Target
HIV-1 protease
Ligand
BDBM81677
Substrate
n/a
Meas. Tech.
Inhibition Assay
Ki
760±0.0 nM
Citation
 Chellappan, SKiran Kumar Reddy, GSAli, ANalam, MNAnjum, SGCao, HKairys, VFernandes, MXAltman, MDTidor, BRana, TMSchiffer, CAGilson, MK Design of mutation-resistant HIV protease inhibitors with the substrate envelope hypothesis. Chem Biol Drug Des 69:298-313 (2007) [PubMed]  Article
Target
Name:
HIV-1 protease
Synonyms:
n/a
Type:
Protein
Mol. Mass.:
10653.94
Organism:
Human immunodeficiency virus
Description:
O90783
Residue:
98
Sequence:
PQVTLWQRPLVTIRVGGQLKEALLDTGADDTVLEDMNLPGRWKPKMIGGIGGFIKVRQYDQITVEICGHKAIGTVLVGPTPVNIIGRNLLTIGCTLNF
  
Inhibitor
Name:
BDBM81677
Synonyms:
CARB-KB32
Type:
Small organic molecule
Emp. Form.:
C25H35N3O7S
Mol. Mass.:
521.626
SMILES:
CNC(=O)CCC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN(C[C@@H](C)O)S(=O)(=O)c1cccc(OC)c1 |r|
Structure:
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