Study on Interaction between 5-Bromo-4-thio-2'-deoxyuridine and human serum albumin by spectroscopy and molecular docking.

Xiaohui Zhang,Ruiqi Gao,Depeng Li,Hongyan Yin,Juling Zhang,Hongyu Cao,Xuefang Zheng

Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy（2015）

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摘要

•The interaction between 4-SBrdU and HSA was investigated by spectroscopy and molecular docking under physiological condition.•Binding constants and the number of binding sites were calculated using Stern–Volmer equations.•Thermodynamic data showed the main force was typical dynamic and hydrophobic interaction.•The experimental results were in correspondence with molecular docking theory.

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关键词

5-Bromo-4-thio-2′-deoxyuridine (4-SBrdU),Human serum albumin (HSA),Nucleoside,Fluorescence spectroscopy,Molecular docking

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