Modeling of the Aryl Hydrocarbon Receptor (AhR) ligand binding domain and its utility in virtual ligand screening to predict new AhR ligands

The Aryl Hydrocarbon Receptor (AhR) is a ligand-activated transcription factor; the AhR Per-AhR/Arnt-Sim (PAS) domain binds ligands. We developed homology models of the AhR PAS domain to characterize previously observed intra- and inter-species differences in ligand binding using Molecular Docking....

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Bibliographic Details
Main Authors: Bisson, William, Koch, Daniel, O’Donnell, Edmond, Khalil, Sammy M., Kerkvliet, Nancy, Tanguay, Robert, Abagyan, Ruben, Kolluri, Siva Kumar
Format: Artigo
Language:Inglês
Published: 2009
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Article
Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC3289977/
https://ncbi.nlm.nih.gov/pubmed/19719119
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jm900199u
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