Study on the effects of endogenous polyphenols on the structure, physicochemical properties and in vitro digestive characteristics of Euryales Semen starch based on multi-spectroscopies, enzyme kinetics, molecular docking and molecular dynamics simulation.

IF 7.7 1区 化学 Q1 BIOCHEMISTRY & MOLECULAR BIOLOGY International Journal of Biological Macromolecules Pub Date : 2024-11-05 DOI:10.1016/j.ijbiomac.2024.137245
Miao Yu, Cheng Qu, Dishuai Li, Zheng Jiang, Jian Liu, Fan Yang, Chanchan Liu, Wei Yue, Qinan Wu
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Abstract

Euryales Semen (ES) is a highly nutritious food with low digestibility, which is closely associated with its endogenous phenolic compounds. In this study, five phenolic compounds (naringenin, isoquercitrin, gallic acid, epicatechin and quercetin) with high concentrations in ES were selected to prepare starch-polyphenol complexes. Subsequently, the effects of endogenous polyphenols on the structure, physicochemical properties and digestion characteristics of ES starch were studied using multiple techniques. The addition of phenolic compounds markedly reduced the in vitro digestibility, swelling power, gelatinization enthalpy, while increased the solubility of ES starch. Fourier-transform infrared spectroscopy and X-ray diffraction analysis showed that phenolic compounds interacted with the starch through non-covalent bonds. Five phenolic compounds inhibited α-amylase activity through a mixed competitive inhibition mechanism, with the inhibition potency ranked as follows: quercetin > epicatechin > gallic acid > isoquercitrin > naringenin. The spectroscopic analysis and molecular dynamics simulations confirmed that five phenolic compounds interacted with the amino acid residues of α-amylase through hydrogen bonding and hydrophobic interactions, caused α-amylase static fluorescence quenching, and altered its conformation and microenvironment. This study provides a better understanding of the interaction mechanisms between ES starch and polyphenols, and supports the development of ES as a food that lowers sugar levels.

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基于多光谱、酶动力学、分子对接和分子动力学模拟,研究内源性多酚对 Euryales Semen 淀粉结构、理化性质和体外消化特性的影响。
柃木精液(ES)是一种低消化率的高营养食物,这与其内源性酚类化合物密切相关。本研究选择了 ES 中含量较高的五种酚类化合物(柚皮苷、异槲皮苷、没食子酸、表儿茶素和槲皮素)制备淀粉多酚复合物。随后,采用多种技术研究了内源性多酚对 ES 淀粉的结构、理化性质和消化特性的影响。酚类化合物的加入明显降低了 ES 淀粉的体外消化率、膨胀力和糊化焓,同时提高了 ES 淀粉的溶解度。傅立叶变换红外光谱和 X 射线衍射分析表明,酚类化合物通过非共价键与淀粉相互作用。五种酚类化合物通过混合竞争抑制机制抑制了α-淀粉酶的活性,其抑制效力依次为:槲皮素>表儿茶素>没食子酸>异槲皮素>柚皮素。光谱分析和分子动力学模拟证实,五种酚类化合物通过氢键和疏水作用与α-淀粉酶的氨基酸残基相互作用,引起α-淀粉酶静态荧光淬灭,并改变其构象和微环境。这项研究有助于更好地了解 ES 淀粉与多酚之间的相互作用机制,并支持将 ES 开发为一种降糖食品。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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来源期刊
International Journal of Biological Macromolecules
International Journal of Biological Macromolecules 生物-生化与分子生物学
CiteScore
13.70
自引率
9.80%
发文量
2728
审稿时长
64 days
期刊介绍: The International Journal of Biological Macromolecules is a well-established international journal dedicated to research on the chemical and biological aspects of natural macromolecules. Focusing on proteins, macromolecular carbohydrates, glycoproteins, proteoglycans, lignins, biological poly-acids, and nucleic acids, the journal presents the latest findings in molecular structure, properties, biological activities, interactions, modifications, and functional properties. Papers must offer new and novel insights, encompassing related model systems, structural conformational studies, theoretical developments, and analytical techniques. Each paper is required to primarily focus on at least one named biological macromolecule, reflected in the title, abstract, and text.
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Study on the effects of endogenous polyphenols on the structure, physicochemical properties and in vitro digestive characteristics of Euryales Semen starch based on multi-spectroscopies, enzyme kinetics, molecular docking and molecular dynamics simulation. Fucoidan alleviates hepatic lipid deposition by modulating the Perk-Eif2α-Atf4 axis via Sirt1 activation in Acanthopagrus schlegelii. Preparation of phosphorus-nitrogen synergistic flame retardant cellulose composite aerogel from waste cotton/phytic acid/acrylamide. Corrigendum to "Novel chitosan-ulvan hydrogel reinforcement by cellulose nanocrystals with epidermal growth factor for enhanced wound healing: In vitro and in vivo analysis" [Int. J. Biol. Macromol. 183 (2021) 435-446]. Effects of wheat cultivar, bran concentration and endoxylanase on the thermomechanical, viscoelastic and microstructural properties of whole wheat flour dough
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