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Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50121496
Substrate
n/a
Meas. Tech.
ChEMBL_158026 (CHEMBL768619)
Ki
2.1±n/a nM
Kd
102±n/a nM
KON
304000 M-1s-1
Citation
 Markgren, PO; Schaal, W; Hämäläinen, M; Karlén, A; Hallberg, A; Samuelsson, B; Danielson, UH Relationships between structure and interaction kinetics for HIV-1 protease inhibitors. J Med Chem 45:5430-9 (2002) [PubMed]  Article 
Target
Name:
Gag-Pol polyprotein [489-587]
Synonyms:
Human immunodeficiency virus type 1 protease | POL_HV1H2 | Pol polyprotein | gag-pol
Type:
Enzyme Subunit
Mol. Mass.:
10781.16
Organism:
Human immunodeficiency virus type 1
Description:
P04585[489-587]
Residue:
99
Sequence:
PQVTLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMSLPGRWKPKMIGGIGGFIKVRQYDQILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
  
Inhibitor
Name:
BDBM50121496
Synonyms:
2-({2,5-Bis-benzyloxy-5-[(1-carboxy-2-methyl-propyl)-methyl-carbamoyl]-3-hydroxy-pentanoyl}-methyl-amino)-3-methyl-butyric acid | CHEMBL150907
Type:
Small organic molecule
Emp. Form.:
C32H44N2O9
Mol. Mass.:
600.6998
SMILES:
CC(C)C(N(C)C(=O)[C@@H](C[C@@H](O)[C@@H](OCc1ccccc1)C(=O)N(C)C(C(C)C)C(O)=O)OCc1ccccc1)C(O)=O
Structure:
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