Acta Chimica Sinica ›› 2009, Vol. 67 ›› Issue (17): 1967-1972. Previous Articles     Next Articles

Original Articles

盐酸环丙沙星与胰蛋白酶相互作用的光谱和分子模拟研究

王公轲 闫长领 卢秀敏 陈得军 卢 雁

  

  1. (河南师范大学化学与环境科学学院 新乡 453007)

  • 投稿日期:2009-01-16 修回日期:2009-05-18 发布日期:2009-09-14
  • 通讯作者: 卢雁

Study on the Interaction of Ciprofloxacin Hydrochloride with Trypsin by Spectroscopic and Molecular Modeling Methods

Wang, Gongke Yan, Changling Lu, Xiumin Chen, Dejun Lu, Yan*   

  1. (College of Chemistry and Environmental Science, Henan Normal University, Xinxiang 453007)
  • Received:2009-01-16 Revised:2009-05-18 Published:2009-09-14
  • Contact: Lu, Yan

The interaction between ciprofloxacin hydrochloride (CPFX) and trypsin was investigated by fluorescence and UV absorption spectroscopy and molecular modeling methods at different temperatures (288, 298 and 308 K). Results obtained in the study indicate that CPFX has a strong ability to quench the intrinsic fluorescence of trypsin through a static quenching procedure. The fluorescence data were treated by using the double logarithmic equation, and the binding constants K of the interaction of CPFX with trypsin and the number of binding sites n were obtained. With the UV absorption spectrum, the changes of the conformation of trypsin caused by CPFX were analyzed. The thermodynamic parameters of the interaction between CPFX and trypsin at different temperatures were calculated with thermodynamic equations, which show that the binding forces between CPFX and trypsin are mainly hydrophobic interaction and hydrogen bonding. The result of molecular modeling is in good agreement with that of the thermodynamic study.

Key words: ciprofloxacin hydrochloride, trypsin, fluorescence quenching, UV absorption spectrum, molecular modeling

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