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用于分析多聚体蛋白质中结构域运动的DynDom3D网络服务器。

The DynDom3D Webserver for the Analysis of Domain Movements in Multimeric Proteins.

作者信息

Girdlestone Christopher, Hayward Steven

机构信息

D'Arcy Thompson Centre for Computational Biology, School of Computing Sciences, University of East Anglia , Norwich, United Kingdom .

出版信息

J Comput Biol. 2016 Jan;23(1):21-6. doi: 10.1089/cmb.2015.0143. Epub 2015 Nov 5.

Abstract

DynDom3D is a program for the analysis of domain movements in multimeric proteins. Its inputs are two structure files that indicate a possible domain movement, but the onus has been on the user to process the files so that there is the necessary one-to-one equivalence between atoms in the two atom lists. This is often a prohibitive task to carry out manually, which has limited the application of DynDom3D. Here we report on a webserver with a preprocessor that automatically creates an equivalence between atoms using sequence alignment methods. The processed structure files are passed to DynDom3D and the results are presented on a webpage that includes molecular graphics for easy visualization.

摘要

DynDom3D是一个用于分析多聚体蛋白中结构域运动的程序。其输入是两个表示可能的结构域运动的结构文件,但用户有责任处理这些文件,以便两个原子列表中的原子之间存在必要的一一对应关系。这通常是一项难以手动完成的任务,这限制了DynDom3D的应用。在此,我们报告一个带有预处理器的网络服务器,该预处理器使用序列比对方法自动创建原子之间的对应关系。处理后的结构文件被传递给DynDom3D,结果会在一个包含分子图形以便于可视化的网页上呈现。

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