Reaction Details | |||
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Cell Reactant: | Caspase-3 | ||
Syringe Reactant: | BDBM19728 | ||
Meas. Tech.: | Isothermal Titration Calorimetry | ||
Entry Date: | 12/19/07 | ||
ΔG°: | -40.4± (kJ/mole) | ||
pH: | 7.2±n/a | ||
Log10Kb: | 7.09± 6.40 | ||
Temperature: | 298.15±n/a (K) | ||
ΔH° : | n/a | ||
ΔHobs : | -10.3±0.125 (kJ/mole) | ||
Ionic Strength: | n/a | ||
no | |||
Protons Released: | n/a | ||
ΔCp : | n/a | ||
Stoich. Param.: | 1.14 | ||
ΔS° : | 0.1011± (kJ/mole-K) | ||
Comments: | n/a | ||
Citation | Aulabaugh, A; Kapoor, B; Huang, X; Dollings, P; Hum, WT; Banker, A; Wood, A; Ellestad, G Biochemical and biophysical characterization of inhibitor binding to caspase-3 reveals induced asymmetry. Biochemistry46:9462-71 (2007) [PubMed] Article | ||
More Info.: | Get all data from this article , ITC RUN data , Solution Info , Data Fit Method , Instrument Info | ||
Caspase-3 | |||
Source: | The DNA sequence encoding the caspase-3 catalytic domain with a C-terminal hexa-His tag was cloned and expressed in Escherichia coli BL21 (DE3) cells. | ||
Purity: | >95% | ||
Prep. Method: | The cell extracts were further purified by Ni-NTA agarose and gel-filtration columns. The purified caspase-3 showed 2 subunits of 20 and 10 kDa on reduced SDS-PAGE. | ||
Name: | Caspase-3 | ||
Synonyms: | Apopain | CASP-3 | CASP3 | CASP3_HUMAN | CPP-32 | CPP32 | Caspase 3 | Caspase-3 subunit p12 | Caspase-3 subunit p17 | Cysteine protease CPP32 | SCA-1 | SREBP cleavage activity 1 | Yama protein | caspase-3 preproprotein | ||
Type: | Hydrolase; heterotetramer of two heterodimers | ||
Mol. Mass.: | 31607.55 | ||
Organism: | Homo sapiens (Human) | ||
Description: | n/a | ||
Residue: | 277 | ||
Sequence: |
| ||
BDBM19728 | |||
Source: | n/a | ||
Purity: | n/a | ||
Prep. Method: | n/a | ||
Name | BDBM19728 | ||
Synonyms: | (3S)-3-[(1R)-1-[3-(naphthalene-2-amido)-2-oxo-1,2-dihydropyridin-1-yl]-1-phenylacetamido]-4-oxo-5-phenoxypentanoic acid | PEP-1 | ||
Type | Small organic molecule | ||
Emp. Form. | C35H29N3O7 | ||
Mol. Mass. | 603.6207 | ||
SMILES | OC(=O)C[C@H](NC(=O)[C@@H](c1ccccc1)n1cccc(NC(=O)c2ccc3ccccc3c2)c1=O)C(=O)COc1ccccc1 |r| | ||
Structure |
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