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Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50369798
Substrate
n/a
Meas. Tech.
ChEMBL_160747 (CHEMBL769061)
Ki
60000±n/a nM
Citation
 Fairlie, DP; Tyndall, JD; Reid, RC; Wong, AK; Abbenante, G; Scanlon, MJ; March, DR; Bergman, DA; Chai, CL; Burkett, BA Conformational selection of inhibitors and substrates by proteolytic enzymes: implications for drug design and polypeptide processing. J Med Chem 43:1271-81 (2001) [PubMed]  Article 
Target
Name:
Gag-Pol polyprotein [489-587]
Synonyms:
Human immunodeficiency virus type 1 protease | POL_HV1H2 | Pol polyprotein | gag-pol
Type:
Enzyme Subunit
Mol. Mass.:
10781.16
Organism:
Human immunodeficiency virus type 1
Description:
P04585[489-587]
Residue:
99
Sequence:
PQVTLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMSLPGRWKPKMIGGIGGFIKVRQYDQILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
  
Inhibitor
Name:
BDBM50369798
Synonyms:
CHEMBL1794028
Type:
Small organic molecule
Emp. Form.:
C42H63N7O7
Mol. Mass.:
777.9923
SMILES:
CC[C@@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(C)=O)C(C)C)C(=O)N[C@@H](C(C)C)C(N)=O
Structure:
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