Interaction Scheme
Molecule
Sodium triflate
c = 0.0 — 7750.0 µM
Host
P1
c = 500.0 µM
Cofactor
1-carboxyadamantane
c = 525.0 µM
Binding Properties
| 𝜈 | Molecule 1 : 1 Host | ||
| Ka = | 710.0 | M-1 | |
| Kd = | |||
| logKa = | |||
| T | 25.0 °C | ||
| Energy | kJ mol-1 | kcal mol-1 | |||
|---|---|---|---|---|---|
| ΔG | = | -16.28 | ± NaN | -3.89 | ± NaN |
These are the specifications of the determination of the experimental results.
| Detection Method: | Direct | ||
| Assay Type: | Associative Binding Assay | ||
| Technique: | Nuclear Magnetic Resonance | ||
| Nucleus | 1H | ||
Detailed information about the solvation.
| Solvent System | Buffer System | 10 mM deuterated phosphate pD-7.3 |
| Solvents | Deuterium Oxide | |
| Additives | Disodium hydrog... | 7.1 mM |
| Sodium dihydrog... | 2.9 mM | |
| Source of Concentration | ||
| Total concentration | 10.0 mM | |
| pH | 7.3 |
Please find here information about the dataset this interaction is part of.
| Citation: |
C. L. D. Gibb, B. Gibb, J. Jordan, A. Wishard, T. Pham, SupraBank 2024, Ion–Hydrocarbon and/or Ion–Ion Interactions: Direct and Reverse Hofmeister Effects in a Synthetic Host (dataset). https://doi.org/10.34804/supra.2021092870 |
| Link: | https://doi.org/10.34804/supra.2021092870 |
| Export: | BibTex | RIS | EndNote |
Please find here information about the scholarly article describing the results derived from that data.
| Citation: |
J. H. Jordan, C. L. D. Gibb, A. Wishard, T. Pham, B. C. Gibb, J. Am. Chem. Soc. 2018, 140, 4092–4099. |
| Link: | https://doi.org/10.1021/jacs.8b00196 |
| Export: | BibTex | RIS | EndNote | |
Binding Isotherm Simulations
The plot depicts the binding isotherm simulation of a 1:1 interaction of Sodium triflate (0.028169014084507043 M) and P1 (0 — 0.056338028169014086 M).
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