Interaction Scheme
Molecule
1-adamantane carboxylate
Host
β-CD
Binding Properties
| 𝜈 | Molecule 1 : 1 Host | ||
| Ka = | 2.00⋅104 | M-1 | |
| Kd = | |||
| logKa = | |||
| T | 25.0 °C | ||
| Energy | kJ mol-1 | kcal mol-1 | |||
|---|---|---|---|---|---|
| ΔG | = | -24.55 | -5.87 | ||
| ΔH | = | -25.9 | -6.19 | ||
| -TΔS | = | 1.38 | 0.33 | ||
| J mol-1 K-1 | cal mol-1 K-1 | ||||
| ΔS | = | -4.6 | -1.1 | ||
These are the specifications of the determination of the experimental results.
| Detection Method: | Direct | ||
| Assay Type: | Direct Binding Assay | ||
| Technique: | Isothermal Titration Calorimetry | ||
| Molecule: | syringe | ||
| Partner: | cell | ||
Detailed information about the solvation.
| Solvent System | Buffer System |
| Solvents | water |
| Additives | hydrogenphosphate |
| dihydrogen phos... | |
| Source of Concentration | |
| Total concentration | 30.0 mM |
| pH | 7.2 |
Please find here information about the dataset this interaction is part of.
| Citation: |
J. C. Harrison, M. R. Eftink, SupraBank 2024, Cyclodextrin-adamantanecarboxylate inclusion complexes: A model system for the hydrophobic effect (dataset). https://doi.org/10.34804/supra.20210928266 |
| Link: | https://doi.org/10.34804/supra.20210928266 |
| Export: | BibTex | RIS | EndNote |
Please find here information about the scholarly article describing the results derived from that data.
| Citation: |
J. C. Harrison, M. R. Eftink, Biopolymers 1982, 21, 1153–1166. |
| Link: | https://doi.org/10.1002/bip.360210611 |
| Export: | BibTex | RIS | EndNote |
Binding Isotherm Simulations
The plot depicts the binding isotherm simulation of a 1:1 interaction of 1-adamantane carboxylate (0.001 M) and β-CD (0 — 0.002 M).
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