Interaction

curated

Interaction Scheme

Molecule

Bo
BO

c = 9.06 µM

Host

Cb7
CB7

c = 0.0 — 190.0 µM

Binding Properties

𝜈 Molecule 1 : 1 Host
Ka = 1.21⋅104 ± 2000.0 M-1
Kd =
logKa = 4.08 ± 0.07
T 25.0 °C ≈ 298 K
Energy kJ mol-1 kcal mol-1
ΔG = -23.3 ± 0.41 -5.57 ± 0.1
These are the specifications of the determination of the experimental results.
Detection Method: Direct
Assay Type: Direct Binding Assay
Technique: Absorbance
Detailed information about the solvation.
Solvent System Single Solvent
Solvent water
pH 12.0
Please find here information about the dataset this interaction is part of.
Citation:

Z. Miskolczy, L. Biczók, M. Megyesi, SupraBank 2024, Kinetics of base-promoted transformation of berberrubine-cucurbit[7]uril inclusion complex: Active role of alkali cations (dataset). https://doi.org/10.34804/supra.20230623476

Link: https://doi.org/10.34804/supra.20230623476
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Please find here information about the scholarly article describing the results derived from that data.
Citation:

Z. Miskolczy, M. Megyesi, L. Biczók, Journal of Molecular Liquids 2023, 385, 122354.

Link: https://doi.org/10.1016/j.molliq.2023.122354
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Binding Isotherm Simulations

The plot depicts the binding isotherm simulation of a 1:1 interaction of BO (0.001652892561983471 M) and CB7 (0 — 0.003305785123966942 M).