Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50066919
Substrate
n/a
Meas. Tech.
ChEMBL_158026 (CHEMBL768619)
Ki
2.3±n/a nM
Kd
27.4±n/a nM
KON
205000000 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 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:
BDBM50066919
Synonyms:
(2R,3R,4R,5R)-2,5-Bis-benzyloxy-3,4-dihydroxy-hexanedioic acid bis-[((S)-methylcarbamoyl-phenyl-methyl)-amide] | 2,5-Bis-benzyloxy-3,4-dihydroxy-hexanedioic acid bis-[(methylcarbamoyl-phenyl-methyl)-amide] | CHEMBL124093
Type:
Small organic molecule
Emp. Form.:
C38H42N4O8
Mol. Mass.:
682.7621
SMILES:
CNC(=O)[C@@H](NC(=O)[C@H](OCc1ccccc1)[C@H](O)[C@@H](O)[C@@H](OCc1ccccc1)C(=O)N[C@H](C(=O)NC)c1ccccc1)c1ccccc1
Structure:
Search PDB for entries with ligand similarity: