Reaction Details Report a problem with these data
Target
HIV-1 protease
Ligand
BDBM586095
Substrate
n/a
Meas. Tech.
Inhibition Assay
pH
5.6±0
Temperature
310.15±0 K
IC50
10±0.5 nM
Citation
 Brik, A; Lin, YC; Elder, J; Wong, CH A quick diversity-oriented amide-forming reaction to optimize P-subsite residues of HIV protease inhibitors. Chem Biol 9:891-6 (2002) [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:
BDBM586095
Synonyms:
P3-P3' Entry 13
Type:
n/a
Emp. Form.:
C52H54N4O10
Mol. Mass.:
895.006
SMILES:
CC(C)[C@H](NC(=O)c1ccc(o1)C(=O)c1ccccc1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)c1ccc(o1)C(=O)c1ccccc1)C(C)C
Structure:
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