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Reaction Details
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TargetHIV-1 Protease
LigandBDBM716
Substrate/CompetitorHIV-1 Protease substrate
Meas. Tech.Protease Inhibition Assay
pH6±n/a
Temperature310.15±n/a K
Ki 8.91±n/a nM
Citation Mimoto, TKato, RTakaku, HNojima, STerashima, KMisawa, SFukazawa, TUeno, TSato, HShintani, MKiso, YHayashi, H Structure-activity relationship of small-sized HIV protease inhibitors containing allophenylnorstatine. J Med Chem42:1789-802 (1999) [PubMed]  Article
More Info.:Get all data from this article,  Inhibition_Run data,   Solution Info,  Assay Method
 
HIV-1 Protease
Name:HIV-1 Protease
Synonyms:n/a
Type:Protein Complex
Mol. Mass.:n/a
Description:n/a
Components:This complex has 2 components.
Component 1
Name:HIV-1 Protease chain A
Synonyms:HIV-1 Protease (NY5-type sequence)
Type:Enzyme Subunit
Mol. Mass.:10822.21
Organism:Human immunodeficiency virus type 1
Description:n/a
Residue:99
Sequence:
PQITLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMNLPGRWKPKMIGGIGGFIKVRQYD
QILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
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Component 2
Name:HIV-1 Protease chain A
Synonyms:HIV-1 Protease (NY5-type sequence)
Type:Enzyme Subunit
Mol. Mass.:10822.21
Organism:Human immunodeficiency virus type 1
Description:n/a
Residue:99
Sequence:
PQITLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMNLPGRWKPKMIGGIGGFIKVRQYD
QILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
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BDBM716
NameBDBM716
Synonyms:(4R)-3-[(2S,3S)-2-hydroxy-3-[(3-hydroxy-2-methylphenyl)formamido]-4-phenylbutanoyl]-N-[(2-methylphenyl)methyl]-1,3-thiazolidine-4-carboxamide | (R)-N-(2-Methylbenzyl)-3-{(2S,3S)-2-hydroxy-3-(3-hydroxy-2-methylbenzoyl)amino-4-phenylbutanoyl]-1,3-thiazolidine-4-carboxamide | KNI-764 analog | allophenylnorstatine deriv. 13
TypeSmall organic molecule
Emp. Form.C30H33N3O5S
Mol. Mass.547.665
SMILESCc1ccccc1CNC(=O)[C@@H]1CSCN1C(=O)[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(O)c1C |r|
Structure
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HIV-1 Protease substrate
Name:HIV-1 Protease substrate
Synonyms:n/a
Type:Peptide
Mol. Mass.:2535.82
Organism:Synthetic peptide
Description:n/a
Residue:22
Sequence:
H-Ser-Gln-Asn-Tyr-Pro-Ile-Val-OH
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