P450 Enzymes: Their Structure, Reactivity, and Selectivity—Modeled by QM/MM Calculations

Abstract

ADVERTISEMENT RETURN TO ISSUEPREVReviewNEXTP450 Enzymes: Their Structure, Reactivity, and Selectivity—Modeled by QM/MM CalculationsSason Shaik*†, Shimrit Cohen†, Yong Wang†, Hui Chen†, Devesh Kumar‡§, and Walter Thiel*‡View Author Information Institute of Chemistry and the Lise-Meitner-Minerva Center for Computational Quantum Chemistry, The Hebrew University of Jerusalem, 91904 Jerusalem, Israel, and Max-Planck-Institut für Kohlenforschung, Kaiser-Wilhelm-Platz 1, D-45470 Mülheim an der Ruhr, Germany* E-mail: S.S., [email protected]; W.T., [email protected]. Further contact information for S.S.: phone, +972-2-6585909; fax, +972-2-6584680/6585345.†The Hebrew University of Jerusalem.‡Max-Planck-Institut für Kohlenforschung.§Current address: Molecular Modeling Group, Indian Institute of Chemical Technology, Hyderabad 500 607, India.Cite this: Chem. Rev. 2010, 110, 2, 949–1017Publication Date (Web):October 8, 2009Publication History Received30 March 2009Published online8 October 2009Published inissue 10 February 2010https://pubs.acs.org/doi/10.1021/cr900121shttps://doi.org/10.1021/cr900121sreview-articleACS PublicationsCopyright © 2009 American Chemical SocietyRequest reuse permissionsArticle Views15210Altmetric-Citations891LEARN ABOUT THESE METRICSArticle Views are the COUNTER-compliant sum of full text article downloads since November 2008 (both PDF and HTML) across all institutions and individuals. These metrics are regularly updated to reflect usage leading up to the last few days.Citations are the number of other articles citing this article, calculated by Crossref and updated daily. Find more information about Crossref citation counts.The Altmetric Attention Score is a quantitative measure of the attention that a research article has received online. Clicking on the donut icon will load a page at altmetric.com with additional details about the score and the social media presence for the given article. Find more information on the Altmetric Attention Score and how the score is calculated. Share Add toView InAdd Full Text with ReferenceAdd Description ExportRISCitationCitation and abstractCitation and referencesMore Options Share onFacebookTwitterWechatLinked InRedditEmail Other access optionsGet e-Alertsclose SUBJECTS:Chemical calculations,Organic reactions,Peptides and proteins,Quantum mechanics,Reaction mechanisms Get e-Alerts