Target
Dimer of Gag-Pol polyprotein [482-580,I502K,I528M,T553A,V564F]
Ligand
BDBM578
Substrate
HIV Protease Chromogenic Peptide Substrate
Meas. Tech.
Protease Inhibition Assay
Ki
0.48±n/a nM
Citation
 Clemente, JCComan, RMThiaville, MMJanka, LKJeung, JANukoolkarn, SGovindasamy, LAgbandje-McKenna, MMcKenna, RLeelamanit, WGoodenow, MMDunn, BM Analysis of HIV-1 CRF_01 A/E protease inhibitor resistance: structural determinants for maintaining sensitivity and developing resistance to atazanavir. Biochemistry 45:5468-77 (2006) [PubMed]  Article 
Target
Name:
Dimer of Gag-Pol polyprotein [482-580,I502K,I528M,T553A,V564F]
Synonyms:
HIV-1 Protease AE Mutant (V82F) | HIV-1 Protease Mutant (V3I, I13V, E35D, M36I, S37N, R41K, H69K, V82F, L89M) | Pretherapy isolated AE protease mutant (V82F)
Type:
Protein Complex
Mol. Mass.:
n/a
Description:
HIV-1 protease DNA for all the HIV B and AE variants was cloned, and protein was expressed and purified from Escherichia coli strain BL21.
Components:
This complex has 2 components.
Component 1
Name:
Gag-Pol polyprotein [482-580,I502K,I528M,T553A,V564F]
Synonyms:
HIV-1 Protease AE Mutant (V82F) Chain A | HIV-1 Protease AE Mutant (V82F) Chain B | POL_HV1U4 | gag-pol
Type:
Enzyme Subunit
Mol. Mass.:
10805.72
Organism:
Human immunodeficiency virus type 1
Description:
P24740[482-580,I502K,I528M,T553A,V564F]
Residue:
99
Sequence:
PQITLWQRPLVTVKIGGQLKEALLDTGADDTVLEDINLPGKWKPKMIGGIGGFIKVRQYDQILIEICGKKAIGTVLVGPTPFNIIGRNMLTQIGCTLNF
  
Component 2
Name:
Gag-Pol polyprotein [482-580,I502K,I528M,T553A,V564F]
Synonyms:
HIV-1 Protease AE Mutant (V82F) Chain A | HIV-1 Protease AE Mutant (V82F) Chain B | POL_HV1U4 | gag-pol
Type:
Enzyme Subunit
Mol. Mass.:
10805.72
Organism:
Human immunodeficiency virus type 1
Description:
P24740[482-580,I502K,I528M,T553A,V564F]
Residue:
99
Sequence:
PQITLWQRPLVTVKIGGQLKEALLDTGADDTVLEDINLPGKWKPKMIGGIGGFIKVRQYDQILIEICGKKAIGTVLVGPTPFNIIGRNMLTQIGCTLNF
  
Inhibitor
Name:
BDBM578
Synonyms:
(2S)-N-[(2S,4S,5S)-5-[2-(2,6-dimethylphenoxy)acetamido]-4-hydroxy-1,6-diphenylhexan-2-yl]-3-methyl-2-(2-oxo-1,3-diazinan-1-yl)butanamide | ABT-378 | Aluviran | CHEMBL729 | LPV | Lopinavir
Type:
Small organic molecule
Emp. Form.:
C37H48N4O5
Mol. Mass.:
628.8008
SMILES:
CC(C)[C@H](N1CCCNC1=O)C(=O)N[C@H](C[C@H](O)[C@H](Cc1ccccc1)NC(=O)COc1c(C)cccc1C)Cc1ccccc1 |r|
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
HIV Protease Chromogenic Peptide Substrate
Synonyms:
n/a
Type:
Peptide
Mol. Mass.:
1420.11
Organism:
n/a
Description:
n/a
Residue:
13
Sequence:
KARVLNPHEANLG