Literature DB >> 31707701

Correlation Between Allosteric and Orthosteric Sites.

Weilin Zhang1,2, Juan Xie1,2, Luhua Lai3,4.   

Abstract

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.

Keywords:  Community analysis; Correlation; Elastic network model; Evolutionary analysis; Molecular dynamics; Mutual information; Rigid-body simulation; Statistical coupling analysis; Two state Go̅ model

Mesh:

Substances:

Year:  2019        PMID: 31707701     DOI: 10.1007/978-981-13-8719-7_5

Source DB:  PubMed          Journal:  Adv Exp Med Biol        ISSN: 0065-2598            Impact factor:   2.622


  3 in total

Review 1.  Targeting allosteric regulation of cancer metabolism.

Authors:  Daniel M Kremer; Costas A Lyssiotis
Journal:  Nat Chem Biol       Date:  2022-04-28       Impact factor: 16.174

2.  Discovery of cryptic allosteric sites using reversed allosteric communication by a combined computational and experimental strategy.

Authors:  Duan Ni; Jiacheng Wei; Xinheng He; Ashfaq Ur Rehman; Xinyi Li; Yuran Qiu; Jun Pu; Shaoyong Lu; Jian Zhang
Journal:  Chem Sci       Date:  2020-11-02       Impact factor: 9.825

3.  Untangling Dual-Targeting Therapeutic Mechanism of Epidermal Growth Factor Receptor (EGFR) Based on Reversed Allosteric Communication.

Authors:  Yuran Qiu; Xiaolan Yin; Xinyi Li; Yuanhao Wang; Qiang Fu; Renhua Huang; Shaoyong Lu
Journal:  Pharmaceutics       Date:  2021-05-18       Impact factor: 6.321

  3 in total

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