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Prediction of Dissociation Constant in Protein-Ligand Interaction.pdf (516.36 kB)

Prediction of Dissociation Constant in Protein-Ligand Interaction

preprint
submitted on 05.03.2021, 04:22 and posted on 05.03.2021, 13:11 by Masatoshi Kawashima
In protein-ligand interactions, such as antigen-antibody interactions and hormone-receptor interactions, a correlation between the equilibrium dissociation constant KD and the reduced mass of the protein and ligand was found. The correlation of dissociation constants as pKD (-logKD) between literature values and predicted values was confirmed in high coefficient of determination R2 over 0.98.

History

Email Address of Submitting Author

kawashima@azuma-g.co.jp

Institution

Azuma Co., Ltd.

Country

Japan

ORCID For Submitting Author

0000-0002-1849-2053

Declaration of Conflict of Interest

No conflict of interest

Version Notes

20210305-1

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ChemRxiv

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