Defining A Global Map of Functional Group-based 3D Ligand-binding Motifs

Defining A Global Map of Functional Group-based 3D Ligand-binding Motifs

Uncovering conserved 3D protein–ligand binding patterns on the basis of functional groups (FGs) shared by a variety of small molecules can greatly expand our knowledge of protein–ligand interactions. Despite that conserved binding patterns for a few commonly used FGs have been reported in the litera...

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Bibliographic Details
Main Authors: Liu Yang, Wei He, Yuehui Yun, Yongxiang Gao, Zhongliang Zhu, Maikun Teng, Zhi Liang, Liwen Niu
Format: Article
Language:English
Published: Elsevier 2022-08-01
Series:Genomics, Proteomics & Bioinformatics
Subjects:
Protein–ligand interaction
Functional group
Binding motif
Computational method
Drug design
Online Access:http://www.sciencedirect.com/science/article/pii/S1672022922000195

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http://www.sciencedirect.com/science/article/pii/S1672022922000195

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