• 文献检索
  • 文档翻译
  • 深度研究
  • 学术资讯
  • Suppr Zotero 插件Zotero 插件
  • 邀请有礼
  • 套餐&价格
  • 历史记录
应用&插件
Suppr Zotero 插件Zotero 插件浏览器插件Mac 客户端Windows 客户端微信小程序
定价
高级版会员购买积分包购买API积分包
服务
文献检索文档翻译深度研究API 文档MCP 服务
关于我们
关于 Suppr公司介绍联系我们用户协议隐私条款
关注我们

Suppr 超能文献

核心技术专利:CN118964589B侵权必究
粤ICP备2023148730 号-1Suppr @ 2026

文献检索

告别复杂PubMed语法,用中文像聊天一样搜索,搜遍4000万医学文献。AI智能推荐,让科研检索更轻松。

立即免费搜索

文件翻译

保留排版,准确专业,支持PDF/Word/PPT等文件格式,支持 12+语言互译。

免费翻译文档

深度研究

AI帮你快速写综述,25分钟生成高质量综述,智能提取关键信息,辅助科研写作。

立即免费体验

通过核磁共振光谱和分子动力学模拟确定的Lewis x寡糖的溶液结构。

Solution structure of the Lewis x oligosaccharide determined by NMR spectroscopy and molecular dynamics simulations.

作者信息

Miller K E, Mukhopadhyay C, Cagas P, Bush C A

机构信息

Department of Chemistry & Biochemistry, University of Maryland Baltimore County 21228.

出版信息

Biochemistry. 1992 Jul 28;31(29):6703-9. doi: 10.1021/bi00144a009.

DOI:10.1021/bi00144a009
PMID:1353371
Abstract

The Lewis x (Lex) determinant is a trisaccharide fragment that has been implicated as a specific differentiation antigen, as a tumor antigen, and as a key component of the ligand for the endothelial leukocyte adhesion molecule, ELAM-1. High-resolution nuclear magnetic resonance spectroscopy shows it to have a relatively rigid structure. Only a small range of glycosidic dihedral angles in the trisaccharide produce simulated nuclear Overhauser effect spectra agreeing with data measured for the human milk pentasaccharide, lacto-N-fucopentaose-3, which contains the Lex determinant. Independently, the same average structure for the Lex determinant arises from in vacuo molecular dynamics simulations. The proposed conformation of the Lex trisaccharide is very similar to that recently determined for the closely related Lea trisaccharide. In agreement with the recent finding that both sialylated Lea and Lex react with ELAM-1, the results presented here show that the Lea and Lex determinants contain very similar carbohydrate domains.

摘要

Lewis x(Lex)决定簇是一种三糖片段,它被认为是一种特异性分化抗原、肿瘤抗原,也是内皮白细胞黏附分子ELAM - 1配体的关键组成部分。高分辨率核磁共振光谱显示其具有相对刚性的结构。三糖中只有一小范围的糖苷二面角能产生与含Lex决定簇的人乳五糖——乳糖 - N - 岩藻五糖 - 3测量数据相符的模拟核Overhauser效应光谱。独立地,Lex决定簇的相同平均结构也来自于真空分子动力学模拟。所提出的Lex三糖构象与最近确定的密切相关的Lea三糖构象非常相似。与最近发现的唾液酸化的Lea和Lex都与ELAM - 1反应一致,此处给出的结果表明Lea和Lex决定簇含有非常相似的碳水化合物结构域。

相似文献

1
Solution structure of the Lewis x oligosaccharide determined by NMR spectroscopy and molecular dynamics simulations.通过核磁共振光谱和分子动力学模拟确定的Lewis x寡糖的溶液结构。
Biochemistry. 1992 Jul 28;31(29):6703-9. doi: 10.1021/bi00144a009.
2
A carbohydrate domain common to both sialyl Le(a) and sialyl Le(X) is recognized by the endothelial cell leukocyte adhesion molecule ELAM-1.内皮细胞白细胞黏附分子ELAM-1可识别唾液酸化Le(a)和唾液酸化Le(X)共有的碳水化合物结构域。
J Biol Chem. 1991 Aug 15;266(23):14869-72.
3
Weak calcium-mediated interactions between Lewis X-related trisaccharides studied by NMR measurements of residual dipolar couplings.通过剩余偶极耦合的核磁共振测量研究Lewis X相关三糖之间弱的钙介导相互作用。
J Am Chem Soc. 2007 Jul 25;129(29):9080-5. doi: 10.1021/ja0711056. Epub 2007 Jul 3.
4
Solution structure of a trisaccharide-antibody complex: comparison of NMR measurements with a crystal structure.三糖-抗体复合物的溶液结构:核磁共振测量结果与晶体结构的比较
Biochemistry. 1994 May 3;33(17):5183-92. doi: 10.1021/bi00183a023.
5
Contribution of carbohydrate antigens sialyl Lewis A and sialyl Lewis X to adhesion of human cancer cells to vascular endothelium.碳水化合物抗原唾液酸化路易斯A和唾液酸化路易斯X在人癌细胞与血管内皮细胞黏附中的作用。
Cancer Res. 1993 Jan 15;53(2):354-61.
6
Conformational studies on the selectin and natural killer cell receptor ligands sulfo- and sialyl-lacto-N-fucopentaoses (SuLNFPII and SLNFPII) using NMR spectroscopy and molecular dynamics simulations. Comparisons with the nonacidic parent molecule LNFPII.利用核磁共振光谱和分子动力学模拟对选择素和自然杀伤细胞受体配体磺基和唾液酸化乳糖-N-岩藻戊糖(SuLNFPII和SLNFPII)进行构象研究。与非酸性母体分子LNFPII的比较。
Biochemistry. 1996 Feb 13;35(6):1954-64. doi: 10.1021/bi9521598.
7
Affinity of 5-thio-L-fucose-containing Lewis X (LeX) trisaccharide analogs to anti-LeX monoclonal antibody.含5-硫代-L-岩藻糖的Lewis X(LeX)三糖类似物与抗LeX单克隆抗体的亲和力。
Bioorg Med Chem Lett. 1999 Apr 5;9(7):1019-22. doi: 10.1016/s0960-894x(99)00124-9.
8
Comparison of NMR and molecular modeling results for a rigid and a flexible oligosaccharide.刚性和柔性寡糖的核磁共振(NMR)与分子模拟结果比较
Glycobiology. 1996 Apr;6(3):281-8. doi: 10.1093/glycob/6.3.281.
9
Structure and solution conformations of a cyclic trisaccharide from high-resolution n.m.r. spectroscopy and molecular modelling.基于高分辨率核磁共振光谱和分子模拟的环状三糖的结构与溶液构象
Carbohydr Res. 1991 Apr 24;211(2):191-205. doi: 10.1016/0008-6215(91)80091-z.
10
Molecular dynamics simulation and NMR study of a blood group H trisaccharide.血型H三糖的分子动力学模拟与核磁共振研究
Biopolymers. 1994 Aug;34(8):1079-88. doi: 10.1002/bip.360340811.

引用本文的文献

1
Tools for structural lectinomics: From structures to lectomes.结构凝集素组学工具:从结构到凝集素组
BBA Adv. 2025 Mar 6;7:100154. doi: 10.1016/j.bbadva.2025.100154. eCollection 2025.
2
Glycan Stability and Flexibility: Thermodynamic and Kinetic Characterization of Nonconventional Hydrogen Bonding in Lewis Antigens.糖基稳定性和灵活性:路易斯抗原中非传统氢键的热力学和动力学特性。
J Am Chem Soc. 2023 May 10;145(18):10022-10034. doi: 10.1021/jacs.2c13104. Epub 2023 Apr 26.
3
Recognition of Dimeric Lewis X by Anti-Dimeric Le Antibody SH2.
抗二聚体Le抗体SH2对二聚体Lewis X的识别
Vaccines (Basel). 2020 Sep 17;8(3):538. doi: 10.3390/vaccines8030538.
4
Size, Kinetics, and Free Energy of Clusters Formed by Ultraweak Carbohydrate-Carbohydrate Bonds.由超弱碳水化合物-碳水化合物键形成的簇的大小、动力学和自由能。
Biophys J. 2016 Apr 12;110(7):1582-1592. doi: 10.1016/j.bpj.2016.03.006.
5
Fucosylated chondroitin sulfates from the body wall of the sea cucumber Holothuria forskali: conformation, selectin binding, and biological activity.来自福氏海参体壁的岩藻糖基化硫酸软骨素:构象、选择素结合及生物活性。
J Biol Chem. 2014 Oct 10;289(41):28284-98. doi: 10.1074/jbc.M114.572297. Epub 2014 Aug 21.
6
Synthesis of 4" manipulated Lewis X trisaccharide analogues.4" 位操控的 Lewis X 三糖类似物的合成。
Beilstein J Org Chem. 2012;8:1134-43. doi: 10.3762/bjoc.8.126. Epub 2012 Jul 23.
7
Structural insights into what glycan arrays tell us about how glycan-binding proteins interact with their ligands.结构洞察聚糖阵列告诉我们糖结合蛋白如何与其配体相互作用。
Glycobiology. 2009 Nov;19(11):1155-62. doi: 10.1093/glycob/cwp076. Epub 2009 Jun 15.
8
Application of homonuclear 3D NMR experiments and 1D analogs to study the conformation of sialyl Lewis(x) bound to E-selectin.
J Biomol NMR. 1997 Jun;9(4):423-36. doi: 10.1023/a:1018358929268.
9
Solution structure of a Lewis(x) analogue by off-resonance 1H NMR spectroscopy without use of an internal distance reference.
J Biomol NMR. 1996 Jul;8(1):23-35. doi: 10.1007/BF00198137.
10
Heteronuclear NMR studies of 13C-labeled yeast cell wall beta-glucan oligosaccharides.13C标记的酵母细胞壁β-葡聚糖寡糖的异核核磁共振研究
J Biomol NMR. 1993 Jul;3(4):429-41. doi: 10.1007/BF00176009.