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Target
HIV-1 protease
Ligand
BDBM40773
Substrate
n/a
Meas. Tech.
Enzyme Inhibition Assay
Ki
2.7±0.0 nM
Citation
 Chen, CA; Sieburth, SM; Glekas, A; Hewitt, GW; Trainor, GL; Erickson-Viitanen, S; Garber, SS; Cordova, B; Jeffry, S; Klabe, RM Drug design with a new transition state analog of the hydrated carbonyl: silicon-based inhibitors of the HIV protease. Chem Biol 8:1161-6 (2001) [PubMed]  Article
Target
Name:
HIV-1 protease
Synonyms:
HIV-1 protease wild type
Type:
Protein
Mol. Mass.:
10757.68
Organism:
Human immunodeficiency virus
Description:
O90785
Residue:
99
Sequence:
PQITLWQRPLVTVKIGGQLREALLDTGADDTVLEDINLPGKWKPKMIGGIGGFIKVKQYEQVLIEICGKKAIGTVLVGPTPVNIIGRNMLTQIGCTLNF
  
Inhibitor
Name:
BDBM40773
Synonyms:
Silanediol, 17b
Type:
Small organic molecule
Emp. Form.:
C38H42N2O6Si
Mol. Mass.:
650.8354
SMILES:
OC1Cc2ccccc2C1NC(=O)[C@H](Cc1ccccc1)C[Si](O)(O)C[C@@H](Cc1ccccc1)C(=O)NC1C(O)Cc2ccccc12 |r|
Structure:
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