利伐沙班的体外和体外抗结核活性

IF 0.1 Q4 MULTIDISCIPLINARY SCIENCES
T. Lakhvich, V. M. Ryneiskaya, N. S. Golyak, N. Yurkshtovich, K. E. Nasennikava, F. A. Lakhvich
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引用次数: 0

摘要

本文研究了恶唑烷酮系列利伐昔班对土生分枝杆菌的体外和体外活性。计算机研究表明,利伐沙班对β-酮酰基[ACP]合酶I具有很高的结合亲和力,该合酶在分枝杆菌细胞壁组成部分分枝杆菌酸的生物合成中起着关键作用。在分子对接研究中,预测并评估了利伐沙班与蛋白质的两个主要结合位点:两个位点的最小结合能分别为-10.26 kcal/mol和-8.99 kcal/mol。利伐沙班溶液(200μg/ml)已被证明能抑制地面分枝杆菌培养物的生长。所获得的数据为开发有效的新型抗结核药物恶唑烷酮系列开辟了前景。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Anti-tuberculosis activity of Rivaroxabane in silico and in vitro
The activity of Rivaroxoban of oxazolidinone series against Mycobacterium terrae was investigated in silico and in vitro. In silico studies have shown a high binding affinity of Rivaroxaban to β-ketoacyl[ACP]synthase I that plays a key role in the biosynthesis of mycolic acids, being the components of the mycobacterial cell wall. In the molecular docking study, two main binding sites of Rivaroxaban with protein were predicted and evaluated: the minimum binding energies were found for the both sites with the values of –10.26 kcal/mol and –8.99 kcal/mol. A solution of Rivaroxaban (200 μg/ml) has been shown to inhibit the growth of a Mycobacterium terrae culture. The data obtained open up the prospect of developing new effective anti-tuberculosis drugs of oxazolidinone series.
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来源期刊
DOKLADY NATSIONALNOI AKADEMII NAUK BELARUSI
DOKLADY NATSIONALNOI AKADEMII NAUK BELARUSI MULTIDISCIPLINARY SCIENCES-
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