PDB entry 2ien

View 2ien on RCSB PDB site
Description: Crystal structure analysis of HIV-1 protease with a potent non-peptide inhibitor (UIC-94017)
Class: hydrolase
Keywords: HIV-1 protease, dimer, inhibitor, UIC-94017, TMC114, darunavir
Deposited on 2006-09-19, released 2006-10-03
The last revision prior to the SCOP 1.73 freeze date was dated 2006-10-03, with a file datestamp of 2007-06-04.
Experiment type: XRAY
Resolution: 1.3 Å
R-factor: 0.134
AEROSPACI score: 0.78 (click here for full SPACI score report)

Chains and heterogens:

• Chain 'A':
  Compound: Protease
  Species: Human immunodeficiency virus 1
  Gene: GAG, POL
  Database cross-references and differences (RAF-indexed):
  • Uniprot P03368
    • engineered (6)
    • engineered (32)
    • engineered (62)
    • engineered (66)
    • engineered (94)
  Domains in SCOP 1.73: d2iena1
• Chain 'B':
  Compound: Protease
  Species: Human immunodeficiency virus 1
  Gene: GAG, POL
  Database cross-references and differences (RAF-indexed):
  • Uniprot P03368 (0-98)
    • engineered (6)
    • engineered (32)
    • engineered (62)
    • engineered (66)
    • engineered (94)
  Domains in SCOP 1.73: d2ienb1
• Heterogens: NA, CL, 017, ACY, GOL, HOH

PDB Chain Sequences:

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

  >2ienA (A:)
  pqitlwkrplvtikiggqlkealldtgaddtvieemslpgrwkpkmiggiggfikvrqyd
  qiiieiaghkaigtvlvgptpvniigrnlltqigatlnf
  

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

  >2ienB (B:)
  pqitlwkrplvtikiggqlkealldtgaddtvieemslpgrwkpkmiggiggfikvrqyd
  qiiieiaghkaigtvlvgptpvniigrnlltqigatlnf