𝜈 | Molecule 1 : 1 Host | ||
Ka = | 228.0 | ± 10.0 | M-1 |
Kd = | 4.4 | ± 0.19 | mM |
logKa = | |||
T | 25.0 °C | ||
Energy | kJ mol-1 | kcal mol-1 | |||
---|---|---|---|---|---|
ΔG | = | -13.46 | ± 0.11 | -3.22 | ± 0.03 |
ΔH | = | -9.3 | ± 0.2 | -2.22 | ± 0.05 |
-TΔS | = | -4.2 | ± 0.2 | -1.0 | ± 0.05 |
J mol-1 K-1 | cal mol-1 K-1 | ||||
ΔS | = | 14.1 | ± 0.7 | 3.4 | ± 0.2 |
Detection Method: | Direct | ||
Assay Type: | Direct Binding Assay | ||
Technique: | Isothermal Titration Calorimetry | ||
Molecule: | cell | ||
Partner: | syringe |
Solvent System | Buffer System | 50 mM phosphate pH-6.9 |
Solvents | water | 100.0 % |
Additives | Disodium hydrog... | 25.0 mM |
Sodium dihydrog... | 25.0 mM | |
Source of Concentration | real | |
Total concentration | 50.0 mM | |
pH | 6.9 |
Citation: |
Y. Inoue, M. Rekharsky, SupraBank 2025, Chiral Recognition Thermodynamics of β-Cyclodextrin: The Thermodynamic Origin of Enantioselectivity and the Enthalpy−Entropy Compensation Effect (dataset). https://doi.org/10.34804/supra.20210928379 |
Link: | https://doi.org/10.34804/supra.20210928379 |
Export: | Bibtex | RIS | EndNote |
Citation: |
M. Rekharsky, Y. Inoue, J. Am. Chem. Soc. 2000, 122, 4418–4435. |
Link: | https://doi.org/10.1021/ja9921118 |
Export: | Bibtex | RIS | EndNote | |
The plot depicts the binding isotherm simulation of a 1:1 interaction of (S)-(+)-Benzyl glycidyl ether (0.08771929824561403 M) and β-CD (0 — 0.17543859649122806 M).