Reaction Details  Report a problem with these data
Cell Reactant:
HIV-1 Protease B Subtype Mutant (V82F/I84V)
Syringe Reactant:
BDBM580
Meas. Tech.:
Isothermal Titration Calorimetry
Entry Date.:
2004-06-22
ΔG°:
-54.3400±n/a (kJ/mole)
pH:
5.0000±n/a
Log10Kb:
8.1
Temperature:
298.1500±n/a (K)
ΔH° :
-24.2440±n/a (kJ/mole)
ΔHobs :
-24.2440±n/a (kJ/mole)
Corrected for ΔHioniz:
not known
ΔS° :
0.1010±n/a (kJ/mole-K)
Comments:
In displacement titration, inhibitors were injected into the calorimetric cell containing the protein prebound to a weak inhibitor acetylpepstatin.
Citation
 Velazquez-Campoy, A; Vega, S; Freire, E Amplification of the effects of drug resistance mutations by background polymorphisms in HIV-1 protease from African subtypes. Biochemistry 41:8613-9 (2002) [PubMed]  Article
Cell React
Source:
Plasmid-encoded HIV-1 protease was expressed in E. coli cells.
Purity:
99%
Prep. Method:
HIV-1 protease was purified and refolded from E. coli inclusion bodies.
Name:
HIV-1 Protease B Subtype Mutant (V82F/I84V)
Synonyms:
n/a
Type:
Protein Complex
Mol. Mass.:
n/a
Description:
n/a
Components:
This complex has 2 components.
Component 1
Name:
HIV-1 Protease B Subtype Mutant (V82F/I84V) chain A
Synonyms:
HIV-1 Protease Mutant (Q7K/V82F/I84V) | HIV-1 Protease B Subtype Mutant (V82F/I84V) chain B
Type:
Enzyme Subunit
Mol. Mass.:
10816.23
Organism:
Human immunodeficiency virus type 1
Description:
n/a
Residue:
99
Sequence:
PQVTLWKRPLVTIKIGGQLKEALLDTGADDTVLEEMSLPGRWKPKMIGGIGGFIKVRQYDQILIEICGHKAIGTVLVGPTPFNVIGRNLLTQIGCTLNF
  
Component 2
Name:
HIV-1 Protease B Subtype Mutant (V82F/I84V) chain A
Synonyms:
HIV-1 Protease Mutant (Q7K/V82F/I84V) | HIV-1 Protease B Subtype Mutant (V82F/I84V) chain B
Type:
Enzyme Subunit
Mol. Mass.:
10816.23
Organism:
Human immunodeficiency virus type 1
Description:
n/a
Residue:
99
Sequence:
PQVTLWKRPLVTIKIGGQLKEALLDTGADDTVLEEMSLPGRWKPKMIGGIGGFIKVRQYDQILIEICGHKAIGTVLVGPTPFNVIGRNLLTQIGCTLNF
  
Syringe React
Source:
From Dr. Kiso, Department of Medicinal Chemistry, Kyoto Pharmaceutical University, Kyoto, Japan).
Prep. Method:
were used without further purification
Name:
BDBM580
Synonyms:
AG1776 | (4R)-3-[(2S,3S)-2-hydroxy-3-[(3-hydroxy-2-methylphenyl)formamido]-4-phenylbutanoyl]-5,5-dimethyl-N-[(2-methylphenyl)methyl]-1,3-thiazolidine-4-carboxamide | BDBM50288366 | JE-2147 | KNI-764
Type:
Small organic molecule
Emp. Form.:
TBD
Mol. Mass.:
TBD
SMILES:
TBD
Structure:
Search PDB for entries with ligand similarity: