Reaction Details  Report a problem with these data
Target
HIV-1 protease
Ligand
BDBM40775
Substrate
n/a
Meas. Tech.
Enzyme Inhibition Assay
Ki
3200±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:
BDBM40775
Synonyms:
Carbinol, 18a
Type:
Small organic molecule
Emp. Form.:
C35H38N2O3
Mol. Mass.:
534.6878
SMILES:
OC(C[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1 |r|
Structure:
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