{"assembly_context":"asymmetric_unit_multi_chain_possible","assessment_status":"calculated_observed_ligand_environment","broader_pfam_contacts_at_5A":0,"ccd_id":"A1D73","contacting_residues_missing_sidechain_atoms":0,"contacts":[{"annotation_core":true,"canonical_position":13,"distance_angstrom":5.091,"label_seq_id":13,"ligand_alt":null,"ligand_atom":"BR12","ligand_auth_asym_id":"A","ligand_component":"A1D73","ligand_label_asym_id":"D","ligand_occupancy":0.59,"missing_sidechain_atoms_conformer_consistent":[],"missing_sidechain_atoms_union":[],"model":1,"model_number":1,"pdb_id":"8Z6C","protein_alt":null,"protein_atom":"O","protein_auth_asym_id":"A","protein_auth_seq_id":"13","protein_chain":"A","protein_component":"ALA","protein_insertion_code":null,"protein_occupancy":1.0,"quality_id":"8Z6C:A:UP:Q7Z4V5:PWWP1","region_type":"native_annotation_core","site_id":"PDB:8Z6C:LIG:D:A1D73:101:.:SITE:UP:Q7Z4V5:PWWP1:A","source_coordinate_sha256":"a52b0ce0d915a4ec6357f5dce14e0dbbacdb5fa856c24981a9187cf4168156c2"},{"annotation_core":true,"canonical_position":14,"distance_angstrom":5.8428,"label_seq_id":14,"ligand_alt":null,"ligand_atom":"BR12","ligand_auth_asym_id":"A","ligand_component":"A1D73","ligand_label_asym_id":"D","ligand_occupancy":0.59,"missing_sidechain_atoms_conformer_consistent":[],"missing_sidechain_atoms_union":[],"model":1,"model_number":1,"pdb_id":"8Z6C","protein_alt":null,"protein_atom":"C","protein_auth_asym_id":"A","protein_auth_seq_id":"14","protein_chain":"A","protein_component":"LYS","protein_insertion_code":null,"protein_occupancy":1.0,"quality_id":"8Z6C:A:UP:Q7Z4V5:PWWP1","region_type":"native_annotation_core","site_id":"PDB:8Z6C:LIG:D:A1D73:101:.:SITE:UP:Q7Z4V5:PWWP1:A","source_coordinate_sha256":"a52b0ce0d915a4ec6357f5dce14e0dbbacdb5fa856c24981a9187cf4168156c2"},{"annotation_core":true,"canonical_position":15,"distance_angstrom":3.2305,"label_seq_id":15,"ligand_alt":null,"ligand_atom":"N03","ligand_auth_asym_id":"A","ligand_component":"A1D73","ligand_label_asym_id":"D","ligand_occupancy":0.59,"missing_sidechain_atoms_conformer_consistent":[],"missing_sidechain_atoms_union":[],"model":1,"model_number":1,"pdb_id":"8Z6C","protein_alt":null,"protein_atom":"CE","protein_auth_asym_id":"A","protein_auth_seq_id":"15","protein_chain":"A","protein_component":"MET","protein_insertion_code":null,"protein_occupancy":1.0,"quality_id":"8Z6C:A:UP:Q7Z4V5:PWWP1","region_type":"native_annotation_core","site_id":"PDB:8Z6C:LIG:D:A1D73:101:.:SITE:UP:Q7Z4V5:PWWP1:A","source_coordinate_sha256":"a52b0ce0d915a4ec6357f5dce14e0dbbacdb5fa856c24981a9187cf4168156c2"},{"annotation_core":true,"canonical_position":18,"distance_angstrom":3.4757,"label_seq_id":18,"ligand_alt":null,"ligand_atom":"C05","ligand_auth_asym_id":"A","ligand_component":"A1D73","ligand_label_asym_id":"D","ligand_occupancy":0.59,"missing_sidechain_atoms_conformer_consistent":[],"missing_sidechain_atoms_union":[],"model":1,"model_number":1,"pdb_id":"8Z6C","protein_alt":null,"protein_atom":"CE2","protein_auth_asym_id":"A","protein_auth_seq_id":"18","protein_chain":"A","protein_component":"TYR","protein_insertion_code":null,"protein_occupancy":1.0,"quality_id":"8Z6C:A:UP:Q7Z4V5:PWWP1","region_type":"native_annotation_core","site_id":"PDB:8Z6C:LIG:D:A1D73:101:.:SITE:UP:Q7Z4V5:PWWP1:A","source_coordinate_sha256":"a52b0ce0d915a4ec6357f5dce14e0dbbacdb5fa856c24981a9187cf4168156c2"},{"annotation_core":true,"canonical_position":19,"distance_angstrom":5.0725,"label_seq_id":19,"ligand_alt":null,"ligand_atom":"BR12","ligand_auth_asym_id":"A","ligand_component":"A1D73","ligand_label_asym_id":"D","ligand_occupancy":0.59,"missing_sidechain_atoms_conformer_consistent":[],"missing_sidechain_atoms_union":[],"model":1,"model_number":1,"pdb_id":"8Z6C","protein_alt":null,"protein_atom":"O","protein_auth_asym_id":"A","protein_auth_seq_id":"19","protein_chain":"A","protein_component":"PRO","protein_insertion_code":null,"protein_occupancy":1.0,"quality_id":"8Z6C:A:UP:Q7Z4V5:PWWP1","region_type":"native_annotation_core","site_id":"PDB:8Z6C:LIG:D:A1D73:101:.:SITE:UP:Q7Z4V5:PWWP1:A","source_coordinate_sha256":"a52b0ce0d915a4ec6357f5dce14e0dbbacdb5fa856c24981a9187cf4168156c2"},{"annotation_core":true,"canonical_position":21,"distance_angstrom":3.3231,"label_seq_id":21,"ligand_alt":null,"ligand_atom":"C09","ligand_auth_asym_id":"A","ligand_component":"A1D73","ligand_label_asym_id":"D","ligand_occupancy":0.59,"missing_sidechain_atoms_conformer_consistent":[],"missing_sidechain_atoms_union":[],"model":1,"model_number":1,"pdb_id":"8Z6C","protein_alt":null,"protein_atom":"CE2","protein_auth_asym_id":"A","protein_auth_seq_id":"21","protein_chain":"A","protein_component":"TRP","protein_insertion_code":null,"protein_occupancy":1.0,"quality_id":"8Z6C:A:UP:Q7Z4V5:PWWP1","region_type":"native_annotation_core","site_id":"PDB:8Z6C:LIG:D:A1D73:101:.:SITE:UP:Q7Z4V5:PWWP1:A","source_coordinate_sha256":"a52b0ce0d915a4ec6357f5dce14e0dbbacdb5fa856c24981a9187cf4168156c2"},{"annotation_core":true,"canonical_position":44,"distance_angstrom":3.3686,"label_seq_id":44,"ligand_alt":null,"ligand_atom":"N10","ligand_auth_asym_id":"A","ligand_component":"A1D73","ligand_label_asym_id":"D","ligand_occupancy":0.59,"missing_sidechain_atoms_conformer_consistent":[],"missing_sidechain_atoms_union":[],"model":1,"model_number":1,"pdb_id":"8Z6C","protein_alt":null,"protein_atom":"CB","protein_auth_asym_id":"A","protein_auth_seq_id":"44","protein_chain":"A","protein_component":"PHE","protein_insertion_code":null,"protein_occupancy":1.0,"quality_id":"8Z6C:A:UP:Q7Z4V5:PWWP1","region_type":"native_annotation_core","site_id":"PDB:8Z6C:LIG:D:A1D73:101:.:SITE:UP:Q7Z4V5:PWWP1:A","source_coordinate_sha256":"a52b0ce0d915a4ec6357f5dce14e0dbbacdb5fa856c24981a9187cf4168156c2"},{"annotation_core":true,"canonical_position":45,"distance_angstrom":4.9751,"label_seq_id":45,"ligand_alt":null,"ligand_atom":"N10","ligand_auth_asym_id":"A","ligand_component":"A1D73","ligand_label_asym_id":"D","ligand_occupancy":0.59,"missing_sidechain_atoms_conformer_consistent":[],"missing_sidechain_atoms_union":[],"model":1,"model_number":1,"pdb_id":"8Z6C","protein_alt":null,"protein_atom":"O","protein_auth_asym_id":"A","protein_auth_seq_id":"45","protein_chain":"A","protein_component":"PHE","protein_insertion_code":null,"protein_occupancy":1.0,"quality_id":"8Z6C:A:UP:Q7Z4V5:PWWP1","region_type":"native_annotation_core","site_id":"PDB:8Z6C:LIG:D:A1D73:101:.:SITE:UP:Q7Z4V5:PWWP1:A","source_coordinate_sha256":"a52b0ce0d915a4ec6357f5dce14e0dbbacdb5fa856c24981a9187cf4168156c2"},{"annotation_core":true,"canonical_position":47,"distance_angstrom":2.488,"label_seq_id":47,"ligand_alt":null,"ligand_atom":"N10","ligand_auth_asym_id":"A","ligand_component":"A1D73","ligand_label_asym_id":"D","ligand_occupancy":0.59,"missing_sidechain_atoms_conformer_consistent":[],"missing_sidechain_atoms_union":[],"model":1,"model_number":1,"pdb_id":"8Z6C","protein_alt":null,"protein_atom":"OG1","protein_auth_asym_id":"A","protein_auth_seq_id":"47","protein_chain":"A","protein_component":"THR","protein_insertion_code":null,"protein_occupancy":1.0,"quality_id":"8Z6C:A:UP:Q7Z4V5:PWWP1","region_type":"native_annotation_core","site_id":"PDB:8Z6C:LIG:D:A1D73:101:.:SITE:UP:Q7Z4V5:PWWP1:A","source_coordinate_sha256":"a52b0ce0d915a4ec6357f5dce14e0dbbacdb5fa856c24981a9187cf4168156c2"},{"annotation_core":true,"canonical_position":48,"distance_angstrom":5.3462,"label_seq_id":48,"ligand_alt":null,"ligand_atom":"N10","ligand_auth_asym_id":"A","ligand_component":"A1D73","ligand_label_asym_id":"D","ligand_occupancy":0.59,"missing_sidechain_atoms_conformer_consistent":[],"missing_sidechain_atoms_union":[],"model":1,"model_number":1,"pdb_id":"8Z6C","protein_alt":null,"protein_atom":"N","protein_auth_asym_id":"A","protein_auth_seq_id":"48","protein_chain":"A","protein_component":"HIS","protein_insertion_code":null,"protein_occupancy":1.0,"quality_id":"8Z6C:A:UP:Q7Z4V5:PWWP1","region_type":"native_annotation_core","site_id":"PDB:8Z6C:LIG:D:A1D73:101:.:SITE:UP:Q7Z4V5:PWWP1:A","source_coordinate_sha256":"a52b0ce0d915a4ec6357f5dce14e0dbbacdb5fa856c24981a9187cf4168156c2"},{"annotation_core":true,"canonical_position":49,"distance_angstrom":3.306,"label_seq_id":49,"ligand_alt":null,"ligand_atom":"N11","ligand_auth_asym_id":"A","ligand_component":"A1D73","ligand_label_asym_id":"D","ligand_occupancy":0.59,"missing_sidechain_atoms_conformer_consistent":[],"missing_sidechain_atoms_union":[],"model":1,"model_number":1,"pdb_id":"8Z6C","protein_alt":null,"protein_atom":"OE1","protein_auth_asym_id":"A","protein_auth_seq_id":"49","protein_chain":"A","protein_component":"GLU","protein_insertion_code":null,"protein_occupancy":1.0,"quality_id":"8Z6C:A:UP:Q7Z4V5:PWWP1","region_type":"native_annotation_core","site_id":"PDB:8Z6C:LIG:D:A1D73:101:.:SITE:UP:Q7Z4V5:PWWP1:A","source_coordinate_sha256":"a52b0ce0d915a4ec6357f5dce14e0dbbacdb5fa856c24981a9187cf4168156c2"},{"annotation_core":true,"canonical_position":50,"distance_angstrom":4.3798,"label_seq_id":50,"ligand_alt":null,"ligand_atom":"C02","ligand_auth_asym_id":"A","ligand_component":"A1D73","ligand_label_asym_id":"D","ligand_occupancy":0.59,"missing_sidechain_atoms_conformer_consistent":[],"missing_sidechain_atoms_union":[],"model":1,"model_number":1,"pdb_id":"8Z6C","protein_alt":null,"protein_atom":"O","protein_auth_asym_id":"A","protein_auth_seq_id":"50","protein_chain":"A","protein_component":"THR","protein_insertion_code":null,"protein_occupancy":1.0,"quality_id":"8Z6C:A:UP:Q7Z4V5:PWWP1","region_type":"native_annotation_core","site_id":"PDB:8Z6C:LIG:D:A1D73:101:.:SITE:UP:Q7Z4V5:PWWP1:A","source_coordinate_sha256":"a52b0ce0d915a4ec6357f5dce14e0dbbacdb5fa856c24981a9187cf4168156c2"},{"annotation_core":true,"canonical_position":51,"distance_angstrom":3.9037,"label_seq_id":51,"ligand_alt":null,"ligand_atom":"C02","ligand_auth_asym_id":"A","ligand_component":"A1D73","ligand_label_asym_id":"D","ligand_occupancy":0.59,"missing_sidechain_atoms_conformer_consistent":[],"missing_sidechain_atoms_union":[],"model":1,"model_number":1,"pdb_id":"8Z6C","protein_alt":null,"protein_atom":"CB","protein_auth_asym_id":"A","protein_auth_seq_id":"51","protein_chain":"A","protein_component":"ALA","protein_insertion_code":null,"protein_occupancy":1.0,"quality_id":"8Z6C:A:UP:Q7Z4V5:PWWP1","region_type":"native_annotation_core","site_id":"PDB:8Z6C:LIG:D:A1D73:101:.:SITE:UP:Q7Z4V5:PWWP1:A","source_coordinate_sha256":"a52b0ce0d915a4ec6357f5dce14e0dbbacdb5fa856c24981a9187cf4168156c2"}],"contacts_at_6A":13,"core_contacts_at_5A":9,"interpretation":"Observed source classified geometry, representative consistent alt state; distances do not imply favorable interaction or validated electron density.","ligand_alternate_conformers":[],"ligand_instance_id":"PDB:8Z6C:LIG:D:A1D73:101:.","ligand_label_asym_id":"D","minimum_core_distance_angstrom":2.488,"model":1,"pdb_id":"8Z6C","protein_label_asym_id":"A","quality_id":"8Z6C:A:UP:Q7Z4V5:PWWP1","site_id":"PDB:8Z6C:LIG:D:A1D73:101:.:SITE:UP:Q7Z4V5:PWWP1:A","source_component_is_unmodified_parent":null,"source_coordinate_sha256":"a52b0ce0d915a4ec6357f5dce14e0dbbacdb5fa856c24981a9187cf4168156c2","source_role":"research_ligand","warnings":["partial_occupancy_contact_atoms","multi_chain_environment_source_annotation"]}
