data_PRD_002362
# 
_pdbx_reference_molecule.prd_id                       PRD_002362 
_pdbx_reference_molecule.name                         "GsIN-1 peptide" 
_pdbx_reference_molecule.represent_as                 polymer 
_pdbx_reference_molecule.type                         "Cyclic peptide" 
_pdbx_reference_molecule.type_evidence_code           ? 
_pdbx_reference_molecule.class                        Inhibitor 
_pdbx_reference_molecule.class_evidence_code          ? 
_pdbx_reference_molecule.formula                      "C79 H106 N16 O21 S" 
_pdbx_reference_molecule.formula_weight               1647.847 
_pdbx_reference_molecule.chem_comp_id                 ? 
_pdbx_reference_molecule.release_status               REL 
_pdbx_reference_molecule.replaces                     ? 
_pdbx_reference_molecule.replaced_by                  ? 
_pdbx_reference_molecule.compound_details             ? 
_pdbx_reference_molecule.description                  ? 
_pdbx_reference_molecule.representative_PDB_id_code   7BPH 
# 
_pdbx_reference_entity_list.prd_id          PRD_002362 
_pdbx_reference_entity_list.ref_entity_id   1 
_pdbx_reference_entity_list.component_id    1 
_pdbx_reference_entity_list.type            polymer 
_pdbx_reference_entity_list.details         . 
# 
loop_
_pdbx_reference_entity_poly_link.prd_id 
_pdbx_reference_entity_poly_link.ref_entity_id 
_pdbx_reference_entity_poly_link.link_id 
_pdbx_reference_entity_poly_link.atom_id_1 
_pdbx_reference_entity_poly_link.comp_id_1 
_pdbx_reference_entity_poly_link.entity_seq_num_1 
_pdbx_reference_entity_poly_link.atom_id_2 
_pdbx_reference_entity_poly_link.comp_id_2 
_pdbx_reference_entity_poly_link.entity_seq_num_2 
_pdbx_reference_entity_poly_link.value_order 
_pdbx_reference_entity_poly_link.component_id 
_pdbx_reference_entity_poly_link.details 
_pdbx_reference_entity_poly_link.insert_code_1 
_pdbx_reference_entity_poly_link.insert_code_2 
PRD_002362 1 1  C   ACE 1  N  DTY 2  sing 1 ? ? ? 
PRD_002362 1 2  CH3 ACE 1  SG CYS 14 sing 1 ? ? ? 
PRD_002362 1 3  C   DTY 2  N  PHE 3  sing 1 ? ? ? 
PRD_002362 1 4  C   PHE 3  N  GLU 4  sing 1 ? ? ? 
PRD_002362 1 5  C   GLU 4  N  SER 5  sing 1 ? ? ? 
PRD_002362 1 6  C   SER 5  N  VAL 6  sing 1 ? ? ? 
PRD_002362 1 7  C   VAL 6  N  TYR 7  sing 1 ? ? ? 
PRD_002362 1 8  C   TYR 7  N  ALA 8  sing 1 ? ? ? 
PRD_002362 1 9  C   ALA 8  N  ILE 9  sing 1 ? ? ? 
PRD_002362 1 10 C   ILE 9  N  TRP 10 sing 1 ? ? ? 
PRD_002362 1 11 C   TRP 10 N  GLY 11 sing 1 ? ? ? 
PRD_002362 1 12 C   GLY 11 N  THR 12 sing 1 ? ? ? 
PRD_002362 1 13 C   THR 12 N  LEU 13 sing 1 ? ? ? 
PRD_002362 1 14 C   LEU 13 N  CYS 14 sing 1 ? ? ? 
PRD_002362 1 15 C   CYS 14 N  GLY 15 sing 1 ? ? ? 
PRD_002362 1 16 C   GLY 15 N  NH2 16 sing 1 ? ? ? 
# 
_pdbx_reference_entity_poly.prd_id          PRD_002362 
_pdbx_reference_entity_poly.ref_entity_id   1 
_pdbx_reference_entity_poly.db_code         . 
_pdbx_reference_entity_poly.db_name         . 
_pdbx_reference_entity_poly.type            peptide-like 
# 
_pdbx_reference_entity_sequence.prd_id          PRD_002362 
_pdbx_reference_entity_sequence.ref_entity_id   1 
_pdbx_reference_entity_sequence.type            peptide-like 
_pdbx_reference_entity_sequence.NRP_flag        N 
# 
loop_
_pdbx_reference_entity_poly_seq.prd_id 
_pdbx_reference_entity_poly_seq.ref_entity_id 
_pdbx_reference_entity_poly_seq.num 
_pdbx_reference_entity_poly_seq.mon_id 
_pdbx_reference_entity_poly_seq.parent_mon_id 
_pdbx_reference_entity_poly_seq.hetero 
_pdbx_reference_entity_poly_seq.observed 
PRD_002362 1 1  ACE .   N Y 
PRD_002362 1 2  DTY .   N Y 
PRD_002362 1 3  PHE PHE N Y 
PRD_002362 1 4  GLU GLU N Y 
PRD_002362 1 5  SER SER N Y 
PRD_002362 1 6  VAL VAL N Y 
PRD_002362 1 7  TYR TYR N Y 
PRD_002362 1 8  ALA ALA N Y 
PRD_002362 1 9  ILE ILE N Y 
PRD_002362 1 10 TRP TRP N Y 
PRD_002362 1 11 GLY GLY N Y 
PRD_002362 1 12 THR THR N Y 
PRD_002362 1 13 LEU LEU N Y 
PRD_002362 1 14 CYS CYS N Y 
PRD_002362 1 15 GLY GLY N Y 
PRD_002362 1 16 NH2 .   N Y 
# 
loop_
_pdbx_prd_audit.prd_id 
_pdbx_prd_audit.date 
_pdbx_prd_audit.processing_site 
_pdbx_prd_audit.action_type 
PRD_002362 2021-04-14 .    "Create molecule" 
PRD_002362 2021-04-21 RCSB "Initial release" 
# 
