𝜈 | Molecule 1 : 2 Host | ||
Ka = | 6.70⋅109 | ± 6.70⋅108 | M-2 |
Kd = | |||
logKa = | |||
T | 25.0 °C | ||
Energy | kJ mol-1 | kcal mol-1 | |||
---|---|---|---|---|---|
ΔG | = | -56.09 | ± 0.25 | -13.41 | ± 0.06 |
ΔH | = | -65.9 | ± 6.59 | -15.75 | ± 1.58 |
-TΔS | = | 9.8 | ± 0.98 | 2.34 | ± 0.23 |
J mol-1 K-1 | cal mol-1 K-1 | ||||
ΔS | = | -32.9 | ± 3.3 | -7.9 | ± 0.8 |
Detection Method: | Direct | ||
Assay Type: | Direct Binding Assay | ||
Technique: | Isothermal Titration Calorimetry | ||
Instrument: | NanoITC LV | ||
VCell | = | 190.0 𝜇L | |
Molecule: | syringe | ||
Partner: | cell |
Solvent System | Complex Mixture | |
Solvents | acetonitrile | 50.0 % |
1,2-dichloroethane | 50.0 % | |
Citation: |
A. Valkonen, K. Rissanen, H. Ke, W. Jiang, Y. Ma, SupraBank 2024, Achieving Strong Positive Cooperativity through Activating Weak Non‐Covalent Interactions (dataset). https://doi.org/10.34804/supra.20230310471 |
Link: | https://doi.org/10.34804/supra.20230310471 |
Export: | BibTex | RIS | EndNote |
Citation: |
Y. L. Ma, H. Ke, A. Valkonen, K. Rissanen, W. Jiang, Angew. Chem. Int. Ed. 2018, 57, 709–713. |
Link: | https://doi.org/10.1002/anie.201711077 |
Export: | BibTex | RIS | EndNote |
The plot depicts the binding isotherm simulation of a 1:1 interaction of 1,1'-(undecane-1,11-diyl)bis(1,4-diazabicyclo[2.2.2]octan-1-ium) (2.9850746268656717e-09 M) and syn oxatube (0 — 5.970149253731343e-09 M).