Free Energy Calculations Give Insight into the Stereoselective Hydroxylation of α-Ionones by Engineered Cytochrome P450 BM3 Mutants-Reference-Cited by-同舟云学术

Free Energy Calculations Give Insight into the Stereoselective Hydroxylation of α-Ionones by Engineered Cytochrome P450 BM3 Mutants

Published:2012-07-19 Issue:8 Volume:52 Page:2139-2148
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

de Beer Stephanie B.A.¹²,Venkataraman Harini¹,Geerke Daan P.¹,Oostenbrink Chris¹²,Vermeulen Nico P.E.¹

Affiliation:

1. Leiden-Amsterdam Center for Drug Research, Division of Molecular and Computational Toxicology, Department of Chemistry and Pharmaceutical Sciences, Vrije Universiteit, De Boelelaan 1083, 1081 HV Amsterdam, The Netherlands

2. Institute of Molecular Modeling and Simulation, University of Natural Resources and Life Sciences, Muthgasse 18, A-1190, Vienna, Austria

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/ci300243n

Reference47 articles.

1. Biosynthesis and engineering of isoprenoid small molecules

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3. Biocatalytic Methods for the Synthesis of Enantioenriched Odor Active Compounds

4. Synthese und Chiralit�t der enantiomeren 6-Hydroxy-?-ionone sowie voncis- undtrans-5,6-Dihydroxy-5,6-dihydro-?-iononen

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