data_PRD_000749
# 
_pdbx_reference_molecule.prd_id                       PRD_000749 
_pdbx_reference_molecule.name                         "KALATA B1" 
_pdbx_reference_molecule.represent_as                 polymer 
_pdbx_reference_molecule.type                         "Cyclic peptide" 
_pdbx_reference_molecule.type_evidence_code           ? 
_pdbx_reference_molecule.class                        "Antimicrobial, Antitumor" 
_pdbx_reference_molecule.class_evidence_code          ? 
_pdbx_reference_molecule.formula                      "C117 H180 N35 O39 S6" 
_pdbx_reference_molecule.formula_weight               2893.282 
_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   1jjz 
# 
_pdbx_reference_entity_list.prd_id          PRD_000749 
_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         peptide 
# 
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_000749 1 1  C  ASN 1  N  GLY 2  sing 1 ? ? ? 
PRD_000749 1 2  N  ASN 1  C  ARG 29 sing 1 ? ? ? 
PRD_000749 1 3  C  GLY 2  N  LEU 3  sing 1 ? ? ? 
PRD_000749 1 4  C  LEU 3  N  PRO 4  sing 1 ? ? ? 
PRD_000749 1 5  C  PRO 4  N  VAL 5  sing 1 ? ? ? 
PRD_000749 1 6  C  VAL 5  N  CYS 6  sing 1 ? ? ? 
PRD_000749 1 7  C  CYS 6  N  GLY 7  sing 1 ? ? ? 
PRD_000749 1 8  SG CYS 6  SG CYS 27 sing 1 ? ? ? 
PRD_000749 1 9  C  GLY 7  N  GLU 8  sing 1 ? ? ? 
PRD_000749 1 10 C  GLU 8  N  THR 9  sing 1 ? ? ? 
PRD_000749 1 11 C  THR 9  N  CYS 10 sing 1 ? ? ? 
PRD_000749 1 12 C  CYS 10 N  VAL 11 sing 1 ? ? ? 
PRD_000749 1 13 SG CYS 10 SG CYS 22 sing 1 ? ? ? 
PRD_000749 1 14 C  VAL 11 N  GLY 12 sing 1 ? ? ? 
PRD_000749 1 15 C  GLY 12 N  GLY 13 sing 1 ? ? ? 
PRD_000749 1 16 C  GLY 13 N  THR 14 sing 1 ? ? ? 
PRD_000749 1 17 C  THR 14 N  CYS 15 sing 1 ? ? ? 
PRD_000749 1 18 C  CYS 15 N  ASN 16 sing 1 ? ? ? 
PRD_000749 1 19 SG CYS 15 SG CYS 20 sing 1 ? ? ? 
PRD_000749 1 20 C  ASN 16 N  THR 17 sing 1 ? ? ? 
PRD_000749 1 21 C  THR 17 N  PRO 18 sing 1 ? ? ? 
PRD_000749 1 22 C  PRO 18 N  GLY 19 sing 1 ? ? ? 
PRD_000749 1 23 C  GLY 19 N  CYS 20 sing 1 ? ? ? 
PRD_000749 1 24 C  CYS 20 N  THR 21 sing 1 ? ? ? 
PRD_000749 1 25 C  THR 21 N  CYS 22 sing 1 ? ? ? 
PRD_000749 1 26 C  CYS 22 N  SER 23 sing 1 ? ? ? 
PRD_000749 1 27 C  SER 23 N  TRP 24 sing 1 ? ? ? 
PRD_000749 1 28 C  TRP 24 N  PRO 25 sing 1 ? ? ? 
PRD_000749 1 29 C  PRO 25 N  VAL 26 sing 1 ? ? ? 
PRD_000749 1 30 C  VAL 26 N  CYS 27 sing 1 ? ? ? 
PRD_000749 1 31 C  CYS 27 N  THR 28 sing 1 ? ? ? 
PRD_000749 1 32 C  THR 28 N  ARG 29 sing 1 ? ? ? 
# 
_pdbx_reference_entity_poly.prd_id          PRD_000749 
_pdbx_reference_entity_poly.ref_entity_id   1 
_pdbx_reference_entity_poly.db_code         P56254 
_pdbx_reference_entity_poly.db_name         UNP 
_pdbx_reference_entity_poly.type            peptide-like 
# 
_pdbx_reference_entity_sequence.prd_id          PRD_000749 
_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_000749 1 1  ASN ASN N Y 
PRD_000749 1 2  GLY GLY N Y 
PRD_000749 1 3  LEU LEU N Y 
PRD_000749 1 4  PRO PRO N Y 
PRD_000749 1 5  VAL VAL N Y 
PRD_000749 1 6  CYS CYS N Y 
PRD_000749 1 7  GLY GLY N Y 
PRD_000749 1 8  GLU GLU N Y 
PRD_000749 1 9  THR THR N Y 
PRD_000749 1 10 CYS CYS N Y 
PRD_000749 1 11 VAL VAL N Y 
PRD_000749 1 12 GLY GLY N Y 
PRD_000749 1 13 GLY GLY N Y 
PRD_000749 1 14 THR THR N Y 
PRD_000749 1 15 CYS CYS N Y 
PRD_000749 1 16 ASN ASN N Y 
PRD_000749 1 17 THR THR N Y 
PRD_000749 1 18 PRO PRO N Y 
PRD_000749 1 19 GLY GLY N Y 
PRD_000749 1 20 CYS CYS N Y 
PRD_000749 1 21 THR THR N Y 
PRD_000749 1 22 CYS CYS N Y 
PRD_000749 1 23 SER SER N Y 
PRD_000749 1 24 TRP TRP N Y 
PRD_000749 1 25 PRO PRO N Y 
PRD_000749 1 26 VAL VAL N Y 
PRD_000749 1 27 CYS CYS N Y 
PRD_000749 1 28 THR THR N Y 
PRD_000749 1 29 ARG ARG N Y 
# 
_pdbx_reference_entity_src_nat.prd_id                PRD_000749 
_pdbx_reference_entity_src_nat.ref_entity_id         1 
_pdbx_reference_entity_src_nat.ordinal               1 
_pdbx_reference_entity_src_nat.taxid                 60225 
_pdbx_reference_entity_src_nat.organism_scientific   "Oldenlandia affinis" 
_pdbx_reference_entity_src_nat.source                ? 
_pdbx_reference_entity_src_nat.db_code               P56254 
_pdbx_reference_entity_src_nat.db_name               UniProt 
_pdbx_reference_entity_src_nat.strain                ? 
# 
loop_
_pdbx_prd_audit.prd_id 
_pdbx_prd_audit.date 
_pdbx_prd_audit.processing_site 
_pdbx_prd_audit.action_type 
PRD_000749 2012-02-03 RCSB "Create molecule"    
PRD_000749 2012-07-09 PDBE "Other modification" 
PRD_000749 2013-06-03 RCSB "Other modification" 
PRD_000749 2020-08-12 RCSB "Initial release"    
PRD_000749 2023-09-20 PDBE "Modify audit"       
# 
