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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Cell Reactant: | v-Src SH2 Domain | ||
| Syringe Reactant: | BDBM22596 | ||
| Meas. Tech.: | Isothermal Titration Calorimetry | ||
| Entry Date: | 06/14/08 | ||
| ΔG°: | -39.9± (kJ/mole) | ||
| pH: | 6±n/a | ||
| Log10Kb: | 7± 6.00 | ||
| Temperature: | 298.15±n/a (K) | ||
| ΔH° : | n/a | ||
| ΔHobs : | -34.8±0.150 (kJ/mole) | ||
| Ionic Strength: | n/a | ||
| no | |||
| Protons Released: | n/a | ||
| ΔCp : | n/a | ||
| Stoich. Param.: | n/a | ||
| ΔS° : | 0.0171± (kJ/mole-K) | ||
| Comments: | n/a | ||
| Citation |  Taylor, JD; Gilbert, PJ; Williams, MA; Pitt, WR; Ladbury, JE Identification of novel fragment compounds targeted against the pY pocket of v-Src SH2 by computational and NMR screening and thermodynamic evaluation. Proteins67:981-90 (2007) [PubMed] Article | ||
| More Info.: | Get all data from this article , ITC RUN data , Solution Info , Data Fit Method , Instrument Info | ||
| v-Src SH2 Domain | |||
| Source: | n/a | ||
| Purity: | n/a | ||
| Prep. Method: | n/a | ||
| Name: | Tyrosine-protein kinase transforming protein Src | ||
| Synonyms: | SRC_RSVSA | V-SRC | p60-Src | v-Src SH2 Domain | ||
| Type: | SH2 Domain | ||
| Mol. Mass.: | 58884.32 | ||
| Organism: | Avian leukosis virus (RSA) | ||
| Description: | P00524 | ||
| Residue: | 526 | ||
| Sequence: |
| ||
| BDBM22596 | |||
| Source: | n/a | ||
| Purity: | n/a | ||
| Prep. Method: | n/a | ||
| Name | BDBM22596 | ||
| Synonyms: | (4S)-4-{[(1S)-1-{[(2S)-1-[(2S)-2-{[(1S)-1-carbamoyl-2-methylbutyl]carbamoyl}pyrrolidin-1-yl]-3-methyl-1-oxopentan-2-yl]carbamoyl}-3-carboxypropyl]carbamoyl}-4-[(2S)-2-[(2S)-2-{[(2S)-1-acetylpyrrolidin-2-yl]formamido}pentanediamido]-3-[4-(phosphonooxy)phenyl]propanamido]butanoic acid | Ac-PQpYEEIPI-NH2 | ||
| Type | Phosphotyrosyl peptide | ||
| Emp. Form. | C48H73N10O18P | ||
| Mol. Mass. | 1109.1232 | ||
| SMILES | CCC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(C)=O)C(C)CC)C(N)=O | ||
| Structure | 
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