Correlation Between Allosteric and Orthosteric Sites

被引：8
|
作者：
Zhang, Weilin [1 ,2 ]
Xie, Juan [1 ,2 ]
Lai, Luhua [1 ,2 ]
机构：
[1] Peking Univ, Coll Chem & Mol Engn, Beijing, Peoples R China
[2] Peking Univ, Ctr Quantitat Biol, AAIS, Beijing, Peoples R China
来源：
PROTEIN ALLOSTERY IN DRUG DISCOVERY | 2019年 / 1163卷
关键词：
Correlation; Evolutionary analysis; Statistical coupling analysis; Elastic network model; Molecular dynamics; Two state Go model; Rigid-body simulation; Community analysis; Mutual information; MOLECULAR-DYNAMICS; PROTEIN ALLOSTERY; BINDING-SITES; NETWORK; PREDICTION; MOTIONS; PATHWAYS; MODELS; TOOL;
D O I：
10.1007/978-981-13-8719-7_5
中图分类号：
R-3 [医学研究方法]; R3 [基础医学];
学科分类号：
1001 ;
摘要：
Correlation between an allosteric site and its orthosteric site refers to the phenomenon that perturbations like ligand binding, mutation, or posttranslational modifications at the allosteric site leverage variation in the orthosteric site. Understanding this kind of correlation not only helps to disclose how information is transmitted in allosteric regulation but also provides clues for allosteric drug discovery. This chapter starts with an overview of correlation studies on allosteric and orthosteric sites and then introduces recent progress in evolutionary and simulation-based dynamic studies. Discussions and perspectives on future directions are also given.
引用
收藏
页码：89 / 105
页数：17
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