Interaction Scheme
Molecule
4-Methylbenzylamine
c = 8.23 µM
Host
CB6
c = 1.05 µM
Indicator
DSMI
c = 2.08 µM
Binding Properties
| 𝜈 | Molecule 1 : 1 Host | ||
| Ka = | 5.13⋅107 | M-1 | |
| Kd = | |||
| logKa = | |||
| T | 25.0 °C | ||
| kin= | 33300.0 | ± 300.0 | M-1s-1 |
| kout= | 0.000649122807017544 | ± 5.0e-06 | s-1 |
| Energy | kJ mol-1 | kcal mol-1 | |||
|---|---|---|---|---|---|
| ΔG | = | -44.01 | -10.52 |
- Comment
- kinetic indicator displacement assay
These are the specifications of the determination of the experimental results.
| Detection Method: | Competitive | |||
| Assay Type: | Competitive Binding Assay | |||
| Technique: | Fluorescence | |||
| 𝛌ex | = | 519.0 nm | ||
| 𝛌em | = | 575.0 nm | ||
Detailed information about the solvation.
| Solvent System | Complex Mixture | |
| Solvents | water | |
| Additives | hydrochloric acid | 0.00823 mM |
| Total concentration | 0.00823 mM | |
| pH | 7.0 |
Please find here information about the dataset this interaction is part of.
| Citation: |
Z. Miskolczy, L. Biczok, L. M. Grimm, F. Biedermann, M. Megyesi, S. Sinn, S. Braese, A. Prabodh, SupraBank 2024, Teaching indicators to unravel the kinetic features of host–guest inclusion complexes (dataset). https://doi.org/10.34804/supra.20220717459 |
| Link: | https://doi.org/10.34804/supra.20220717459 |
| Export: | BibTex | RIS | EndNote |
Please find here information about the scholarly article describing the results derived from that data.
| Citation: |
A. Prabodh, S. Sinn, L. Grimm, Z. Miskolczy, M. Megyesi, L. Biczók, S. Bräse, F. Biedermann, Chem. Commun. 2020, 56, 12327–12330. |
| Link: | https://doi.org/10.1039/D0CC03715J |
| Export: | BibTex | RIS | EndNote | |
Binding Isotherm Simulations
The plot depicts the binding isotherm simulation of a 1:1 interaction of 4-Methylbenzylamine (3.898635477582846e-07 M) and CB6 (0 — 7.797270955165692e-07 M).
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