Evaluation of Molecular Modeling of Agonist Binding in Light of the Crystallographic Structure of an Agonist-Bound A(2A) Adenosine Receptor

Molecular modeling of agonist binding to the human A(2A) adenosine receptor (AR) was assessed and extended in light of crystallographic structures. Heterocyclic adenine nitrogens of co-crystallized agonist overlayed corresponding positions of the heterocyclic base of a bound triazolotriazine antagon...

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Autores principales: Deflorian, Francesca, Kumar, T. Santhosh, Phan, Khai, Gao, Zhan-Guo, Xu, Fei, Wu, Huixian, Katritch, Vsevolod, Stevens, Raymond C., Jacobson, Kenneth A.
Formato: Artigo
Lenguaje:Inglês
Publicado: 2011
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Article
Acceso en línea:https://ncbi.nlm.nih.gov/pmc/articles/PMC3261785/
https://ncbi.nlm.nih.gov/pubmed/22104008
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jm201461q
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