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三嗪铁和钌配合物的抗菌活性及与DNA的相互作用:光谱、伏安和理论研究

Antibacterial activity and DNA interaction of triazine iron and ruthenium complexes: spectroscopic, voltammetric and theoretical studies.

作者信息

Albaqami Faisal F, Sahib Ameer S, Alharthy Khalid M, Altharawi Ali, Alshahrani Mohammad Y, Jawad Mohammed Abed, Suliman Muath, Ahmad Irfan

机构信息

Pharmacology and Toxicology Department, College of Pharmacy, Prince Sattam Bin Abdulaziz University AlKharj 11942 Saudi Arabia.

Department of Pharmacy, Al-Mustaqbal University College 51001 Hilla Iraq.

出版信息

RSC Adv. 2023 Oct 10;13(42):29594-29606. doi: 10.1039/d3ra04152b. eCollection 2023 Oct 4.

Abstract

The 2,4,6-tris(2-pyridyl)-1,3,5-triazine (tptz), [Ru(μ-tptz)]Cl and [Fe(μ-tptz)]Cl, complexes containing Ru (1) and Fe (2) are created. Using electronic absorption spectroscopy, fluorescence spectroscopy, circular dichroism spectroscopy, viscosity measurement and electrochemistry, as well as two complexes with Fish Salmon DNA (FS-DNA), the binding interactions of these complexes were investigated. According to binding assays, complexes bind to DNA through a mild intercalation mechanism, most likely the DNA helix's base pairs being intercalated by the tptz ligand. Additionally, complex (2) is more capable of binding than complex (1). The electrochemical method offers a quick and easy way to determine the binding constant (). The antibacterial performance of these complexes Gram-positive and Gram-negative bacteria was examined using the zone of inhibition test, MIC, and MBC method, and the results revealed that complex (2) exhibits strong antibacterial activity against these bacteria. The outcomes of this investigation will help in understanding DNA interaction mechanisms as well as the creation of a prospective one. Additionally, the density functional theory (DFT) computation included probes of DNA structure and conformation as well as potential pharmacological regulators for particular disorders to fully explain the experimental results.

摘要

制备了含钌(1)和铁(2)的2,4,6-三(2-吡啶基)-1,3,5-三嗪(tptz)、[Ru(μ-tptz)]Cl和[Fe(μ-tptz)]Cl配合物。利用电子吸收光谱、荧光光谱、圆二色光谱、粘度测量和电化学方法,以及与鱼鲑鱼DNA(FS-DNA)的两种配合物,研究了这些配合物的结合相互作用。根据结合试验,配合物通过温和的嵌入机制与DNA结合,最有可能是tptz配体嵌入DNA螺旋的碱基对。此外,配合物(2)比配合物(1)更具结合能力。电化学方法提供了一种快速简便的测定结合常数()的方法。使用抑菌圈试验、MIC和MBC方法检测了这些配合物对革兰氏阳性菌和革兰氏阴性菌的抗菌性能,结果表明配合物(2)对这些细菌表现出较强的抗菌活性。本研究结果将有助于理解DNA相互作用机制以及创建一种前瞻性的机制。此外,密度泛函理论(DFT)计算包括对DNA结构和构象的探测以及针对特定疾病的潜在药理调节剂,以充分解释实验结果。

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