通过分子对接研究探索Alginate-Carrageenan@AgNPs水凝胶在潜在抗菌剂和抗氧化剂中的活性

IF 3.1 3区 生物学 Q2 BIOCHEMICAL RESEARCH METHODS
Ghada E. Dawwam, Ahmed M. Khalil, Ahmed A. El-Rashedy, Doaa M. Azmy, Samir Kamel
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引用次数: 0

摘要

海藻酸盐和kappa- carragean (KC)是天然阴离子生物聚合物,因其抗凝血、免疫调节和抗病毒特性而广泛应用于食品、制药和化妆品行业。然而,未经改性的海藻酸钠/KC (SA/KC)水凝胶往往缺乏足够的抗菌和抗氧化功效,限制了它们在先进生物医学和包装应用中的功能。为了克服这些限制,我们设计了一种多功能水凝胶,将银纳米颗粒(AgNPs)结合到抗坏血酸交联的SA/KC基质中。进行了全面的理化、形态学、抗菌、抗氧化和细胞相容性评估。2% AgNPs复合物对革兰氏阳性菌株(单核细胞增生乳杆菌、金黄色葡萄球菌)、革兰氏阴性菌株(大肠杆菌、沙门氏菌)和真菌菌株(白色念珠菌)具有明显的抗菌活性。2% AgNPs水凝胶与正常Vero细胞相容(IC50 = 599.9±3.47µg/mL),而8% AgNPs水凝胶表现出强大的抗氧化能力(通过DPPH和ABTS检测,IC50分别为21.77µg/mL和33.3µg/mL)。分子动力学模拟证实了水凝胶组分和关键结合位点残基之间的强相互作用,确保了复合材料的稳定性。这些结果支持了agnps增强的SA/KC水凝胶在抗菌伤口敷料、生物活性药物传递基质和抗氧化活性食品包装材料方面的潜力。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Exploring the Activities of Alginate-Carrageenan@AgNPs Hydrogels Supported by Molecular Docking Studies for Potential Antimicrobial and Antioxidant Agents

Exploring the Activities of Alginate-Carrageenan@AgNPs Hydrogels Supported by Molecular Docking Studies for Potential Antimicrobial and Antioxidant Agents

Exploring the Activities of Alginate-Carrageenan@AgNPs Hydrogels Supported by Molecular Docking Studies for Potential Antimicrobial and Antioxidant Agents

Exploring the Activities of Alginate-Carrageenan@AgNPs Hydrogels Supported by Molecular Docking Studies for Potential Antimicrobial and Antioxidant Agents

Exploring the Activities of Alginate-Carrageenan@AgNPs Hydrogels Supported by Molecular Docking Studies for Potential Antimicrobial and Antioxidant Agents

Alginates and kappa-carrageenan (KC) are natural anionic biopolymers widely utilized in food, pharmaceutical, and cosmetic industries for their anticoagulant, immunomodulatory, and antiviral properties. However, unmodified sodium alginate/KC (SA/KC) hydrogels often lack sufficient antimicrobial and antioxidant efficacy, limiting their functionality in advanced biomedical and packaging applications. To overcome these limitations, we designed a multifunctional hydrogel incorporating silver nanoparticles (AgNPs) into an ascorbic acid-crosslinked SA/KC matrix. Comprehensive physicochemical, morphological, antibacterial, antioxidant, and cytocompatibility assessments were conducted. The 2% AgNPs composite exhibited pronounced antimicrobial activity against Gram-positive (L. monocytogenes, S. aureus), Gram-negative (E. coli, Salmonella sp.), and fungal strain (Candida albicans). The 2% AgNPs hydrogel was cytocompatible with normal Vero cells (IC50 = 599.9 ± 3.47 µg/mL), while the 8% AgNPs variant demonstrated potent antioxidant capacity (IC50 of 21.77 µg/mL and 33.3 µg/mL via DPPH and ABTS assays, respectively). Molecular dynamics simulations confirmed strong interactions between hydrogel components and key binding site residues, ensuring composite stability. These results support the potential of AgNPs-enhanced SA/KC hydrogels for antimicrobial wound dressings, bioactive drug delivery matrices, and antioxidant-active food packaging materials.

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来源期刊
Biotechnology Journal
Biotechnology Journal Biochemistry, Genetics and Molecular Biology-Molecular Medicine
CiteScore
8.90
自引率
2.10%
发文量
123
审稿时长
1.5 months
期刊介绍: Biotechnology Journal (2019 Journal Citation Reports: 3.543) is fully comprehensive in its scope and publishes strictly peer-reviewed papers covering novel aspects and methods in all areas of biotechnology. Some issues are devoted to a special topic, providing the latest information on the most crucial areas of research and technological advances. In addition to these special issues, the journal welcomes unsolicited submissions for primary research articles, such as Research Articles, Rapid Communications and Biotech Methods. BTJ also welcomes proposals of Review Articles - please send in a brief outline of the article and the senior author''s CV to the editorial office. BTJ promotes a special emphasis on: Systems Biotechnology Synthetic Biology and Metabolic Engineering Nanobiotechnology and Biomaterials Tissue engineering, Regenerative Medicine and Stem cells Gene Editing, Gene therapy and Immunotherapy Omics technologies Industrial Biotechnology, Biopharmaceuticals and Biocatalysis Bioprocess engineering and Downstream processing Plant Biotechnology Biosafety, Biotech Ethics, Science Communication Methods and Advances.
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