{"assembly_context":"asymmetric_unit_multi_chain_possible","assessment_status":"calculated_observed_ligand_environment","broader_pfam_contacts_at_5A":0,"ccd_id":"2NU","contacting_residues_missing_sidechain_atoms":0,"contacts":[{"annotation_core":true,"canonical_position":29,"distance_angstrom":5.2345,"label_seq_id":30,"ligand_alt":null,"ligand_atom":"C4","ligand_auth_asym_id":"B","ligand_component":"2NU","ligand_label_asym_id":"J","ligand_occupancy":0.68,"missing_sidechain_atoms_conformer_consistent":[],"missing_sidechain_atoms_union":[],"model":1,"model_number":1,"pdb_id":"7HG6","protein_alt":null,"protein_atom":"C","protein_auth_asym_id":"A","protein_auth_seq_id":"29","protein_chain":"A","protein_component":"ALA","protein_insertion_code":null,"protein_occupancy":1.0,"quality_id":"7HG6:A:UP:Q7Z4V5:PWWP1","region_type":"native_annotation_core","site_id":"PDB:7HG6:LIG:J:2NU:103:.:SITE:UP:Q7Z4V5:PWWP1:A","source_coordinate_sha256":"44a14091c19c0de2c120805d1a9782bcc5e2db1c0fedf669de107021cae2cfff"},{"annotation_core":true,"canonical_position":30,"distance_angstrom":3.1134,"label_seq_id":31,"ligand_alt":null,"ligand_atom":"C4","ligand_auth_asym_id":"B","ligand_component":"2NU","ligand_label_asym_id":"J","ligand_occupancy":0.68,"missing_sidechain_atoms_conformer_consistent":[],"missing_sidechain_atoms_union":[],"model":1,"model_number":1,"pdb_id":"7HG6","protein_alt":null,"protein_atom":"O","protein_auth_asym_id":"A","protein_auth_seq_id":"30","protein_chain":"A","protein_component":"ASP","protein_insertion_code":null,"protein_occupancy":1.0,"quality_id":"7HG6:A:UP:Q7Z4V5:PWWP1","region_type":"native_annotation_core","site_id":"PDB:7HG6:LIG:J:2NU:103:.:SITE:UP:Q7Z4V5:PWWP1:A","source_coordinate_sha256":"44a14091c19c0de2c120805d1a9782bcc5e2db1c0fedf669de107021cae2cfff"},{"annotation_core":true,"canonical_position":31,"distance_angstrom":4.4138,"label_seq_id":32,"ligand_alt":null,"ligand_atom":"C2","ligand_auth_asym_id":"B","ligand_component":"2NU","ligand_label_asym_id":"J","ligand_occupancy":0.68,"missing_sidechain_atoms_conformer_consistent":[],"missing_sidechain_atoms_union":[],"model":1,"model_number":1,"pdb_id":"7HG6","protein_alt":null,"protein_atom":"CA","protein_auth_asym_id":"A","protein_auth_seq_id":"31","protein_chain":"A","protein_component":"GLY","protein_insertion_code":null,"protein_occupancy":1.0,"quality_id":"7HG6:A:UP:Q7Z4V5:PWWP1","region_type":"native_annotation_core","site_id":"PDB:7HG6:LIG:J:2NU:103:.:SITE:UP:Q7Z4V5:PWWP1:A","source_coordinate_sha256":"44a14091c19c0de2c120805d1a9782bcc5e2db1c0fedf669de107021cae2cfff"}],"contacts_at_6A":3,"core_contacts_at_5A":2,"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:7HG6:LIG:J:2NU:103:.","ligand_label_asym_id":"J","minimum_core_distance_angstrom":3.1134,"model":1,"pdb_id":"7HG6","protein_label_asym_id":"A","quality_id":"7HG6:A:UP:Q7Z4V5:PWWP1","site_id":"PDB:7HG6:LIG:J:2NU:103:.:SITE:UP:Q7Z4V5:PWWP1:A","source_component_is_unmodified_parent":null,"source_coordinate_sha256":"44a14091c19c0de2c120805d1a9782bcc5e2db1c0fedf669de107021cae2cfff","source_role":"research_ligand","warnings":["partial_occupancy_contact_atoms","multi_chain_environment_source_annotation"]}
