Reaction Details Report a problem with these data
Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50505279
Substrate
n/a
Meas. Tech.
ChEMBL_2266436
Ki
0.500000±n/a nM
Citation
 Graham, BJ; Windsor, IW; Raines, RT Inhibition of HIV-1 Protease by a Boronic Acid with High Oxidative Stability. ACS Med Chem Lett 14:171-175 (2023) [PubMed] 
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:
BDBM50505279
Synonyms:
CHEMBL4436207
Type:
Small organic molecule
Emp. Form.:
C27H37BN2O9S
Mol. Mass.:
576.467
SMILES:
[H][C@@]12CCO[C@]1([H])OC[C@@H]2OC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN(CC(C)C)S(=O)(=O)c1ccc(cc1)B(O)O |r|
Structure:
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