data_PRD_000640
# 
_pdbx_reference_molecule.prd_id                       PRD_000640 
_pdbx_reference_molecule.name                         "bis-trifluoromethyl pepstatin A acid analogue" 
_pdbx_reference_molecule.represent_as                 "single molecule" 
_pdbx_reference_molecule.type                         Peptide-like 
_pdbx_reference_molecule.type_evidence_code           ? 
_pdbx_reference_molecule.class                        Inhibitor 
_pdbx_reference_molecule.class_evidence_code          ? 
_pdbx_reference_molecule.formula                      "C28 H45 F6 N5 O9" 
_pdbx_reference_molecule.formula_weight               709.675 
_pdbx_reference_molecule.chem_comp_id                 5FP 
_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   1xe6 
# 
_pdbx_reference_entity_subcomponents.prd_id         PRD_000640 
_pdbx_reference_entity_subcomponents.seq            "IVA VAL VAL F3T ALA F3T" 
_pdbx_reference_entity_subcomponents.chem_comp_id   5FP 
# 
_pdbx_reference_entity_list.prd_id          PRD_000640 
_pdbx_reference_entity_list.ref_entity_id   1 
_pdbx_reference_entity_list.component_id    1 
_pdbx_reference_entity_list.type            polymer-like 
_pdbx_reference_entity_list.details         . 
# 
_pdbx_reference_entity_poly.prd_id          PRD_000640 
_pdbx_reference_entity_poly.ref_entity_id   1 
_pdbx_reference_entity_poly.type            peptide-like 
_pdbx_reference_entity_poly.db_code         ? 
_pdbx_reference_entity_poly.db_name         ? 
# 
_pdbx_reference_entity_sequence.prd_id          PRD_000640 
_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_000640 1 1 IVA .   N Y 
PRD_000640 1 2 VAL VAL N Y 
PRD_000640 1 3 VAL VAL N Y 
PRD_000640 1 4 F3T .   N Y 
PRD_000640 1 5 ALA ALA N Y 
PRD_000640 1 6 F3T .   N Y 
# 
loop_
_pdbx_reference_entity_poly_link.prd_id 
_pdbx_reference_entity_poly_link.ref_entity_id 
_pdbx_reference_entity_poly_link.component_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.details 
_pdbx_reference_entity_poly_link.insert_code_1 
_pdbx_reference_entity_poly_link.insert_code_2 
PRD_000640 1 1 1 C  ALA 5 N F3T 6 SING ? ? ? 
PRD_000640 1 1 2 C1 F3T 4 N ALA 5 SING ? ? ? 
PRD_000640 1 1 3 C  VAL 3 N F3T 4 SING ? ? ? 
PRD_000640 1 1 4 C  VAL 2 N VAL 3 SING ? ? ? 
PRD_000640 1 1 5 C  IVA 1 N VAL 2 SING ? ? ? 
# 
loop_
_pdbx_prd_audit.prd_id 
_pdbx_prd_audit.date 
_pdbx_prd_audit.processing_site 
_pdbx_prd_audit.action_type 
PRD_000640 2012-02-08 RCSB "Create molecule"    
PRD_000640 2012-05-01 RCSB "Other modification" 
PRD_000640 2012-07-09 PDBE "Other modification" 
PRD_000640 2012-12-12 RCSB "Initial release"    
PRD_000640 2023-09-20 PDBE "Modify audit"       
# 
