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. 2022 Sep 28;12:16232. doi: 10.1038/s41598-022-20671-0

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© The Author(s) 2022

Open Access This article is licensed under a Creative Commons Attribution 4.0 International License, which permits use, sharing, adaptation, distribution and reproduction in any medium or format, as long as you give appropriate credit to the original author(s) and the source, provide a link to the Creative Commons licence, and indicate if changes were made. The images or other third party material in this article are included in the article's Creative Commons licence, unless indicated otherwise in a credit line to the material. If material is not included in the article's Creative Commons licence and your intended use is not permitted by statutory regulation or exceeds the permitted use, you will need to obtain permission directly from the copyright holder. To view a copy of this licence, visit http://creativecommons.org/licenses/by/4.0/.

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Interactions between the CYP51 proteins and their substrates. Calculations were made in MOE using molecule A. Polar interactions are in plum; hydrophobic interactions are in green, and the arene–H interaction between Y103 and C19 atom of obtusiofoliol is indicated as a green dotted line.