PDB entry 4mc2

View 4mc2 on RCSB PDB site
Description: HIV protease in complex with SA525P
Class: hydrolase/hydrolase inhibitor
Keywords: carbamates, drug design, HIV protease inhibitors, protein binding, stereoisomerism, structure-activity relationship, thiazepines, HYDROLASE-HYDROLASE INHIBITOR complex
Deposited on 2013-08-21, released 2014-04-02
The last revision prior to the SCOPe 2.08 freeze date was dated 2014-04-02, with a file datestamp of 2014-03-28.
Experiment type: XRAY
Resolution: 1.56 Å
R-factor: 0.2
AEROSPACI score: 0.51 (click here for full SPACI score report)

Chains and heterogens:

• Chain 'A':
  Compound: Protease
  Species: HUMAN IMMUNODEFICIENCY VIRUS 1 [TaxId:11676]
  Gene: gag-pol
  Database cross-references and differences (RAF-indexed):
  • Uniprot P0C6F2 (0-98)
    • engineered mutation (6)
    • engineered mutation (32)
    • engineered mutation (62)
  Domains in SCOPe 2.08: d4mc2a_
• Chain 'B':
  Compound: Protease
  Species: HUMAN IMMUNODEFICIENCY VIRUS 1 [TaxId:11676]
  Gene: gag-pol
  Database cross-references and differences (RAF-indexed):
  • Uniprot P0C6F2 (0-98)
    • engineered mutation (6)
    • engineered mutation (32)
    • engineered mutation (62)
  Domains in SCOPe 2.08: d4mc2b_
• Heterogens: 525, CL, HOH

PDB Chain Sequences:

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

  >4mc2A (A:)
  pqitlwkrplvtikiggqlkealldtgaddtvieemslpgrwkpkmiggiggfikvrqyd
  qiiieicghkaigtvlvgptpvniigrnlltqigctlnf
  

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

  >4mc2B (B:)
  pqitlwkrplvtikiggqlkealldtgaddtvieemslpgrwkpkmiggiggfikvrqyd
  qiiieicghkaigtvlvgptpvniigrnlltqigctlnf