Interaction Scheme
Molecule
5-Bromo-2-adamantanone
c = 2.5 µM
Host
CB7
c = 0.25 µM
Indicator
Berberine chloride
c = 15.5 µM
Binding Properties
| 𝜈 | Molecule 1 : 1 Host | ||
| Ka = | 3.06⋅108 | M-1 | |
| Kd = | |||
| logKa = | |||
| T | 25.0 °C | ||
| kin= | 550000.0 | ± 55000.0 | M-1s-1 |
| kout= | 0.00179738562091503 | ± 0.00018 | s-1 |
| Energy | kJ mol-1 | kcal mol-1 | |||
|---|---|---|---|---|---|
| ΔG | = | -48.44 | -11.58 |
- Comment
- kinetic simultaneous analyte indicator binding assay
These are the specifications of the determination of the experimental results.
| Detection Method: | Competitive | |||
| Assay Type: | Competitive Binding Assay | |||
| Technique: | Fluorescence | |||
| 𝛌ex | = | 420.0 nm | ||
| 𝛌em | = | 500.0 nm | ||
Detailed information about the solvation.
| Solvent System | Single Solvent |
| Solvent | water |
| pH | 7.0 |
Please find here information about the dataset this interaction is part of.
| Citation: |
Z. Miskolczy, L. Biczok, F. Biedermann, M. Megyesi, S. Sinn, SupraBank 2024, Simultaneous analyte indicator binding assay (SBA) for the monitoring of reversible host–guest complexation kinetics (dataset). https://doi.org/10.34804/supra.20220717460 |
| Link: | https://doi.org/10.34804/supra.20220717460 |
| Export: | BibTex | RIS | EndNote |
Please find here information about the scholarly article describing the results derived from that data.
| Citation: |
Z. Miskolczy, M. Megyesi, S. Sinn, F. Biedermann, L. Biczók, Chem. Commun. 2021, 57, 12663–12666. |
| Link: | https://doi.org/10.1039/D1CC04888K |
| Export: | BibTex | RIS | EndNote | |
Binding Isotherm Simulations
The plot depicts the binding isotherm simulation of a 1:1 interaction of 5-Bromo-2-adamantanone (6.5359477124183e-08 M) and CB7 (0 — 1.30718954248366e-07 M).
Please sign in: customize the simulation by signing in to the SupraBank.
