对多药耐药细菌和真菌的抗菌效果、次生代谢物成分及配体对接

T. Abike, Dr Oludare temitope Osuntokun, Aladejana Oluwatoyin Modupe, Ajadi Fatima Adenike, Akinyemi R. Atinuke
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引用次数: 6

摘要

本研究旨在测定绿花刺花的植物化学成分及对多药耐药微生物的抑菌效果。并研究了青花葡萄次生代谢物(植物化学物质)与三种蛋白质的相互作用。采用琼脂孔扩散法研究了绿花草(叶和茎皮)提取物对选定微生物的抑菌活性。最低抑菌浓度(mic)、最低杀菌浓度(MBCs)也采用标准方法测定。定性原创研究文章Abike等;Jabb, 23(6): 17-32, 2020;文章no.JABB。测定了60911 18和绿antha的植物化学定量筛选。用硅技术确定了分子对接,并对其进行了说明。用GLIDE测定蛋白质生成、配体生成和配体对接。在Schrödinger-Maestro 11.1的Glide和超精密(XP)模式下进行标准精度(SP)柔性配体对接。粗提物对所有分离的细菌和真菌均有抑菌活性,而叶提物对部分分离的细菌和真菌均有抑菌活性,差异不大。100mg/ml乙醇提取物的抑制区为9mm-24mm, 12.5mg/ml乙醇提取物的抑制区为10mm-13mm。对不同提取物敏感的最小抑菌浓度(MIC)为12.5mg/ml ~ 100mg/ml,而对微生物敏感的最小抑菌浓度(MBC)为25mg/ml ~ 100mg/ml。定性植物化学筛选结果显示,绿antha叶和茎皮中含有心糖苷、类固醇、蒽醌、单宁、皂苷、酚和还原糖等药用活性成分。用不同的溶剂对绿棘茎皮和叶进行了植物化学定量筛选,结果表明绿棘茎皮和叶中存在不同数量的植物化学成分。分子对接结果显示,与左氧氟沙星相比,该植物的某些成分通过抑制拓扑异构酶IV而具有更强的活性。对伤寒沙门菌,绿antha中Jartrorrhizine-1和canadine-1的对接得分分别为-2.267和1.625,高于左氧氟沙星的对接得分(-1.557)。金黄色葡萄球菌,阿根廷产。sdf(-7.373)和Jartrorrhizine。与左氧氟沙星相比,sdf(-4.225)的对接评分较高。sdf(-3.436)和白色念珠菌。本研究对赤花莲对细菌和真菌分离物的抑菌作用,特别是其茎皮提取物的抑菌作用表明,赤花莲对伤寒沙门氏菌和其他生物引起的疾病更有效,因此可以作为治疗药物的替代来源。
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Antimicrobial Efficacy, Secondary Metabolite Constituents, Ligand Docking of Enantia chlorantha on Selected Multidrug Resistance Bacteria and Fungi
This study aimed at determining the phytochemical constituents and antimicrobial efficacy of Enantia chlorantha on multidrug resistance microorganisms.And also to study the interaction of plant secondary metabolite (phytochemicals) from Enantia chlorantha with three proteins. Antimicrobial activity of the extracts of E. chlorantha (leaf and stem bark) against selected microorganisms was done using agar well diffusion method. Minimum inhibitory concentrations (MICs), minimum bactericidal concentrations (MBCs) were also determined using standard methods. The qualitative Original Research Article Abike et al.; JABB, 23(6): 17-32, 2020; Article no.JABB.60911 18 and quantitative phytochemical screening of E. chlorantha were also determined. The molecular docking was determined using in-silico techniques and was elucidated. Protein generation, Ligand generation and Ligand Docking using GLIDE were determined. Standard precision (SP) flexible ligand docking was carried out in Glide of Schrödinger-Maestro 11.1 and the extra-precision (XP) mode. The crude extracts tested showed antimicrobial activities against all the test bacterial and fungal isolates for the stem bark extract while the leaf extract showed antimicrobial activities against some of the isolates with little differences. The zones of inhibition ranges between 9mm-24mm at 100mg/ml for the ethanol extract and 10mm-13mm at 12.5mg/ml. The Minimum Inhibitory Concentration (MIC) at which the isolates were sensitive to the various extracts differed and the MIC values ranged from 12.5mg/ml to 100mg/ml while the MBC for the organisms ranged from 25mg/ml to 100mg/ml.The qualitative phytochemical screening of Enantia chlorantha leaf and stem bark revealed the presence of medicinally active constituent such as cardiac glycoside, steroids, anthraquinone,tannin, saponin, phenol, and reducing sugar. The quantitative phytochemical screening of E. chlorantha stem bark and leaf using different solvents, showed the presence of different phytoconstituents in different quantities. Molecular docking results revealed some components of the plant to be more active compared to levofloxacin by inhibiting topoisomerase IV. Jartrorrhizine-1 and canadine-1 present in Enantia chlorantha have docking scores of -2.267 and 1.625 respectively which are greater than that of levofloxacin (-1.557) against Salmonella typhi. For Staphylococcus aureus, Argentine.sdf (-7.373) and Jartrorrhizine.sdf (-4.225) have high docking scores compared to Levofloxacin.sdf (-3.436) as well as Candida albican.The promising evidence for the antimicrobial effects of E. chlorantha against bacterial and fungal isolates in this study especially the stem bark extract showed that Enantia chlorantha is more effective at treating diseases caused by Salmonella typhi and other organisms and therefore can be used as an alternative source of therapeutic agents.
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