Computational methods meet in vitro techniques: A case study on fusaric acid and its possible detoxification through cytochrome P450 enzymes-Reference-Cited by-同舟云学术

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Computational methods meet in vitro techniques: A case study on fusaric acid and its possible detoxification through cytochrome P450 enzymes

Published:2024-03 Issue: Volume:273 Page:116167
ISSN:0147-6513
Container-title:Ecotoxicology and Environmental Safety
language:en
Short-container-title:Ecotoxicology and Environmental Safety

Author:

Pedroni Lorenzo,Doherty Daniel Zocchi,Dall’Asta Chiara,Galaverna Gianni,Bell Stephen G.,Dellafiora Luca

Funder

Australian Institute of Nuclear Science and Engineering Inc

Ministero dell’Istruzione, dell’Università e della Ricerca

Emilia-Romagna Region

Publisher

Elsevier BV

Reference50 articles.

1. GROMACS: high performance molecular simulations through multi-level parallelism from laptops to supercomputers;Abraham;SoftwareX,2015

2. UniProt: the Universal Protein Knowledgebase in 2023;Bateman;Nucleic Acids Res.,2023

3. Selective oxidative demethylation of veratric acid to vanillic acid by CYP199A4 from Rhodopseudomonas palustris HaA2;Bell;Mol. Biosyst.,2010

4. Investigation of the substrate range of CYP199A4: modification of the partition between hydroxylation and desaturation activities by substrate and protein engineering;Bell;Chem. a Eur. J.,2012

5. The protein data bank;Berman;Nucleic Acids Res.,2000

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