Interaction Scheme

Molecule

Artkqtark%28me3%29stgy
ARTKQTARK(me3)STGY

Host

Scx4 nhco%284 br%29ph
sCx4-NHCO(4-Br)Ph

Indicator

Lucigenin
Lucigenin

Binding Properties

𝜈 Molecule 1 : 1 Host
Ka = 1.10⋅106 ± 9.70⋅104 M-1
Kd =
logKa = 6.04 ± 0.04
T 25.0 °C 298 K
Energy kJ mol-1 kcal mol-1
ΔG = -34.48 ± 0.22 -8.24 ± 0.05
These are the specifications of the determination of the experimental results.
Detection Method: Competitive
Assay Type: Competitive Binding Assay
Technique: Fluorescence
𝛌ex = 369.0 nm
𝛌em = 485.0 nm
Detailed information about the solvation.
Solvent System Buffer System 10 mM phosphate pH-7.4
Solvents water 100.0 %
Additives Disodium phosph... 7.5 mM
Sodium dihydro... 2.5 mM
Source of Concentration
Total concentration 10.0 mM
pH 7.4
Please find here information about the dataset this interaction is part of.
Citation:

F. Hof, H. Allen, K. Daze, T. Shimbo, A. Lai, C. Musselman, J. Sims, P. Wade, T. Kutateladze, SupraBank 2024, Inhibition of histone binding by supramolecular hosts (dataset). https://doi.org/10.34804/supra.20210928134

Link: https://doi.org/10.34804/supra.20210928134
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Please find here information about the scholarly article describing the results derived from that data.
Citation:

H. F. Allen, K. D. Daze, T. Shimbo, A. Lai, C. A. Musselman, J. K. Sims, P. A. Wade, F. Hof, T. G. Kutateladze, Biochemical Journal 2014, 459, 505–512.

Link: https://doi.org/10.1042/BJ20140145
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Binding Isotherm Simulations


The plot depicts the binding isotherm simulation of a 1:1 interaction of ARTKQTARK(me3)STGY (1.8181818181818182e-05 M) and sCx4-NHCO(4-Br)Ph (0 — 3.6363636363636364e-05 M).