Interaction Scheme
Molecule
1,8-ANS
Host
Octa-(6-O-(1-ethoxypropan-2-ol))-γ-CD
c = 10000.0 µM
Binding Properties
| 𝜈 | Molecule 1 : 1 Host | ||
| Ka = | 240.0 | ± 80.0 | M-1 |
| Kd = | |||
| logKa = | |||
| T | 21.0 °C | ||
| Energy | kJ mol-1 | kcal mol-1 | |||
|---|---|---|---|---|---|
| ΔG | = | -13.4 | ± 0.85 | -3.2 | ± 0.2 |
These are the specifications of the determination of the experimental results.
| Detection Method: | Direct | |||
| Assay Type: | Direct Binding Assay | |||
| Technique: | Fluorescence | |||
| 𝛌ex | = | 335.0 nm | ||
| 𝛌em | = | 500.0 nm | ||
| Ibound⁄Ifree | = | 17.0 | ||
Detailed information about the solvation.
| Solvent System | Buffer System | phosphate pH-6.8 |
| Solvents | water | |
| Source of Concentration | ||
| pH | 6.8 |
Please find here information about the dataset this interaction is part of.
| Citation: |
B. D. Wagner, S. J. Fitzpatrick, SupraBank 2024, A Comparison of the Host–Guest Inclusion Complexes of 1,8-ANS and 2,6-ANS in Parent and Modified Cyclodextrins - Journal of Inclusion Phenomena and Macrocyclic Chemistry (dataset). https://doi.org/10.34804/supra.20211007405 |
| Link: | https://doi.org/10.34804/supra.20211007405 |
| Export: | BibTex | RIS | EndNote |
Please find here information about the scholarly article describing the results derived from that data.
| Citation: |
B. D. Wagner, S. J. Fitzpatrick, Journal of Inclusion Phenomena and Macrocyclic Chemistry 2000, 38, 467–478. |
| Link: | https://doi.org/10.1023/A:1008198825835 |
| Export: | BibTex | RIS | EndNote |
Binding Isotherm Simulations
The plot depicts the binding isotherm simulation of a 1:1 interaction of 1,8-ANS (0.08333333333333333 M) and Octa-(6-O-(1-ethoxypropan-2-ol))-γ-CD (0 — 0.16666666666666666 M).
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