Crystallographic Information File browser    Powered by zincr within Tanzer
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      This Crystallographic Information File browser gives acces to the content of the Cif file
      Data are stored in two ways, SimpleKey - value, or LoopKeys whith lists of values.
      
      First select a Cif file
            give a CifEntry (ie 1qru) it will be dowloaded from  https://files.rcsb.org/download/1qru.cif"
         or get existing files from the server
         or upload a cif file from your computer
      
      Some relevant data are automatically displayed on the main page
      In the left part of the page click on a GlobalKey, a SimpleKey or a LoopKey with subkey 

      Get help about available Cif functions with Cif Help, CifAsym Help, CifEntity Help, etc
      All these functions can be called in command line mode
          or from any other program querying gscope directly
          or through the CafeDesScience (qds Zero Cif Help)
          or as webservice (see Cif Help)
          

      See the 3d structure with the Ngl button
      
      Raymond
      
To get a Cif file :    Give a cif entry    or    Get a file from the server Get a file from the server and press    or    Upload your file Upload your file : first then select the server directory and ... current Cif store/synthetases/6KBF.cif


see global keys
Cif Help Cif File Value Cif Text Cif ValuesOf SimpleKeys Cif ListOf Key Cif ListOf SimpleKey Cif ListOf SimpleKeyClass Cif ListOf LoopKey Cif ListOf LoopKeyClass Cif AsymAndEntities Cif _entity ListOfLines CifEntity CifEntity Help CifEntity 2 _entity pdbx_description CifEntity 2 Sequence CifEx Help CifAsym Help CifAsym ListOf LabelAuth CifAsym ListOf Label CifAsym L Auth CifAsym A Label CifAsym Auth_A _entity.id
see simple Cif keys
Cif _entry.id Cif _audit_conform.dict_name Cif _audit_conform.dict_version Cif _audit_conform.dict_location Cif _pdbx_database_status.status_code Cif _pdbx_database_status.status_code_sf Cif _pdbx_database_status.status_code_mr Cif _pdbx_database_status.entry_id Cif _pdbx_database_status.recvd_initial_deposition_date Cif _pdbx_database_status.SG_entry Cif _pdbx_database_status.deposit_site Cif _pdbx_database_status.process_site Cif _pdbx_database_status.status_code_cs Cif _pdbx_database_status.methods_development_category Cif _pdbx_database_status.pdb_format_compatible Cif _citation.abstract Cif _citation.abstract_id_CAS Cif _citation.book_id_ISBN Cif _citation.book_publisher Cif _citation.book_publisher_city Cif _citation.book_title Cif _citation.coordinate_linkage Cif _citation.country Cif _citation.database_id_Medline Cif _citation.details Cif _citation.id Cif _citation.journal_abbrev Cif _citation.journal_id_ASTM Cif _citation.journal_id_CSD Cif _citation.journal_id_ISSN Cif _citation.journal_full Cif _citation.journal_issue Cif _citation.journal_volume Cif _citation.language Cif _citation.page_first Cif _citation.page_last Cif _citation.title Cif _citation.year Cif _citation.database_id_CSD Cif _citation.pdbx_database_id_DOI Cif _citation.pdbx_database_id_PubMed Cif _citation.unpublished_flag Cif _cell.angle_alpha Cif _cell.angle_alpha_esd Cif _cell.angle_beta Cif _cell.angle_beta_esd Cif _cell.angle_gamma Cif _cell.angle_gamma_esd Cif _cell.entry_id Cif _cell.details Cif _cell.formula_units_Z Cif _cell.length_a Cif _cell.length_a_esd Cif _cell.length_b Cif _cell.length_b_esd Cif _cell.length_c Cif _cell.length_c_esd Cif _cell.volume Cif _cell.volume_esd Cif _cell.Z_PDB Cif _cell.reciprocal_angle_alpha Cif _cell.reciprocal_angle_beta Cif _cell.reciprocal_angle_gamma Cif _cell.reciprocal_angle_alpha_esd Cif _cell.reciprocal_angle_beta_esd Cif _cell.reciprocal_angle_gamma_esd Cif _cell.reciprocal_length_a Cif _cell.reciprocal_length_b Cif _cell.reciprocal_length_c Cif _cell.reciprocal_length_a_esd Cif _cell.reciprocal_length_b_esd Cif _cell.reciprocal_length_c_esd Cif _cell.pdbx_unique_axis Cif _symmetry.entry_id Cif _symmetry.cell_setting Cif _symmetry.Int_Tables_number Cif _symmetry.space_group_name_Hall Cif _symmetry.space_group_name_H-M Cif _symmetry.pdbx_full_space_group_name_H-M Cif _entity_name_com.entity_id Cif _entity_name_com.name Cif _entity_poly.entity_id Cif _entity_poly.type Cif _entity_poly.nstd_linkage Cif _entity_poly.nstd_monomer Cif _entity_poly.pdbx_seq_one_letter_code Cif _entity_poly.pdbx_seq_one_letter_code_can Cif _entity_poly.pdbx_strand_id Cif _entity_poly.pdbx_target_identifier Cif _entity_src_gen.entity_id Cif _entity_src_gen.pdbx_src_id Cif _entity_src_gen.pdbx_alt_source_flag Cif _entity_src_gen.pdbx_seq_type Cif _entity_src_gen.pdbx_beg_seq_num Cif _entity_src_gen.pdbx_end_seq_num Cif _entity_src_gen.gene_src_common_name Cif _entity_src_gen.gene_src_genus Cif _entity_src_gen.pdbx_gene_src_gene Cif _entity_src_gen.gene_src_species Cif _entity_src_gen.gene_src_strain Cif _entity_src_gen.gene_src_tissue Cif _entity_src_gen.gene_src_tissue_fraction Cif _entity_src_gen.gene_src_details Cif _entity_src_gen.pdbx_gene_src_fragment Cif _entity_src_gen.pdbx_gene_src_scientific_name Cif _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id Cif _entity_src_gen.pdbx_gene_src_variant Cif _entity_src_gen.pdbx_gene_src_cell_line Cif _entity_src_gen.pdbx_gene_src_atcc Cif _entity_src_gen.pdbx_gene_src_organ Cif _entity_src_gen.pdbx_gene_src_organelle Cif _entity_src_gen.pdbx_gene_src_cell Cif _entity_src_gen.pdbx_gene_src_cellular_location Cif _entity_src_gen.host_org_common_name Cif _entity_src_gen.pdbx_host_org_scientific_name Cif _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id Cif _entity_src_gen.host_org_genus Cif _entity_src_gen.pdbx_host_org_gene Cif _entity_src_gen.pdbx_host_org_organ Cif _entity_src_gen.host_org_species Cif _entity_src_gen.pdbx_host_org_tissue Cif _entity_src_gen.pdbx_host_org_tissue_fraction Cif _entity_src_gen.pdbx_host_org_strain Cif _entity_src_gen.pdbx_host_org_variant Cif _entity_src_gen.pdbx_host_org_cell_line Cif _entity_src_gen.pdbx_host_org_atcc Cif _entity_src_gen.pdbx_host_org_culture_collection Cif _entity_src_gen.pdbx_host_org_cell Cif _entity_src_gen.pdbx_host_org_organelle Cif _entity_src_gen.pdbx_host_org_cellular_location Cif _entity_src_gen.pdbx_host_org_vector_type Cif _entity_src_gen.pdbx_host_org_vector Cif _entity_src_gen.host_org_details Cif _entity_src_gen.expression_system_id Cif _entity_src_gen.plasmid_name Cif _entity_src_gen.plasmid_details Cif _entity_src_gen.pdbx_description Cif _struct_ref.id Cif _struct_ref.db_name Cif _struct_ref.db_code Cif _struct_ref.pdbx_db_accession Cif _struct_ref.pdbx_db_isoform Cif _struct_ref.entity_id Cif _struct_ref.pdbx_seq_one_letter_code Cif _struct_ref.pdbx_align_begin Cif _exptl.absorpt_coefficient_mu Cif _exptl.absorpt_correction_T_max Cif _exptl.absorpt_correction_T_min Cif _exptl.absorpt_correction_type Cif _exptl.absorpt_process_details Cif _exptl.entry_id Cif _exptl.crystals_number Cif _exptl.details Cif _exptl.method Cif _exptl.method_details Cif _exptl_crystal.colour Cif _exptl_crystal.density_diffrn Cif _exptl_crystal.density_Matthews Cif _exptl_crystal.density_method Cif _exptl_crystal.density_percent_sol Cif _exptl_crystal.description Cif _exptl_crystal.F_000 Cif _exptl_crystal.id Cif _exptl_crystal.preparation Cif _exptl_crystal.size_max Cif _exptl_crystal.size_mid Cif _exptl_crystal.size_min Cif _exptl_crystal.size_rad Cif _exptl_crystal.colour_lustre Cif _exptl_crystal.colour_modifier Cif _exptl_crystal.colour_primary Cif _exptl_crystal.density_meas Cif _exptl_crystal.density_meas_esd Cif _exptl_crystal.density_meas_gt Cif _exptl_crystal.density_meas_lt Cif _exptl_crystal.density_meas_temp Cif _exptl_crystal.density_meas_temp_esd Cif _exptl_crystal.density_meas_temp_gt Cif _exptl_crystal.density_meas_temp_lt Cif _exptl_crystal.pdbx_crystal_image_url Cif _exptl_crystal.pdbx_crystal_image_format Cif _exptl_crystal.pdbx_mosaicity Cif _exptl_crystal.pdbx_mosaicity_esd Cif _exptl_crystal_grow.apparatus Cif _exptl_crystal_grow.atmosphere Cif _exptl_crystal_grow.crystal_id Cif _exptl_crystal_grow.details Cif _exptl_crystal_grow.method Cif _exptl_crystal_grow.method_ref Cif _exptl_crystal_grow.pH Cif _exptl_crystal_grow.pressure Cif _exptl_crystal_grow.pressure_esd Cif _exptl_crystal_grow.seeding Cif _exptl_crystal_grow.seeding_ref Cif _exptl_crystal_grow.temp Cif _exptl_crystal_grow.temp_details Cif _exptl_crystal_grow.temp_esd Cif _exptl_crystal_grow.time Cif _exptl_crystal_grow.pdbx_details Cif _exptl_crystal_grow.pdbx_pH_range Cif _diffrn.ambient_environment Cif _diffrn.ambient_temp Cif _diffrn.ambient_temp_details Cif _diffrn.ambient_temp_esd Cif _diffrn.crystal_id Cif _diffrn.crystal_support Cif _diffrn.crystal_treatment Cif _diffrn.details Cif _diffrn.id Cif _diffrn.ambient_pressure Cif _diffrn.ambient_pressure_esd Cif _diffrn.ambient_pressure_gt Cif _diffrn.ambient_pressure_lt Cif _diffrn.ambient_temp_gt Cif _diffrn.ambient_temp_lt Cif _diffrn.pdbx_serial_crystal_experiment Cif _diffrn_detector.details Cif _diffrn_detector.detector Cif _diffrn_detector.diffrn_id Cif _diffrn_detector.type Cif _diffrn_detector.area_resol_mean Cif _diffrn_detector.dtime Cif _diffrn_detector.pdbx_frames_total Cif _diffrn_detector.pdbx_collection_time_total Cif _diffrn_detector.pdbx_collection_date Cif _diffrn_detector.pdbx_frequency Cif _diffrn_radiation.collimation Cif _diffrn_radiation.diffrn_id Cif _diffrn_radiation.filter_edge Cif _diffrn_radiation.inhomogeneity Cif _diffrn_radiation.monochromator Cif _diffrn_radiation.polarisn_norm Cif _diffrn_radiation.polarisn_ratio Cif _diffrn_radiation.probe Cif _diffrn_radiation.type Cif _diffrn_radiation.xray_symbol Cif _diffrn_radiation.wavelength_id Cif _diffrn_radiation.pdbx_monochromatic_or_laue_m_l Cif _diffrn_radiation.pdbx_wavelength_list Cif _diffrn_radiation.pdbx_wavelength Cif _diffrn_radiation.pdbx_diffrn_protocol Cif _diffrn_radiation.pdbx_analyzer Cif _diffrn_radiation.pdbx_scattering_type Cif _diffrn_radiation_wavelength.id Cif _diffrn_radiation_wavelength.wavelength Cif _diffrn_radiation_wavelength.wt Cif _diffrn_source.current Cif _diffrn_source.details Cif _diffrn_source.diffrn_id Cif _diffrn_source.power Cif _diffrn_source.size Cif _diffrn_source.source Cif _diffrn_source.target Cif _diffrn_source.type Cif _diffrn_source.voltage Cif _diffrn_source.take-off_angle Cif _diffrn_source.pdbx_wavelength_list Cif _diffrn_source.pdbx_wavelength Cif _diffrn_source.pdbx_synchrotron_beamline Cif _diffrn_source.pdbx_synchrotron_site Cif _reflns.B_iso_Wilson_estimate Cif _reflns.entry_id Cif _reflns.data_reduction_details Cif _reflns.data_reduction_method Cif _reflns.d_resolution_high Cif _reflns.d_resolution_low Cif _reflns.details Cif _reflns.limit_h_max Cif _reflns.limit_h_min Cif _reflns.limit_k_max Cif _reflns.limit_k_min Cif _reflns.limit_l_max Cif _reflns.limit_l_min Cif _reflns.number_all Cif _reflns.number_obs Cif _reflns.observed_criterion Cif _reflns.observed_criterion_F_max Cif _reflns.observed_criterion_F_min Cif _reflns.observed_criterion_I_max Cif _reflns.observed_criterion_I_min Cif _reflns.observed_criterion_sigma_F Cif _reflns.observed_criterion_sigma_I Cif _reflns.percent_possible_obs Cif _reflns.R_free_details Cif _reflns.Rmerge_F_all Cif _reflns.Rmerge_F_obs Cif _reflns.Friedel_coverage Cif _reflns.number_gt Cif _reflns.threshold_expression Cif _reflns.pdbx_redundancy Cif _reflns.pdbx_Rmerge_I_obs Cif _reflns.pdbx_Rmerge_I_all Cif _reflns.pdbx_Rsym_value Cif _reflns.pdbx_netI_over_av_sigmaI Cif _reflns.pdbx_netI_over_sigmaI Cif _reflns.pdbx_res_netI_over_av_sigmaI_2 Cif _reflns.pdbx_res_netI_over_sigmaI_2 Cif _reflns.pdbx_chi_squared Cif _reflns.pdbx_scaling_rejects Cif _reflns.pdbx_d_res_high_opt Cif _reflns.pdbx_d_res_low_opt Cif _reflns.pdbx_d_res_opt_method Cif _reflns.phase_calculation_details Cif _reflns.pdbx_Rrim_I_all Cif _reflns.pdbx_Rpim_I_all Cif _reflns.pdbx_d_opt Cif _reflns.pdbx_number_measured_all Cif _reflns.pdbx_diffrn_id Cif _reflns.pdbx_ordinal Cif _reflns.pdbx_CC_half Cif _reflns.pdbx_R_split Cif _refine.ls_hydrogen_treatment Cif _refine.ls_matrix_type Cif _refine.ls_number_constraints Cif _refine.ls_number_parameters Cif _refine.ls_number_reflns_all Cif _refine.ls_number_reflns_obs Cif _refine.ls_number_reflns_R_free Cif _refine.ls_number_reflns_R_work Cif _refine.ls_number_restraints Cif _refine.ls_percent_reflns_obs Cif _refine.ls_percent_reflns_R_free Cif _refine.ls_R_factor_all Cif _refine.ls_R_factor_obs Cif _refine.ls_R_factor_R_free Cif _refine.ls_R_factor_R_free_error Cif _refine.ls_R_factor_R_free_error_details Cif _refine.ls_R_factor_R_work Cif _refine.ls_R_Fsqd_factor_obs Cif _refine.ls_R_I_factor_obs Cif _refine.ls_redundancy_reflns_all Cif _refine.ls_redundancy_reflns_obs Cif _refine.ls_restrained_S_all Cif _refine.ls_restrained_S_obs Cif _refine.ls_shift_over_esd_max Cif _refine.ls_shift_over_esd_mean Cif _refine.ls_structure_factor_coef Cif _refine.ls_weighting_details Cif _refine.ls_weighting_scheme Cif _refine.ls_wR_factor_all Cif _refine.ls_wR_factor_obs Cif _refine.ls_wR_factor_R_free Cif _refine.ls_wR_factor_R_work Cif _refine.occupancy_max Cif _refine.occupancy_min Cif _refine.solvent_model_details Cif _refine.solvent_model_param_bsol Cif _refine.solvent_model_param_ksol Cif _refine.ls_R_factor_gt Cif _refine.ls_goodness_of_fit_gt Cif _refine.ls_goodness_of_fit_ref Cif _refine.ls_shift_over_su_max Cif _refine.ls_shift_over_su_max_lt Cif _refine.ls_shift_over_su_mean Cif _refine.ls_shift_over_su_mean_lt Cif _refine.pdbx_ls_sigma_I Cif _refine.pdbx_ls_sigma_F Cif _refine.pdbx_ls_sigma_Fsqd Cif _refine.pdbx_data_cutoff_high_absF Cif _refine.pdbx_data_cutoff_high_rms_absF Cif _refine.pdbx_data_cutoff_low_absF Cif _refine.pdbx_isotropic_thermal_model Cif _refine.pdbx_ls_cross_valid_method Cif _refine.pdbx_method_to_determine_struct Cif _refine.pdbx_starting_model Cif _refine.pdbx_stereochemistry_target_values Cif _refine.pdbx_R_Free_selection_details Cif _refine.pdbx_stereochem_target_val_spec_case Cif _refine.pdbx_overall_ESU_R Cif _refine.pdbx_overall_ESU_R_Free Cif _refine.pdbx_solvent_vdw_probe_radii Cif _refine.pdbx_solvent_ion_probe_radii Cif _refine.pdbx_solvent_shrinkage_radii Cif _refine.pdbx_real_space_R Cif _refine.pdbx_density_correlation Cif _refine.pdbx_pd_number_of_powder_patterns Cif _refine.pdbx_pd_number_of_points Cif _refine.pdbx_pd_meas_number_of_points Cif _refine.pdbx_pd_proc_ls_prof_R_factor Cif _refine.pdbx_pd_proc_ls_prof_wR_factor Cif _refine.pdbx_pd_Marquardt_correlation_coeff Cif _refine.pdbx_pd_Fsqrd_R_factor Cif _refine.pdbx_pd_ls_matrix_band_width Cif _refine.pdbx_overall_phase_error Cif _refine.pdbx_overall_SU_R_free_Cruickshank_DPI Cif _refine.pdbx_overall_SU_R_free_Blow_DPI Cif _refine.pdbx_overall_SU_R_Blow_DPI Cif _refine.pdbx_TLS_residual_ADP_flag Cif _refine.pdbx_diffrn_id Cif _refine.overall_SU_B Cif _refine.overall_SU_ML Cif _refine.overall_SU_R_Cruickshank_DPI Cif _refine.overall_SU_R_free Cif _refine.overall_FOM_free_R_set Cif _refine.overall_FOM_work_R_set Cif _refine.pdbx_average_fsc_overall Cif _refine.pdbx_average_fsc_work Cif _refine.pdbx_average_fsc_free Cif _refine_hist.pdbx_refine_id Cif _refine_hist.cycle_id Cif _refine_hist.details Cif _refine_hist.d_res_high Cif _refine_hist.d_res_low Cif _refine_hist.number_atoms_solvent Cif _refine_hist.number_atoms_total Cif _refine_hist.number_reflns_all Cif _refine_hist.number_reflns_obs Cif _refine_hist.number_reflns_R_free Cif _refine_hist.number_reflns_R_work Cif _refine_hist.R_factor_all Cif _refine_hist.R_factor_obs Cif _refine_hist.R_factor_R_free Cif _refine_hist.R_factor_R_work Cif _refine_hist.pdbx_number_residues_total Cif _refine_hist.pdbx_B_iso_mean_ligand Cif _refine_hist.pdbx_B_iso_mean_solvent Cif _refine_hist.pdbx_number_atoms_protein Cif _refine_hist.pdbx_number_atoms_nucleic_acid Cif _refine_hist.pdbx_number_atoms_ligand Cif _refine_hist.pdbx_number_atoms_lipid Cif _refine_hist.pdbx_number_atoms_carb Cif _refine_hist.pdbx_pseudo_atom_details Cif _struct.entry_id Cif _struct.title Cif _struct.pdbx_descriptor Cif _struct.pdbx_model_details Cif _struct.pdbx_formula_weight Cif _struct.pdbx_formula_weight_method Cif _struct.pdbx_model_type_details Cif _struct.pdbx_CASP_flag Cif _struct_keywords.entry_id Cif _struct_keywords.text Cif _struct_keywords.pdbx_keywords Cif _struct_conf_type.id Cif _struct_conf_type.criteria Cif _struct_conf_type.reference Cif _atom_sites.entry_id Cif _atom_sites.solution_primary Cif _atom_sites.solution_secondary Cif _atom_sites.solution_hydrogens Cif _atom_sites.special_details Cif _atom_site_anisotrop.pdbx_auth_asym_id Cif _pdbx_struct_assembly.id Cif _pdbx_struct_assembly.details Cif _pdbx_struct_assembly.method_details Cif _pdbx_struct_assembly.oligomeric_details Cif _pdbx_struct_assembly.oligomeric_count Cif _pdbx_struct_assembly_gen.assembly_id Cif _pdbx_struct_assembly_gen.oper_expression Cif _pdbx_struct_assembly_gen.asym_id_list Cif _pdbx_struct_oper_list.id Cif _pdbx_struct_oper_list.type Cif _pdbx_struct_oper_list.name Cif _pdbx_struct_oper_list.symmetry_operation Cif _pdbx_audit_revision_details.ordinal Cif _pdbx_audit_revision_details.revision_ordinal Cif _pdbx_audit_revision_details.data_content_type Cif _pdbx_audit_revision_details.provider Cif _pdbx_audit_revision_details.type Cif _pdbx_audit_revision_details.description Cif _pdbx_audit_revision_details.details Cif _pdbx_audit_revision_group.ordinal Cif _pdbx_audit_revision_group.revision_ordinal Cif _pdbx_audit_revision_group.data_content_type Cif _pdbx_audit_revision_group.group Cif _pdbx_refine_tls.id Cif _pdbx_refine_tls.pdbx_refine_id Cif _pdbx_refine_tls.details Cif _pdbx_refine_tls.method Cif _pdbx_refine_tls.origin_x Cif _pdbx_refine_tls.origin_y Cif _pdbx_refine_tls.origin_z Cif _pdbx_entry_details.entry_id Cif _pdbx_entry_details.has_ligand_of_interest Cif _pdbx_entry_details.compound_details Cif _pdbx_entry_details.source_details Cif _pdbx_entry_details.nonpolymer_details Cif _pdbx_entry_details.sequence_details Cif _pdbx_audit_support.funding_organization Cif _pdbx_audit_support.country Cif _pdbx_audit_support.grant_number Cif _pdbx_audit_support.ordinal Cif _pdbx_entity_instance_feature.ordinal Cif _pdbx_entity_instance_feature.comp_id Cif _pdbx_entity_instance_feature.asym_id Cif _pdbx_entity_instance_feature.seq_num Cif _pdbx_entity_instance_feature.auth_comp_id Cif _pdbx_entity_instance_feature.auth_asym_id Cif _pdbx_entity_instance_feature.auth_seq_num Cif _pdbx_entity_instance_feature.feature_type Cif _pdbx_entity_instance_feature.details Cif _pdbx_struct_assembly_auth_evidence.id Cif _pdbx_struct_assembly_auth_evidence.assembly_id Cif _pdbx_struct_assembly_auth_evidence.experimental_support Cif _pdbx_struct_assembly_auth_evidence.details
see Loop Cif keys
0 Cif _database_2 LoopLength = 2 0 Cif _database_2 ListOfLines 0 Cif _database_2.database_id 0 Cif _database_2.database_code 1 Cif _audit_author LoopLength = 2 1 Cif _audit_author ListOfLines 1 Cif _audit_author.name 1 Cif _audit_author.pdbx_ordinal 1 Cif _audit_author.identifier_ORCID 2 Cif _citation_author LoopLength = 7 2 Cif _citation_author ListOfLines 2 Cif _citation_author.citation_id 2 Cif _citation_author.name 2 Cif _citation_author.ordinal 2 Cif _citation_author.identifier_ORCID 3 Cif _entity LoopLength = 6 3 Cif _entity ListOfLines 3 Cif _entity.id 3 Cif _entity.type 3 Cif _entity.src_method 3 Cif _entity.pdbx_description 3 Cif _entity.formula_weight 3 Cif _entity.pdbx_number_of_molecules 3 Cif _entity.pdbx_ec 3 Cif _entity.pdbx_mutation 3 Cif _entity.pdbx_fragment 3 Cif _entity.details 4 Cif _entity_poly_seq LoopLength = 516 4 Cif _entity_poly_seq ListOfLines 4 Cif _entity_poly_seq.entity_id 4 Cif _entity_poly_seq.num 4 Cif _entity_poly_seq.mon_id 4 Cif _entity_poly_seq.hetero 5 Cif _struct_ref_seq LoopLength = 2 5 Cif _struct_ref_seq ListOfLines 5 Cif _struct_ref_seq.align_id 5 Cif _struct_ref_seq.ref_id 5 Cif _struct_ref_seq.pdbx_PDB_id_code 5 Cif _struct_ref_seq.pdbx_strand_id 5 Cif _struct_ref_seq.seq_align_beg 5 Cif _struct_ref_seq.pdbx_seq_align_beg_ins_code 5 Cif _struct_ref_seq.seq_align_end 5 Cif _struct_ref_seq.pdbx_seq_align_end_ins_code 5 Cif _struct_ref_seq.pdbx_db_accession 5 Cif _struct_ref_seq.db_align_beg 5 Cif _struct_ref_seq.pdbx_db_align_beg_ins_code 5 Cif _struct_ref_seq.db_align_end 5 Cif _struct_ref_seq.pdbx_db_align_end_ins_code 5 Cif _struct_ref_seq.pdbx_auth_seq_align_beg 5 Cif _struct_ref_seq.pdbx_auth_seq_align_end 6 Cif _struct_ref_seq_dif LoopLength = 18 6 Cif _struct_ref_seq_dif ListOfLines 6 Cif _struct_ref_seq_dif.align_id 6 Cif _struct_ref_seq_dif.pdbx_pdb_id_code 6 Cif _struct_ref_seq_dif.mon_id 6 Cif _struct_ref_seq_dif.pdbx_pdb_strand_id 6 Cif _struct_ref_seq_dif.seq_num 6 Cif _struct_ref_seq_dif.pdbx_pdb_ins_code 6 Cif _struct_ref_seq_dif.pdbx_seq_db_name 6 Cif _struct_ref_seq_dif.pdbx_seq_db_accession_code 6 Cif _struct_ref_seq_dif.db_mon_id 6 Cif _struct_ref_seq_dif.pdbx_seq_db_seq_num 6 Cif _struct_ref_seq_dif.details 6 Cif _struct_ref_seq_dif.pdbx_auth_seq_num 6 Cif _struct_ref_seq_dif.pdbx_ordinal 7 Cif _chem_comp LoopLength = 24 7 Cif _chem_comp ListOfLines 7 Cif _chem_comp.id 7 Cif _chem_comp.type 7 Cif _chem_comp.mon_nstd_flag 7 Cif _chem_comp.name 7 Cif _chem_comp.pdbx_synonyms 7 Cif _chem_comp.formula 7 Cif _chem_comp.formula_weight 8 Cif _reflns_shell LoopLength = 4 8 Cif _reflns_shell ListOfLines 8 Cif _reflns_shell.d_res_high 8 Cif _reflns_shell.d_res_low 8 Cif _reflns_shell.meanI_over_sigI_all 8 Cif _reflns_shell.meanI_over_sigI_obs 8 Cif _reflns_shell.number_measured_all 8 Cif _reflns_shell.number_measured_obs 8 Cif _reflns_shell.number_possible 8 Cif _reflns_shell.number_unique_all 8 Cif _reflns_shell.number_unique_obs 8 Cif _reflns_shell.percent_possible_all 8 Cif _reflns_shell.percent_possible_obs 8 Cif _reflns_shell.Rmerge_F_all 8 Cif _reflns_shell.Rmerge_F_obs 8 Cif _reflns_shell.Rmerge_I_all 8 Cif _reflns_shell.Rmerge_I_obs 8 Cif _reflns_shell.meanI_over_sigI_gt 8 Cif _reflns_shell.meanI_over_uI_all 8 Cif _reflns_shell.meanI_over_uI_gt 8 Cif _reflns_shell.number_measured_gt 8 Cif _reflns_shell.number_unique_gt 8 Cif _reflns_shell.percent_possible_gt 8 Cif _reflns_shell.Rmerge_F_gt 8 Cif _reflns_shell.Rmerge_I_gt 8 Cif _reflns_shell.pdbx_redundancy 8 Cif _reflns_shell.pdbx_Rsym_value 8 Cif _reflns_shell.pdbx_chi_squared 8 Cif _reflns_shell.pdbx_netI_over_sigmaI_all 8 Cif _reflns_shell.pdbx_netI_over_sigmaI_obs 8 Cif _reflns_shell.pdbx_Rrim_I_all 8 Cif _reflns_shell.pdbx_Rpim_I_all 8 Cif _reflns_shell.pdbx_rejects 8 Cif _reflns_shell.pdbx_ordinal 8 Cif _reflns_shell.pdbx_diffrn_id 8 Cif _reflns_shell.pdbx_CC_half 8 Cif _reflns_shell.pdbx_R_split 9 Cif _refine_ls_shell LoopLength = 10 9 Cif _refine_ls_shell ListOfLines 9 Cif _refine_ls_shell.pdbx_refine_id 9 Cif _refine_ls_shell.d_res_high 9 Cif _refine_ls_shell.d_res_low 9 Cif _refine_ls_shell.number_reflns_all 9 Cif _refine_ls_shell.number_reflns_obs 9 Cif _refine_ls_shell.number_reflns_R_free 9 Cif _refine_ls_shell.number_reflns_R_work 9 Cif _refine_ls_shell.percent_reflns_obs 9 Cif _refine_ls_shell.percent_reflns_R_free 9 Cif _refine_ls_shell.R_factor_all 9 Cif _refine_ls_shell.R_factor_obs 9 Cif _refine_ls_shell.R_factor_R_free 9 Cif _refine_ls_shell.R_factor_R_free_error 9 Cif _refine_ls_shell.R_factor_R_work 9 Cif _refine_ls_shell.redundancy_reflns_all 9 Cif _refine_ls_shell.redundancy_reflns_obs 9 Cif _refine_ls_shell.wR_factor_all 9 Cif _refine_ls_shell.wR_factor_obs 9 Cif _refine_ls_shell.wR_factor_R_free 9 Cif _refine_ls_shell.wR_factor_R_work 9 Cif _refine_ls_shell.pdbx_total_number_of_bins_used 9 Cif _refine_ls_shell.pdbx_phase_error 9 Cif _refine_ls_shell.pdbx_fsc_work 9 Cif _refine_ls_shell.pdbx_fsc_free 10 Cif _struct_asym LoopLength = 14 10 Cif _struct_asym ListOfLines 10 Cif _struct_asym.id 10 Cif _struct_asym.pdbx_blank_PDB_chainid_flag 10 Cif _struct_asym.pdbx_modified 10 Cif _struct_asym.entity_id 10 Cif _struct_asym.details 11 Cif _struct_conf LoopLength = 36 11 Cif _struct_conf ListOfLines 11 Cif _struct_conf.conf_type_id 11 Cif _struct_conf.id 11 Cif _struct_conf.pdbx_PDB_helix_id 11 Cif _struct_conf.beg_label_comp_id 11 Cif _struct_conf.beg_label_asym_id 11 Cif _struct_conf.beg_label_seq_id 11 Cif _struct_conf.pdbx_beg_PDB_ins_code 11 Cif _struct_conf.end_label_comp_id 11 Cif _struct_conf.end_label_asym_id 11 Cif _struct_conf.end_label_seq_id 11 Cif _struct_conf.pdbx_end_PDB_ins_code 11 Cif _struct_conf.beg_auth_comp_id 11 Cif _struct_conf.beg_auth_asym_id 11 Cif _struct_conf.beg_auth_seq_id 11 Cif _struct_conf.end_auth_comp_id 11 Cif _struct_conf.end_auth_asym_id 11 Cif _struct_conf.end_auth_seq_id 11 Cif _struct_conf.pdbx_PDB_helix_class 11 Cif _struct_conf.details 11 Cif _struct_conf.pdbx_PDB_helix_length 12 Cif _struct_mon_prot_cis LoopLength = 5 12 Cif _struct_mon_prot_cis ListOfLines 12 Cif _struct_mon_prot_cis.pdbx_id 12 Cif _struct_mon_prot_cis.label_comp_id 12 Cif _struct_mon_prot_cis.label_seq_id 12 Cif _struct_mon_prot_cis.label_asym_id 12 Cif _struct_mon_prot_cis.label_alt_id 12 Cif _struct_mon_prot_cis.pdbx_PDB_ins_code 12 Cif _struct_mon_prot_cis.auth_comp_id 12 Cif _struct_mon_prot_cis.auth_seq_id 12 Cif _struct_mon_prot_cis.auth_asym_id 12 Cif _struct_mon_prot_cis.pdbx_label_comp_id_2 12 Cif _struct_mon_prot_cis.pdbx_label_seq_id_2 12 Cif _struct_mon_prot_cis.pdbx_label_asym_id_2 12 Cif _struct_mon_prot_cis.pdbx_PDB_ins_code_2 12 Cif _struct_mon_prot_cis.pdbx_auth_comp_id_2 12 Cif _struct_mon_prot_cis.pdbx_auth_seq_id_2 12 Cif _struct_mon_prot_cis.pdbx_auth_asym_id_2 12 Cif _struct_mon_prot_cis.pdbx_PDB_model_num 12 Cif _struct_mon_prot_cis.pdbx_omega_angle 13 Cif _struct_sheet LoopLength = 8 13 Cif _struct_sheet ListOfLines 13 Cif _struct_sheet.id 13 Cif _struct_sheet.type 13 Cif _struct_sheet.number_strands 13 Cif _struct_sheet.details 14 Cif _struct_sheet_order LoopLength = 30 14 Cif _struct_sheet_order ListOfLines 14 Cif _struct_sheet_order.sheet_id 14 Cif _struct_sheet_order.range_id_1 14 Cif _struct_sheet_order.range_id_2 14 Cif _struct_sheet_order.offset 14 Cif _struct_sheet_order.sense 15 Cif _struct_sheet_range LoopLength = 38 15 Cif _struct_sheet_range ListOfLines 15 Cif _struct_sheet_range.sheet_id 15 Cif _struct_sheet_range.id 15 Cif _struct_sheet_range.beg_label_comp_id 15 Cif _struct_sheet_range.beg_label_asym_id 15 Cif _struct_sheet_range.beg_label_seq_id 15 Cif _struct_sheet_range.pdbx_beg_PDB_ins_code 15 Cif _struct_sheet_range.end_label_comp_id 15 Cif _struct_sheet_range.end_label_asym_id 15 Cif _struct_sheet_range.end_label_seq_id 15 Cif _struct_sheet_range.pdbx_end_PDB_ins_code 15 Cif _struct_sheet_range.beg_auth_comp_id 15 Cif _struct_sheet_range.beg_auth_asym_id 15 Cif _struct_sheet_range.beg_auth_seq_id 15 Cif _struct_sheet_range.end_auth_comp_id 15 Cif _struct_sheet_range.end_auth_asym_id 15 Cif _struct_sheet_range.end_auth_seq_id 16 Cif _pdbx_struct_sheet_hbond LoopLength = 30 16 Cif _pdbx_struct_sheet_hbond ListOfLines 16 Cif _pdbx_struct_sheet_hbond.sheet_id 16 Cif _pdbx_struct_sheet_hbond.range_id_1 16 Cif _pdbx_struct_sheet_hbond.range_id_2 16 Cif _pdbx_struct_sheet_hbond.range_1_label_atom_id 16 Cif _pdbx_struct_sheet_hbond.range_1_label_comp_id 16 Cif _pdbx_struct_sheet_hbond.range_1_label_asym_id 16 Cif _pdbx_struct_sheet_hbond.range_1_label_seq_id 16 Cif _pdbx_struct_sheet_hbond.range_1_PDB_ins_code 16 Cif _pdbx_struct_sheet_hbond.range_1_auth_atom_id 16 Cif _pdbx_struct_sheet_hbond.range_1_auth_comp_id 16 Cif _pdbx_struct_sheet_hbond.range_1_auth_asym_id 16 Cif _pdbx_struct_sheet_hbond.range_1_auth_seq_id 16 Cif _pdbx_struct_sheet_hbond.range_2_label_atom_id 16 Cif _pdbx_struct_sheet_hbond.range_2_label_comp_id 16 Cif _pdbx_struct_sheet_hbond.range_2_label_asym_id 16 Cif _pdbx_struct_sheet_hbond.range_2_label_seq_id 16 Cif _pdbx_struct_sheet_hbond.range_2_PDB_ins_code 16 Cif _pdbx_struct_sheet_hbond.range_2_auth_atom_id 16 Cif _pdbx_struct_sheet_hbond.range_2_auth_comp_id 16 Cif _pdbx_struct_sheet_hbond.range_2_auth_asym_id 16 Cif _pdbx_struct_sheet_hbond.range_2_auth_seq_id 17 Cif _struct_site LoopLength = 10 17 Cif _struct_site ListOfLines 17 Cif _struct_site.id 17 Cif _struct_site.pdbx_evidence_code 17 Cif _struct_site.pdbx_auth_asym_id 17 Cif _struct_site.pdbx_auth_comp_id 17 Cif _struct_site.pdbx_auth_seq_id 17 Cif _struct_site.pdbx_auth_ins_code 17 Cif _struct_site.pdbx_num_residues 17 Cif _struct_site.details 18 Cif _struct_site_gen LoopLength = 93 18 Cif _struct_site_gen ListOfLines 18 Cif _struct_site_gen.id 18 Cif _struct_site_gen.site_id 18 Cif _struct_site_gen.pdbx_num_res 18 Cif _struct_site_gen.label_comp_id 18 Cif _struct_site_gen.label_asym_id 18 Cif _struct_site_gen.label_seq_id 18 Cif _struct_site_gen.pdbx_auth_ins_code 18 Cif _struct_site_gen.auth_comp_id 18 Cif _struct_site_gen.auth_asym_id 18 Cif _struct_site_gen.auth_seq_id 18 Cif _struct_site_gen.label_atom_id 18 Cif _struct_site_gen.label_alt_id 18 Cif _struct_site_gen.symmetry 18 Cif _struct_site_gen.details 19 Cif _atom_type LoopLength = 4 19 Cif _atom_type ListOfLines 19 Cif _atom_type.symbol 20 Cif _atom_site LoopLength = 8696 20 Cif _atom_site ListOfLines 20 Cif _atom_site.group_PDB 20 Cif _atom_site.id 20 Cif _atom_site.type_symbol 20 Cif _atom_site.label_atom_id 20 Cif _atom_site.label_alt_id 20 Cif _atom_site.label_comp_id 20 Cif _atom_site.label_asym_id 20 Cif _atom_site.label_entity_id 20 Cif _atom_site.label_seq_id 20 Cif _atom_site.pdbx_PDB_ins_code 20 Cif _atom_site.Cartn_x 20 Cif _atom_site.Cartn_y 20 Cif _atom_site.Cartn_z 20 Cif _atom_site.occupancy 20 Cif _atom_site.B_iso_or_equiv 20 Cif _atom_site.pdbx_formal_charge 20 Cif _atom_site.auth_seq_id 20 Cif _atom_site.auth_comp_id 20 Cif _atom_site.auth_asym_id 20 Cif _atom_site.auth_atom_id 20 Cif _atom_site.pdbx_PDB_model_num 21 Cif _atom_site_anisotrop LoopLength = 1 21 Cif _atom_site_anisotrop ListOfLines 21 Cif _atom_site_anisotrop.id 21 Cif _atom_site_anisotrop.type_symbol 21 Cif _atom_site_anisotrop.pdbx_label_atom_id 21 Cif _atom_site_anisotrop.pdbx_label_alt_id 21 Cif _atom_site_anisotrop.pdbx_label_comp_id 21 Cif _atom_site_anisotrop.pdbx_label_asym_id 21 Cif _atom_site_anisotrop.pdbx_label_seq_id 21 Cif _atom_site_anisotrop.pdbx_PDB_ins_code 22 Cif _pdbx_poly_seq_scheme LoopLength = 1032 22 Cif _pdbx_poly_seq_scheme ListOfLines 22 Cif _pdbx_poly_seq_scheme.asym_id 22 Cif _pdbx_poly_seq_scheme.entity_id 22 Cif _pdbx_poly_seq_scheme.seq_id 22 Cif _pdbx_poly_seq_scheme.mon_id 22 Cif _pdbx_poly_seq_scheme.ndb_seq_num 22 Cif _pdbx_poly_seq_scheme.pdb_seq_num 22 Cif _pdbx_poly_seq_scheme.auth_seq_num 22 Cif _pdbx_poly_seq_scheme.pdb_mon_id 22 Cif _pdbx_poly_seq_scheme.auth_mon_id 22 Cif _pdbx_poly_seq_scheme.pdb_strand_id 22 Cif _pdbx_poly_seq_scheme.pdb_ins_code 22 Cif _pdbx_poly_seq_scheme.hetero 23 Cif _pdbx_nonpoly_scheme LoopLength = 670 23 Cif _pdbx_nonpoly_scheme ListOfLines 23 Cif _pdbx_nonpoly_scheme.asym_id 23 Cif _pdbx_nonpoly_scheme.entity_id 23 Cif _pdbx_nonpoly_scheme.mon_id 23 Cif _pdbx_nonpoly_scheme.ndb_seq_num 23 Cif _pdbx_nonpoly_scheme.pdb_seq_num 23 Cif _pdbx_nonpoly_scheme.auth_seq_num 23 Cif _pdbx_nonpoly_scheme.pdb_mon_id 23 Cif _pdbx_nonpoly_scheme.auth_mon_id 23 Cif _pdbx_nonpoly_scheme.pdb_strand_id 23 Cif _pdbx_nonpoly_scheme.pdb_ins_code 24 Cif _pdbx_struct_assembly_prop LoopLength = 3 24 Cif _pdbx_struct_assembly_prop ListOfLines 24 Cif _pdbx_struct_assembly_prop.biol_id 24 Cif _pdbx_struct_assembly_prop.type 24 Cif _pdbx_struct_assembly_prop.value 24 Cif _pdbx_struct_assembly_prop.details 25 Cif _pdbx_audit_revision_history LoopLength = 2 25 Cif _pdbx_audit_revision_history ListOfLines 25 Cif _pdbx_audit_revision_history.ordinal 25 Cif _pdbx_audit_revision_history.data_content_type 25 Cif _pdbx_audit_revision_history.major_revision 25 Cif _pdbx_audit_revision_history.minor_revision 25 Cif _pdbx_audit_revision_history.revision_date 26 Cif _pdbx_audit_revision_category LoopLength = 2 26 Cif _pdbx_audit_revision_category ListOfLines 26 Cif _pdbx_audit_revision_category.ordinal 26 Cif _pdbx_audit_revision_category.revision_ordinal 26 Cif _pdbx_audit_revision_category.data_content_type 26 Cif _pdbx_audit_revision_category.category 27 Cif _pdbx_audit_revision_item LoopLength = 4 27 Cif _pdbx_audit_revision_item ListOfLines 27 Cif _pdbx_audit_revision_item.ordinal 27 Cif _pdbx_audit_revision_item.revision_ordinal 27 Cif _pdbx_audit_revision_item.data_content_type 27 Cif _pdbx_audit_revision_item.item 28 Cif _pdbx_refine_tls_group LoopLength = 8 28 Cif _pdbx_refine_tls_group ListOfLines 28 Cif _pdbx_refine_tls_group.id 28 Cif _pdbx_refine_tls_group.pdbx_refine_id 28 Cif _pdbx_refine_tls_group.refine_tls_id 28 Cif _pdbx_refine_tls_group.beg_label_asym_id 28 Cif _pdbx_refine_tls_group.beg_label_seq_id 28 Cif _pdbx_refine_tls_group.beg_auth_asym_id 28 Cif _pdbx_refine_tls_group.beg_auth_seq_id 28 Cif _pdbx_refine_tls_group.end_label_asym_id 28 Cif _pdbx_refine_tls_group.end_label_seq_id 28 Cif _pdbx_refine_tls_group.end_auth_asym_id 28 Cif _pdbx_refine_tls_group.end_auth_seq_id 28 Cif _pdbx_refine_tls_group.selection 28 Cif _pdbx_refine_tls_group.selection_details 29 Cif _software LoopLength = 5 29 Cif _software ListOfLines 29 Cif _software.citation_id 29 Cif _software.classification 29 Cif _software.compiler_name 29 Cif _software.compiler_version 29 Cif _software.contact_author 29 Cif _software.contact_author_email 29 Cif _software.date 29 Cif _software.description 29 Cif _software.dependencies 29 Cif _software.hardware 29 Cif _software.language 29 Cif _software.location 29 Cif _software.mods 29 Cif _software.name 29 Cif _software.os 29 Cif _software.os_version 29 Cif _software.type 29 Cif _software.version 29 Cif _software.pdbx_ordinal 30 Cif _pdbx_validate_torsion LoopLength = 7 30 Cif _pdbx_validate_torsion ListOfLines 30 Cif _pdbx_validate_torsion.id 30 Cif _pdbx_validate_torsion.PDB_model_num 30 Cif _pdbx_validate_torsion.auth_comp_id 30 Cif _pdbx_validate_torsion.auth_asym_id 30 Cif _pdbx_validate_torsion.auth_seq_id 30 Cif _pdbx_validate_torsion.PDB_ins_code 30 Cif _pdbx_validate_torsion.label_alt_id 30 Cif _pdbx_validate_torsion.phi 30 Cif _pdbx_validate_torsion.psi 31 Cif _pdbx_distant_solvent_atoms LoopLength = 2 31 Cif _pdbx_distant_solvent_atoms ListOfLines 31 Cif _pdbx_distant_solvent_atoms.id 31 Cif _pdbx_distant_solvent_atoms.PDB_model_num 31 Cif _pdbx_distant_solvent_atoms.auth_atom_id 31 Cif _pdbx_distant_solvent_atoms.label_alt_id 31 Cif _pdbx_distant_solvent_atoms.auth_asym_id 31 Cif _pdbx_distant_solvent_atoms.auth_comp_id 31 Cif _pdbx_distant_solvent_atoms.auth_seq_id 31 Cif _pdbx_distant_solvent_atoms.PDB_ins_code 31 Cif _pdbx_distant_solvent_atoms.neighbor_macromolecule_distance 31 Cif _pdbx_distant_solvent_atoms.neighbor_ligand_distance 32 Cif _pdbx_unobs_or_zero_occ_atoms LoopLength = 316 32 Cif _pdbx_unobs_or_zero_occ_atoms ListOfLines 32 Cif _pdbx_unobs_or_zero_occ_atoms.id 32 Cif _pdbx_unobs_or_zero_occ_atoms.PDB_model_num 32 Cif _pdbx_unobs_or_zero_occ_atoms.polymer_flag 32 Cif _pdbx_unobs_or_zero_occ_atoms.occupancy_flag 32 Cif _pdbx_unobs_or_zero_occ_atoms.auth_asym_id 32 Cif _pdbx_unobs_or_zero_occ_atoms.auth_comp_id 32 Cif _pdbx_unobs_or_zero_occ_atoms.auth_seq_id 32 Cif _pdbx_unobs_or_zero_occ_atoms.PDB_ins_code 32 Cif _pdbx_unobs_or_zero_occ_atoms.auth_atom_id 32 Cif _pdbx_unobs_or_zero_occ_atoms.label_alt_id 32 Cif _pdbx_unobs_or_zero_occ_atoms.label_asym_id 32 Cif _pdbx_unobs_or_zero_occ_atoms.label_comp_id 32 Cif _pdbx_unobs_or_zero_occ_atoms.label_seq_id 32 Cif _pdbx_unobs_or_zero_occ_atoms.label_atom_id 33 Cif _pdbx_unobs_or_zero_occ_residues LoopLength = 25 33 Cif _pdbx_unobs_or_zero_occ_residues ListOfLines 33 Cif _pdbx_unobs_or_zero_occ_residues.id 33 Cif _pdbx_unobs_or_zero_occ_residues.PDB_model_num 33 Cif _pdbx_unobs_or_zero_occ_residues.polymer_flag 33 Cif _pdbx_unobs_or_zero_occ_residues.occupancy_flag 33 Cif _pdbx_unobs_or_zero_occ_residues.auth_asym_id 33 Cif _pdbx_unobs_or_zero_occ_residues.auth_comp_id 33 Cif _pdbx_unobs_or_zero_occ_residues.auth_seq_id 33 Cif _pdbx_unobs_or_zero_occ_residues.PDB_ins_code 33 Cif _pdbx_unobs_or_zero_occ_residues.label_asym_id 33 Cif _pdbx_unobs_or_zero_occ_residues.label_comp_id 33 Cif _pdbx_unobs_or_zero_occ_residues.label_seq_id 34 Cif _pdbx_entity_nonpoly LoopLength = 5 34 Cif _pdbx_entity_nonpoly ListOfLines 34 Cif _pdbx_entity_nonpoly.entity_id 34 Cif _pdbx_entity_nonpoly.name 34 Cif _pdbx_entity_nonpoly.comp_id
store/synthetases/6KBF.cif Crystal structure of plasmodium lysyl-tRNA synthetase in complex with a cladosporin derivative 3 About organisms entity 1 gene_src_taxid 5843 gene_src_Name Plasmodium falciparum (isolate NF54) pdbx_org_TaxId 562 pdbx_org_Name Escherichia coli entity 1 gene_host_taxid 562 gene_host_Name Escherichia coli pdbx_org_TaxId 562 pdbx_org_Name Escherichia coli LabAsym AutAsym Entity A A 1 polymer man Lysine--tRNA B B 1 polymer man Lysine--tRNA C A 2 non-polymer syn LYSINE D A 3 non-polymer syn {(3~{S})-3-[[(1~{S},3~{S})-3-methylcyclohexyl]methyl]-6,8-bis(oxidanyl)-3,4-dihydro-2~{H}-isoquinolin-1-one} E A 4 non-polymer syn GLYCEROL F A 4 non-polymer syn GLYCEROL G A 4 non-polymer syn GLYCEROL H B 2 non-polymer syn LYSINE I B 3 non-polymer syn {(3~{S})-3-[[(1~{S},3~{S})-3-methylcyclohexyl]methyl]-6,8-bis(oxidanyl)-3,4-dihydro-2~{H}-isoquinolin-1-one} J B 4 non-polymer syn GLYCEROL K B 4 non-polymer syn GLYCEROL L B 5 non-polymer syn DIMETHYL M A 6 water nat water N B 6 water nat water ValuesOf SimpleKeys _entry.id 6KBF _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.324 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic _pdbx_database_status.status_code REL _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.entry_id 6KBF _pdbx_database_status.recvd_initial_deposition_date 2019-06-24 _pdbx_database_status.SG_entry N _pdbx_database_status.deposit_site PDBJ _pdbx_database_status.process_site PDBJ _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? _pdbx_database_status.pdb_format_compatible Y _citation.abstract ? _citation.abstract_id_CAS ? _citation.book_id_ISBN ? _citation.book_publisher ? _citation.book_publisher_city ? _citation.book_title ? _citation.coordinate_linkage ? _citation.country US _citation.database_id_Medline ? _citation.details ? _citation.id primary _citation.journal_abbrev Acs Chem.Biol. _citation.journal_id_ASTM ? _citation.journal_id_CSD ? _citation.journal_id_ISSN 1554-8937 _citation.journal_full ? _citation.journal_issue ? _citation.journal_volume 15 _citation.language ? _citation.page_first 1016 _citation.page_last 1025 _citation.title Atomic Resolution Analyses of Isocoumarin Derivatives for Inhibition of Lysyl-tRNA Synthetase. _citation.year 2020 _citation.database_id_CSD ? _citation.pdbx_database_id_DOI 10.1021/acschembio.0c00032 _citation.pdbx_database_id_PubMed 32195573 _citation.unpublished_flag ? _cell.angle_alpha 90.000 _cell.angle_alpha_esd ? _cell.angle_beta 111.450 _cell.angle_beta_esd ? _cell.angle_gamma 90.000 _cell.angle_gamma_esd ? _cell.entry_id 6KBF _cell.details ? _cell.formula_units_Z ? _cell.length_a 87.932 _cell.length_a_esd ? _cell.length_b 70.822 _cell.length_b_esd ? _cell.length_c 101.125 _cell.length_c_esd ? _cell.volume ? _cell.volume_esd ? _cell.Z_PDB 4 _cell.reciprocal_angle_alpha ? _cell.reciprocal_angle_beta ? _cell.reciprocal_angle_gamma ? _cell.reciprocal_angle_alpha_esd ? _cell.reciprocal_angle_beta_esd ? _cell.reciprocal_angle_gamma_esd ? _cell.reciprocal_length_a ? _cell.reciprocal_length_b ? _cell.reciprocal_length_c ? _cell.reciprocal_length_a_esd ? _cell.reciprocal_length_b_esd ? _cell.reciprocal_length_c_esd ? _cell.pdbx_unique_axis ? _symmetry.entry_id 6KBF _symmetry.cell_setting ? _symmetry.Int_Tables_number 4 _symmetry.space_group_name_Hall ? _symmetry.space_group_name_H-M P 1 21 1 _symmetry.pdbx_full_space_group_name_H-M ? _entity_name_com.entity_id 1 _entity_name_com.name Lysyl-tRNA synthetase _entity_poly.entity_id 1 _entity_poly.type polypeptide(L) _entity_poly.nstd_linkage no _entity_poly.nstd_monomer no _entity_poly.pdbx_seq_one_letter_code MEVDPRLYFENRSKFIQDQKDKGINPYPHKFERTISIPEFIEKYKDLGNGEHLEDTILNITGRIMRVSASGQKLRFFDLV GDGEKIQVLANYSFHNHEKGNFAECYDKIRRGDIVGIVGFPGKSKKGELSIFPKETILLSACLHMLPMKYGLKDTEIRYR QRYLDLLINESSRHTFVTRTKIINFLRNFLNERGFFEVETPMMNLIAGGANARPFITHHNDLDLDLYLRIATELPLKMLI VGGIDKVYEIGKVFRNEGIDNTHNPEFTSCEFYWAYADYNDLIKWSEDFFSQLVYHLFGTYKISYNKDGPENQPIEIDFT PPYPKVSIVEEIEKVTNTILEQPFDSNETIEKMINIIKEHKIELPNPPTAAKLLDQLASHFIENKYNDKPFFIVEHPQIM SPLAKYHRTKPGLTERLEMFICGKEVLNAYTELNDPFKQKECFKLQQKDREKGDTEAAQLDSAFCTSLEYGLPPTGGLGL GIDRITMFLTNKNSIKDVILFPTMRPANGGHHHHHH _entity_poly.pdbx_seq_one_letter_code_can MEVDPRLYFENRSKFIQDQKDKGINPYPHKFERTISIPEFIEKYKDLGNGEHLEDTILNITGRIMRVSASGQKLRFFDLV GDGEKIQVLANYSFHNHEKGNFAECYDKIRRGDIVGIVGFPGKSKKGELSIFPKETILLSACLHMLPMKYGLKDTEIRYR QRYLDLLINESSRHTFVTRTKIINFLRNFLNERGFFEVETPMMNLIAGGANARPFITHHNDLDLDLYLRIATELPLKMLI VGGIDKVYEIGKVFRNEGIDNTHNPEFTSCEFYWAYADYNDLIKWSEDFFSQLVYHLFGTYKISYNKDGPENQPIEIDFT PPYPKVSIVEEIEKVTNTILEQPFDSNETIEKMINIIKEHKIELPNPPTAAKLLDQLASHFIENKYNDKPFFIVEHPQIM SPLAKYHRTKPGLTERLEMFICGKEVLNAYTELNDPFKQKECFKLQQKDREKGDTEAAQLDSAFCTSLEYGLPPTGGLGL GIDRITMFLTNKNSIKDVILFPTMRPANGGHHHHHH _entity_poly.pdbx_strand_id A,B _entity_poly.pdbx_target_identifier ? _entity_src_gen.entity_id 1 _entity_src_gen.pdbx_src_id 1 _entity_src_gen.pdbx_alt_source_flag sample _entity_src_gen.pdbx_seq_type Biological sequence _entity_src_gen.pdbx_beg_seq_num 1 _entity_src_gen.pdbx_end_seq_num 516 _entity_src_gen.gene_src_common_name ? _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene PFNF54_04763 _entity_src_gen.gene_src_species ? _entity_src_gen.gene_src_strain isolate NF54 _entity_src_gen.gene_src_tissue ? _entity_src_gen.gene_src_tissue_fraction ? _entity_src_gen.gene_src_details ? _entity_src_gen.pdbx_gene_src_fragment ? _entity_src_gen.pdbx_gene_src_scientific_name Plasmodium falciparum (isolate NF54) _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 5843 _entity_src_gen.pdbx_gene_src_variant ? _entity_src_gen.pdbx_gene_src_cell_line ? _entity_src_gen.pdbx_gene_src_atcc ? _entity_src_gen.pdbx_gene_src_organ ? _entity_src_gen.pdbx_gene_src_organelle ? _entity_src_gen.pdbx_gene_src_cell ? _entity_src_gen.pdbx_gene_src_cellular_location ? _entity_src_gen.host_org_common_name ? _entity_src_gen.pdbx_host_org_scientific_name Escherichia coli _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 562 _entity_src_gen.host_org_genus ? _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain ? _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line ? _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type ? _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name ? _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code W7JP72_PLAFO _struct_ref.pdbx_db_accession W7JP72 _struct_ref.pdbx_db_isoform ? _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code EVDPRLYFENRSKFIQDQKDKGINPYPHKFERTISIPEFIEKYKDLGNGEHLEDTILNITGRIMRVSASGQKLRFFDLVG DGEKIQVLANYSFHNHEKGNFAECYDKIRRGDIVGIVGFPGKSKKGELSIFPKETILLSACLHMLPMKYGLKDTEIRYRQ RYLDLLINESSRHTFVTRTKIINFLRNFLNERGFFEVETPMMNLIAGGANARPFITHHNDLDLDLYLRIATELPLKMLIV GGIDKVYEIGKVFRNEGIDNTHNPEFTSCEFYWAYADYNDLIKWSEDFFSQLVYHLFGTYKISYNKDGPENQPIEIDFTP PYPKVSIVEEIEKVTNTILEQPFDSNETIEKMINIIKEHKIELPNPPTAAKLLDQLASHFIENKYNDKPFFIVEHPQIMS PLAKYHRTKPGLTERLEMFICGKEVLNAYTELNDPFKQKECFKLQQKDREKGDTEAAQLDSAFCTSLEYGLPPTGGLGLG IDRITMFLTNKNSIKDVILFPTMRPAN _struct_ref.pdbx_align_begin 15 _exptl.absorpt_coefficient_mu ? _exptl.absorpt_correction_T_max ? _exptl.absorpt_correction_T_min ? _exptl.absorpt_correction_type ? _exptl.absorpt_process_details ? _exptl.entry_id 6KBF _exptl.crystals_number 1 _exptl.details ? _exptl.method X-RAY DIFFRACTION _exptl.method_details ? _exptl_crystal.colour ? _exptl_crystal.density_diffrn ? _exptl_crystal.density_Matthews 2.45 _exptl_crystal.density_method ? _exptl_crystal.density_percent_sol 49.82 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.id 1 _exptl_crystal.preparation ? _exptl_crystal.size_max ? _exptl_crystal.size_mid ? _exptl_crystal.size_min ? _exptl_crystal.size_rad ? _exptl_crystal.colour_lustre ? _exptl_crystal.colour_modifier ? _exptl_crystal.colour_primary ? _exptl_crystal.density_meas ? _exptl_crystal.density_meas_esd ? _exptl_crystal.density_meas_gt ? _exptl_crystal.density_meas_lt ? _exptl_crystal.density_meas_temp ? _exptl_crystal.density_meas_temp_esd ? _exptl_crystal.density_meas_temp_gt ? _exptl_crystal.density_meas_temp_lt ? _exptl_crystal.pdbx_crystal_image_url ? _exptl_crystal.pdbx_crystal_image_format ? _exptl_crystal.pdbx_mosaicity ? _exptl_crystal.pdbx_mosaicity_esd ? _exptl_crystal_grow.apparatus ? _exptl_crystal_grow.atmosphere ? _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.details ? _exptl_crystal_grow.method VAPOR DIFFUSION, SITTING DROP _exptl_crystal_grow.method_ref ? _exptl_crystal_grow.pH ? _exptl_crystal_grow.pressure ? _exptl_crystal_grow.pressure_esd ? _exptl_crystal_grow.seeding ? _exptl_crystal_grow.seeding_ref ? _exptl_crystal_grow.temp 291 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.temp_esd ? _exptl_crystal_grow.time ? _exptl_crystal_grow.pdbx_details tri-sodium citrate, PEG 3350 _exptl_crystal_grow.pdbx_pH_range ? _diffrn.ambient_environment ? _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.ambient_temp_esd ? _diffrn.crystal_id 1 _diffrn.crystal_support ? _diffrn.crystal_treatment ? _diffrn.details ? _diffrn.id 1 _diffrn.ambient_pressure ? _diffrn.ambient_pressure_esd ? _diffrn.ambient_pressure_gt ? _diffrn.ambient_pressure_lt ? _diffrn.ambient_temp_gt ? _diffrn.ambient_temp_lt ? _diffrn.pdbx_serial_crystal_experiment N _diffrn_detector.details ? _diffrn_detector.detector CCD _diffrn_detector.diffrn_id 1 _diffrn_detector.type ADSC QUANTUM 315r _diffrn_detector.area_resol_mean ? _diffrn_detector.dtime ? _diffrn_detector.pdbx_frames_total ? _diffrn_detector.pdbx_collection_time_total ? _diffrn_detector.pdbx_collection_date 2019-04-13 _diffrn_detector.pdbx_frequency ? _diffrn_radiation.collimation ? _diffrn_radiation.diffrn_id 1 _diffrn_radiation.filter_edge ? _diffrn_radiation.inhomogeneity ? _diffrn_radiation.monochromator ? _diffrn_radiation.polarisn_norm ? _diffrn_radiation.polarisn_ratio ? _diffrn_radiation.probe ? _diffrn_radiation.type ? _diffrn_radiation.xray_symbol ? _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.pdbx_wavelength_list ? _diffrn_radiation.pdbx_wavelength ? _diffrn_radiation.pdbx_diffrn_protocol SINGLE WAVELENGTH _diffrn_radiation.pdbx_analyzer ? _diffrn_radiation.pdbx_scattering_type x-ray _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 0.987 _diffrn_radiation_wavelength.wt 1.0 _diffrn_source.current ? _diffrn_source.details ? _diffrn_source.diffrn_id 1 _diffrn_source.power ? _diffrn_source.size ? _diffrn_source.source SYNCHROTRON _diffrn_source.target ? _diffrn_source.type SSRF BEAMLINE BL19U1 _diffrn_source.voltage ? _diffrn_source.take-off_angle ? _diffrn_source.pdbx_wavelength_list 0.987 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_synchrotron_beamline BL19U1 _diffrn_source.pdbx_synchrotron_site SSRF _reflns.B_iso_Wilson_estimate 29.830 _reflns.entry_id 6KBF _reflns.data_reduction_details ? _reflns.data_reduction_method ? _reflns.d_resolution_high 1.920 _reflns.d_resolution_low 47.070 _reflns.details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.number_all ? _reflns.number_obs 87690 _reflns.observed_criterion ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.observed_criterion_I_max ? _reflns.observed_criterion_I_min ? _reflns.observed_criterion_sigma_F ? _reflns.observed_criterion_sigma_I ? _reflns.percent_possible_obs 99.200 _reflns.R_free_details ? _reflns.Rmerge_F_all ? _reflns.Rmerge_F_obs ? _reflns.Friedel_coverage ? _reflns.number_gt ? _reflns.threshold_expression ? _reflns.pdbx_redundancy 6.600 _reflns.pdbx_Rmerge_I_obs 0.114 _reflns.pdbx_Rmerge_I_all ? _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_av_sigmaI ? _reflns.pdbx_netI_over_sigmaI 8.7 _reflns.pdbx_res_netI_over_av_sigmaI_2 ? _reflns.pdbx_res_netI_over_sigmaI_2 ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_d_res_high_opt ? _reflns.pdbx_d_res_low_opt ? _reflns.pdbx_d_res_opt_method ? _reflns.phase_calculation_details ? _reflns.pdbx_Rrim_I_all ? _reflns.pdbx_Rpim_I_all ? _reflns.pdbx_d_opt ? _reflns.pdbx_number_measured_all ? _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.pdbx_CC_half ? _reflns.pdbx_R_split ? _refine.ls_hydrogen_treatment ? _refine.ls_matrix_type ? _refine.ls_number_constraints ? _refine.ls_number_parameters ? _refine.ls_number_reflns_all ? _refine.ls_number_reflns_obs 87607 _refine.ls_number_reflns_R_free 4255 _refine.ls_number_reflns_R_work 83352 _refine.ls_number_restraints ? _refine.ls_percent_reflns_obs 99.0300 _refine.ls_percent_reflns_R_free 4.8600 _refine.ls_R_factor_all ? _refine.ls_R_factor_obs 0.1820 _refine.ls_R_factor_R_free 0.2161 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_R_factor_R_work 0.1802 _refine.ls_R_Fsqd_factor_obs ? _refine.ls_R_I_factor_obs ? _refine.ls_redundancy_reflns_all ? _refine.ls_redundancy_reflns_obs ? _refine.ls_restrained_S_all ? _refine.ls_restrained_S_obs ? _refine.ls_shift_over_esd_max ? _refine.ls_shift_over_esd_mean ? _refine.ls_structure_factor_coef ? _refine.ls_weighting_details ? _refine.ls_weighting_scheme ? _refine.ls_wR_factor_all ? _refine.ls_wR_factor_obs ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.occupancy_max ? _refine.occupancy_min ? _refine.solvent_model_details FLAT BULK SOLVENT MODEL _refine.solvent_model_param_bsol ? _refine.solvent_model_param_ksol ? _refine.ls_R_factor_gt ? _refine.ls_goodness_of_fit_gt ? _refine.ls_goodness_of_fit_ref ? _refine.ls_shift_over_su_max ? _refine.ls_shift_over_su_max_lt ? _refine.ls_shift_over_su_mean ? _refine.ls_shift_over_su_mean_lt ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 1.360 _refine.pdbx_ls_sigma_Fsqd ? _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.pdbx_method_to_determine_struct MOLECULAR REPLACEMENT _refine.pdbx_starting_model 4YCV _refine.pdbx_stereochemistry_target_values ML _refine.pdbx_R_Free_selection_details ? _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.pdbx_solvent_vdw_probe_radii 1.1100 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 0.9000 _refine.pdbx_real_space_R ? _refine.pdbx_density_correlation ? _refine.pdbx_pd_number_of_powder_patterns ? _refine.pdbx_pd_number_of_points ? _refine.pdbx_pd_meas_number_of_points ? _refine.pdbx_pd_proc_ls_prof_R_factor ? _refine.pdbx_pd_proc_ls_prof_wR_factor ? _refine.pdbx_pd_Marquardt_correlation_coeff ? _refine.pdbx_pd_Fsqrd_R_factor ? _refine.pdbx_pd_ls_matrix_band_width ? _refine.pdbx_overall_phase_error 23.4000 _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_diffrn_id 1 _refine.overall_SU_B ? _refine.overall_SU_ML 0.2400 _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_average_fsc_overall ? _refine.pdbx_average_fsc_work ? _refine.pdbx_average_fsc_free ? _refine_hist.pdbx_refine_id X-RAY DIFFRACTION _refine_hist.cycle_id final _refine_hist.details ? _refine_hist.d_res_high 1.9200 _refine_hist.d_res_low 43.8450 _refine_hist.number_atoms_solvent 660 _refine_hist.number_atoms_total 8659 _refine_hist.number_reflns_all ? _refine_hist.number_reflns_obs ? _refine_hist.number_reflns_R_free ? _refine_hist.number_reflns_R_work ? _refine_hist.R_factor_all ? _refine_hist.R_factor_obs ? _refine_hist.R_factor_R_free ? _refine_hist.R_factor_R_work ? _refine_hist.pdbx_number_residues_total 1007 _refine_hist.pdbx_B_iso_mean_ligand 39.35 _refine_hist.pdbx_B_iso_mean_solvent 47.82 _refine_hist.pdbx_number_atoms_protein 7903 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 96 _refine_hist.pdbx_number_atoms_lipid ? _refine_hist.pdbx_number_atoms_carb ? _refine_hist.pdbx_pseudo_atom_details ? _struct.entry_id 6KBF _struct.title Crystal structure of plasmodium lysyl-tRNA synthetase in complex with a cladosporin derivative 3 _struct.pdbx_descriptor Lysine--tRNA ligase (E.C.6.1.1.6) _struct.pdbx_model_details ? _struct.pdbx_formula_weight ? _struct.pdbx_formula_weight_method ? _struct.pdbx_model_type_details ? _struct.pdbx_CASP_flag N _struct_keywords.entry_id 6KBF _struct_keywords.text Inhibitor, Complex, LIGASE _struct_keywords.pdbx_keywords LIGASE _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? _atom_sites.entry_id 6KBF _atom_sites.solution_primary ? _atom_sites.solution_secondary ? _atom_sites.solution_hydrogens ? _atom_sites.special_details ? _atom_site_anisotrop.pdbx_auth_asym_id _atom_site_anisotrop.pdbx_auth_atom_id _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_and_software_defined_assembly _pdbx_struct_assembly.method_details PISA _pdbx_struct_assembly.oligomeric_details dimeric _pdbx_struct_assembly.oligomeric_count 2 _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I,J,K,L,M,N _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type identity operation _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type Structure model _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type Initial release _pdbx_audit_revision_details.description ? _pdbx_audit_revision_details.details ? _pdbx_audit_revision_group.ordinal 1 _pdbx_audit_revision_group.revision_ordinal 2 _pdbx_audit_revision_group.data_content_type Structure model _pdbx_audit_revision_group.group Database references _pdbx_refine_tls.id 1 _pdbx_refine_tls.pdbx_refine_id X-RAY DIFFRACTION _pdbx_refine_tls.details ? _pdbx_refine_tls.method refined _pdbx_refine_tls.origin_x -50.9080 _pdbx_refine_tls.origin_y -8.8197 _pdbx_refine_tls.origin_z 23.3897 _pdbx_entry_details.entry_id 6KBF _pdbx_entry_details.has_ligand_of_interest Y _pdbx_entry_details.compound_details ? _pdbx_entry_details.source_details ? _pdbx_entry_details.nonpolymer_details ? _pdbx_entry_details.sequence_details ? _pdbx_audit_support.funding_organization National Science Foundation (China) _pdbx_audit_support.country China _pdbx_audit_support.grant_number 21778064 _pdbx_audit_support.ordinal 1 _pdbx_entity_instance_feature.ordinal 1 _pdbx_entity_instance_feature.comp_id D4X _pdbx_entity_instance_feature.asym_id ? _pdbx_entity_instance_feature.seq_num ? _pdbx_entity_instance_feature.auth_comp_id D4X _pdbx_entity_instance_feature.auth_asym_id ? _pdbx_entity_instance_feature.auth_seq_num ? _pdbx_entity_instance_feature.feature_type SUBJECT OF INVESTIGATION _pdbx_entity_instance_feature.details ? _pdbx_struct_assembly_auth_evidence.id 1 _pdbx_struct_assembly_auth_evidence.assembly_id 1 _pdbx_struct_assembly_auth_evidence.experimental_support homology _pdbx_struct_assembly_auth_evidence.details ?

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