Molecular structure of dermatan sulphate tetrasaccharide

M. Hricovíni
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Abstract

The knowledge of carbohydrate molecular structure is essential for understanding various processes in glycobiology. Dermatan sulphate (DS) belongs to the group of glycosaminoglycan (GAG) polysaccharides with biological importance [1]. DS is present in various tissues in higher organisms, e.g. in skin, blood vessels or lungs and plays important roles in various processes, namely intercellular and cell-matrix interactions, cell migrations and morphogenesis [2]. The investigation of DS solution properties and formation of their intermolecular complexes with proteins rely mainly on methods of theoretical chemistry as well as high-resolution NMR spectroscopy. In the present contribution, the results of calculations of molecular geometry of dermatan sulphate by density functional theory (DFT) are discussed and compared with experimental spectroscopic data.
硫酸皮聚糖四糖的分子结构
碳水化合物分子结构的知识对于理解糖生物学的各种过程是必不可少的。硫酸皮聚糖(DS)属于具有重要生物学意义的糖胺聚糖(GAG)多糖群[1]。DS存在于高等生物的多种组织中,如皮肤、血管或肺部,在细胞间和细胞-基质相互作用、细胞迁移和形态发生等过程中发挥重要作用[2]。研究DS溶液的性质及其与蛋白质分子间络合物的形成主要依靠理论化学和高分辨率核磁共振波谱的方法。本文讨论了用密度泛函理论(DFT)计算硫酸皮丹分子几何结构的结果,并与实验光谱数据进行了比较。
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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