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TargetProtease
LigandBDBM50485122
Substrate/Competitorn/a
Meas. Tech.ChEMBL_818090 (CHEMBL2033732)
Ki 1.7±n/a nM
Citation Wu, XOhrngren, PJoshi, AATrejos, APersson, MArvela, RKWallberg, HVrang, LRosenquist, ASamuelsson, BBUnge, JLarhed, M Synthesis, X-ray analysis, and biological evaluation of a new class of stereopure lactam-based HIV-1 protease inhibitors. J Med Chem55:2724-36 (2012) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Protease
Name:Protease
Synonyms:n/a
Type:Enzyme
Mol. Mass.:10904.79
Organism:Human immunodeficiency virus 1 (HIV-1)
Description:Q9YQ12
Residue:99
Sequence:
PQITLWQRPFVTIKIEGQLKEALLDTGADDTVLEEMNLPGRWKPKMIGGIGGFIKVRQYD
QIVIEICGKKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
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  Blast E-value cutoff:
BDBM50485122
n/a
NameBDBM50485122
Synonyms:CHEMBL2030955
TypeSmall organic molecule
Emp. Form.C42H49N5O6
Mol. Mass.719.8684
SMILESCOC(=O)N[C@H](C(=O)NN(CC[C@]1(Cc2ccccc2)[C@@H](O)CN([C@@H]2[C@H](O)Cc3ccccc23)C1=O)Cc1ccc(cc1)-c1ccncc1)C(C)(C)C |r|
Structure
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