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جستجوی مقالات
سه شنبه 15 مهر 1404
Physical Chemistry Research
، جلد ۹، شماره ۳، صفحات ۴۲۷-۴۴۶
عنوان فارسی
چکیده فارسی مقاله
کلیدواژههای فارسی مقاله
عنوان انگلیسی
Insights into Platinum Complex-HSA Bindings: Spectral and Molecular Dynamics Simulation Studies
چکیده انگلیسی مقاله
Mutual interactions of human serum albumin (HSA) with the two binuclear platinum complexes, containing [(bhq)Pt(dppm)2(Cl)Pt(bhq)(Cl)] (1) and [(bhq)Pt(dppm)2(PhMe)Pt(bhq)(CO2CF3)] (2), in which bhq=benzo[h]quinoline, and dppm=bis(diphenylphosphino) methane, were thoroughly investigated using spectroscopic and molecular modeling techniques. In this respect, fluorescence, Ultraviolet-Visible (UV-Vis) and circular dichroism (CD) spectroscopies, along with the docking and molecular dynamics simulations (MD) were utilized.
Analysis of spectroscopic and MD simulation results revealed the structural alterations of HSA, upon binding to the binuclear platinum complexes, while the hydrogen bonding and van der Waals forces were found to mainly contribute to the protein-ligand intermolecular interactions. Results of far-UV CD measurements showed the strong ability of platinum complexes, in reducing the α-helical content of HSA, while other secondary structural features were increased.
Due to their different chemical natures, these complexes bind to HSA in different manners. Binding constants and thermodynamic binding parameters between these complexes and HSA were calculated using the Stern−Volmer and van’t Hoff equations. Calculated thermodynamic binding parameters indicated that the interaction is spontaneous and enthalpy driven, through the static and dynamic quenching mechanisms, for complexes 1 and 2, respectively.
کلیدواژههای انگلیسی مقاله
Protein-ligand interaction,HSA,Platinum complex,Fluorescence spectroscopy,Molecular Dynamics Simulation
نویسندگان مقاله
Abolfazl Ashrafi |
Department of Chemistry, Shiraz University of Technology, Shiraz 71555-313, Iran
Mohamad Mehdi Alavianmehr |
Department of Chemistry, Shiraz University of Technology, Shiraz 71555-313, Iran
Delara Mohammad-Aghaie |
Department of Chemistry, Shiraz University of Technology, Shiraz 71555-313, Iran
Reza Yousefi |
Protein Chemistry Laboratory (PCL), Department of Biology, Shiraz University, Shiraz 71454, Iran
Mohsen Golbon Haghighi |
Department of Chemistry, Shahid Beheshti University, Evin, Tehran 19839-69411, Iran
Ali Akbar Moosavi-Movahedi |
Institute of Biochemistry and Biophysics (IBB), University of Tehran, Tehran, Iran
Navid Soltani Rad |
Department of Chemistry, Shiraz University of Technology, Shiraz 71555-313, Iran
نشانی اینترنتی
https://www.physchemres.org/article_129261_ab40b98d16fe2a55320bca3e8032746f.pdf
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