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Anesthetic Interaction with Ketosteroid Isomerase: Insights from Molecular Dynamics Simulations

The nature and the sites of interactions between anesthetic halothane and homodimeric Δ(5)-3-ketosteroid isomerase (KSI) are characterized by flexible ligand docking and confirmed by (1)H-(15)N NMR. The dynamics consequence of halothane interaction and the implication of the dynamic changes to KSI f...

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Autors principals: Yonkunas, Michael J., Xu, Yan, Tang, Pei
Format: Artigo
Idioma:Inglês
Publicat: Biophysical Society 2005
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Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC1366735/
https://ncbi.nlm.nih.gov/pubmed/16040747
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1529/biophysj.105.063396
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