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TargetHIV-1 protease
LigandBDBM104105
Substrate/Competitorn/a
Meas. Tech.Inhibition Assay
Ki 3.329±0.663 nM
Citation Shen, YAltman, MDAli, ANalam, MNCao, HRana, TMSchiffer, CATidor, B Testing the substrate-envelope hypothesis with designed pairs of compounds. ACS Chem Biol8:2433-41 (2013) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
HIV-1 protease
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:
PQITLWQRPLVTVKIGGQLREALLDTGADDTVLEDINLPGKWKPKMIGGIGGFIKVKQYE
QVLIEICGKKAIGTVLVGPTPVNIIGRNMLTQIGCTLNF
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  Blast E-value cutoff:
BDBM104105
n/a
NameBDBM104105
Synonyms:3-Hydroxy-N-[(1S,2R)-2-hydroxy-3-[[[5-(5-isoxazolyl)-2-thienyl]sulfonyl][(2S)-2- methylbutyl]amino]-1-(phenylmethyl)propyl]-benzamide (AF-71)
TypeSmall organic molecule
Emp. Form.C29H33N3O6S2
Mol. Mass.583.719
SMILESCC[C@H](C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(O)c1)S(=O)(=O)c1ccc(s1)-c1ccno1 |r|
Structure
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