Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetGag-Pol polyprotein [489-587]
LigandBDBM50366324
Substrate/Competitorn/a
Meas. Tech.ChEMBL_158026 (CHEMBL768619)
Ki 2.8±n/a nM
Kd 0.484±n/a nM
KON 6760000 M-1s-1
Citation Markgren, POSchaal, WHämäläinen, MKarlén, AHallberg, ASamuelsson, BDanielson, UH Relationships between structure and interaction kinetics for HIV-1 protease inhibitors. J Med Chem45:5430-9 (2002) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
Gag-Pol polyprotein [489-587]
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:
PQVTLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMSLPGRWKPKMIGGIGGFIKVRQYD
QILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50366324
n/a
NameBDBM50366324
Synonyms:CHEMBL1790545 | U-75875
TypeSmall organic molecule
Emp. Form.C45H61N7O7
Mol. Mass.812.0085
SMILESCC[C@@H](C)[C@H](NC(=O)[C@H](C(C)C)[C@@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)COc1cccc2ccccc12)C(=O)NCc1ccccn1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: