基于分子模拟技术筛选南美白对虾胶原蛋白中的抗氧化肽
DOI:
https://doi.org/10.52810/CJNS.2024.004Keywords:
胶原蛋白, 抗氧化肽, in silico, 分子对接Abstract
本研究以生物信息学技术为基础，利用计算机模拟酶解、相关活性预测与评价、药物代谢动力学及分子模拟技术对南美白对虾胶原蛋白抗氧化肽进行筛选。通过 BIOPEP-UWM 模拟酶解、Peptide Ranker 评分得到具有生物活性的小分子肽，同时采用 ToxinPred、Innovagen 及 Expasy 进一步分析肽段的理化性质，并通过药物代谢动力学 ADMET 分析对肽段进行筛选，得到 2 条无毒、无致敏性、无致突变性、无致癌性及水溶性良好的小分子肽，采用分子对接技术将 AWW、HL 两种抗氧化肽与超氧化物歧化酶 ( superoxide dismutase，SOD) 结合，对其最优复合物进行构象分析。结果显示，AWW、HL 抗氧化肽可在人体中较好地发挥抗氧化活性，本方法为天然食品源抗氧化肽的高效、快速、低成本筛选提供了新思路。
References
Li S, Tan H Y, Wang N, et al. The role of oxidative stress and antioxidants in liver diseases[J]. International journal of molecular sciences, 2015, 16(11): 26087-26124.
Shen R, Liu D, Hou C, et al. Protective effect of Potentilla anserina polysaccharide on cadmium-induced nephrotoxicity in vitro and in vivo[J]. Food & function, 2017, 8(10): 3636-3646.
张强, 李伟华. 抗氧化肽的研究现状[J]. 食品与发酵工业, 2021, 47(2): 298-304.
Martínez-Maqueda D, Miralles B, Recio I, et al. Antihypertensive peptides from food proteins: a review[J]. Food & function, 2012, 3(4): 350-361.
曾丽琴, 陈雅茹, 刘淑集, 等. 沙丁鱼鱼鳞胶原蛋白肽的制备及其抗氧化活性研究[J]. Journal of Food Safety & Quality, 2024, 15(3)：214-224.
李爽,刘小芳,冷凯良,等.大西洋鳕鱼骨胶原蛋白肽的抗氧化活性及稳定性研究[J].食品与发酵工业, 2024, 10(5)：1-9.
赵侠, 李燕, 孙慧敏, 郑昌亮, 宋益善, 脱脂南极磷虾粉中降血糖与抗氧化肽的分离纯化与鉴定, 上海海洋大学学报 2023，32(06): 1155-1164.
孙洁, 李燕, 施文正, 等. 虾类生物活性肽的研究进展[J]. 食品与发酵工业, 2021, 47(4): 261-268.
李二超. 盐度对凡纳滨对虾的生理影响及其营养调节[D]. 上海: 华东师范大学, 2008.
杨华, 刘丽君, 戚向阳, 等. 南美白对虾虾仁无磷保水工艺研究[J]. 安徽农业科学, 2014, 42(31): 11108-11112.
陈贵堂, 赵霖. 食物源生物活性肽及其营养生理价值[J]. 中国临床营养杂志, 2005, 13(5): 312-315.
Madrazo A L, Campos M R S. In silico prediction of peptide variants from chia (S. hispanica L.) with antimicrobial, antibiofilm, and antioxidant potential[J]. Computational Biology and Chemistry, 2022, 98: 107695.
Wongngam W, Hamzeh A, Tian F, et al. Purification and molecular docking of angiotensin converting enzyme-inhibitory peptides derived from corn gluten meal hydrolysate and from in silico gastrointestinal digestion[J]. Process Biochemistry, 2023, 129: 113-120.
Mooney C, Haslam N J, Pollastri G, et al. Towards the improved discovery and design of functional peptides: common features of diverse classes permit generalized prediction of bioactivity[J]. 2012.
张迎阳, 董亚云, 邹平, 郑文武, 橄榄仁抗氧化肽的分离鉴定及分子对接, 食品与发酵工业，2021，10(5): 189-198.
Jin H, Jin Y, Pan J, et al. Comprehensive identification and hydrophobic analysis of key proteins affecting foam capacity and stability during the evolution of egg white foam[J]. Food Hydrocolloids, 2023, 134: 108033.
Lai Y, Chu X, Di L, et al. Recent advances in the translation of drug metabolism and pharmacokinetics science for drug discovery and development[J]. Acta Pharmaceutica Sinica B, 2022, 12(6): 2751-2777.
Clark A M, Dole K, Coulon-Spektor A, et al. Open source Bayesian models. 1. Application to ADME/Tox and drug discovery datasets[J]. Journal of chemical information and modeling, 2015, 55(6): 1231-1245.
You L, Zhao M, Regenstein J M, et al. Changes in the antioxidant activity of loach (Misgurnus anguillicaudatus) protein hydrolysates during a simulated gastrointestinal digestion[J]. Food Chemistry, 2010, 120(3): 810-816.
马寅龙, 郭锐斌, 于雁松, 马隆凯, 许晓曦, 基于分子模拟技术筛选牛乳清蛋白源抗氧化肽, 中国食品学报，2024，24(02)：11-31.
Ran Z, Xuezhi W, Jiajia W, et al. Survey on Computational Approaches for Drug-Target Interaction Prediction[J]. Journal of Computer Engineering & Applications, 59(12) (2023) 1-16.
D. Gaikwad, N. Jadhav, Development of stable emulsified formulations of Terminalia arjuna for topical application: evaluation of antioxidant activity of final product and molecular docking study, Drug Development and Industrial Pharmacy 45(11) (2019) 1740-1750.
孙娟, 黄业传, 李婷婷. 猪肉超氧化物歧化酶超高压失活动力学研究[J]. 食品工业科技, 2016, 37(1): 126-129.
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