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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Cell Reactant: | BDBM18037 | ||
| Syringe Reactant: | Renin | ||
| Meas. Tech.: | Isothermal Titration Calorimetry | ||
| Entry Date: | 09/19/07 | ||
| ΔG°: | -8.63± (kcal/mole) | ||
| pH: | 7±n/a | ||
| Log10Kb: | 6.27± n/a | ||
| Temperature: | 301.15±n/a (K) | ||
| ΔH° : | n/a | ||
| ΔHobs : | -14.5± (kcal/mole) | ||
| Ionic Strength: | n/a | ||
| no | |||
| Protons Released: | n/a | ||
| ΔCp : | n/a | ||
| Stoich. Param.: | n/a | ||
| ΔS° : | -0.0200± (kcal/mole-K) | ||
| Comments: | n/a | ||
| Citation |  Sarver, RW; Peevers, J; Cody, WL; Ciske, FL; Dyer, J; Emerson, SD; Hagadorn, JC; Holsworth, DD; Jalaie, M; Kaufman, M; Mastronardi, M; McConnell, P; Powell, NA; Quin, J; Van Huis, CA; Zhang, E; Mochalkin, I Binding thermodynamics of substituted diaminopyrimidine renin inhibitors. Anal Biochem360:30-40 (2007) [PubMed] Article | ||
| More Info.: | Get all data from this article , ITC RUN data , Solution Info , Data Fit Method , Instrument Info | ||
| BDBM18037 | |||
| Source: | n/a | ||
| Purity: | n/a | ||
| Prep. Method: | n/a | ||
| Name | BDBM18037 | ||
| Synonyms: | 6-ethyl-2,4-diaminopyrimidine-based compound, 5 | 6-ethyl-5-[1-(3-methoxypropyl)-1,2,3,4-tetrahydroquinolin-7-yl]pyrimidine-2,4-diamine | diaminopyrimidine renin inhibitor compound, 2 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C19H27N5O | ||
| Mol. Mass. | 341.4506 | ||
| SMILES | CCc1nc(N)nc(N)c1-c1ccc2CCCN(CCCOC)c2c1 | ||
| Structure | 
| ||
| Renin | |||
| Source: | Recombinant human renin expressed in CHO cells | ||
| Purity: | Purified crystalizable protein. | ||
| Prep. Method: | Mature renin was eluted and loaded onto Blue Sepharose 6 Fast Flow. The unbound fraction containing renin was buffer exchanged and loaded onto POROS S/20. Renin was eluted and dialyzed. Purified renin was concentrated to 12 mg/mL and stored at -70C. | ||
| Name: | Renin | ||
| Synonyms: | Angiotensinogenase | REN | RENI_HUMAN | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 45058.99 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | n/a | ||
| Residue: | 406 | ||
| Sequence: |
| ||
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