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Dynamic behavior of fully solvated β2-adrenergic receptor, embedded in the membrane with bound agonist or antagonist

Recently we predicted the 3D structure of the human β2-adrenergic receptor (β2AR) and of the binding site of several agonists and antagonists to β2AR. These predictions (MembStruk and HierDock) included no explicit water and only a few lipid molecules. Here we include explicit H(2)O and an infinite...

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Hlavní autoři: Spijker, Peter, Vaidehi, Nagarajan, Freddolino, Peter L., Hilbers, Peter A. J., Goddard, William A.
Médium: Artigo
Jazyk:Inglês
Vydáno: National Academy of Sciences 2006
Témata:
On-line přístup:https://ncbi.nlm.nih.gov/pmc/articles/PMC1458764/
https://ncbi.nlm.nih.gov/pubmed/16551744
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.0511329103
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