PDB entry 4cpx

View 4cpx on RCSB PDB site
Description: Macrocyclic Transition-State Mimicking HIV-1 Protease Inhibitors Encompassing a Tertiary Alcohol
Class: hydrolase
Keywords: hydrolase, inhibitor, rational drug design
Deposited on 2014-02-08, released 2014-12-17
The last revision prior to the SCOPe 2.06 freeze date was dated 2014-12-17, with a file datestamp of 2014-12-12.
Experiment type: XRAY
Resolution: 1.85 Å
R-factor: 0.30946
AEROSPACI score: 0.29 (click here for full SPACI score report)

Chains and heterogens:

• Chain 'A':
  Compound: Protease
  Species: HUMAN IMMUNODEFICIENCY VIRUS [TaxId:12721]
  Database cross-references and differences (RAF-indexed):
  • Uniprot P03366
    • engineered mutation (62)
    • engineered mutation (81)
    • engineered mutation (83)
  Domains in SCOPe 2.06: d4cpxa_
• Chain 'B':
  Compound: Protease
  Species: HUMAN IMMUNODEFICIENCY VIRUS [TaxId:12721]
  Database cross-references and differences (RAF-indexed):
  • Uniprot P03366 (0-98)
    • engineered mutation (62)
    • engineered mutation (81)
    • engineered mutation (83)
  Domains in SCOPe 2.06: d4cpxb_
• Heterogens: CL, V78, HOH

PDB Chain Sequences:

• Chain 'A':
  Sequence; same for both SEQRES and ATOM records: (download)
  

  >4cpxA (A:)
  pqitlwqrplvtikiggqlkealldtgaddtvleemslpgrwkpkmiggiggfikvrqyd
  qipieicghkaigtvlvgptptnvigrnlltqigctlnf
  

  
  
• Chain 'B':
  Sequence; same for both SEQRES and ATOM records: (download)
  

  >4cpxB (B:)
  pqitlwqrplvtikiggqlkealldtgaddtvleemslpgrwkpkmiggiggfikvrqyd
  qipieicghkaigtvlvgptptnvigrnlltqigctlnf