Water Exchange from the Buried Binding Sites of Cytochrome P450 Enzymes 1A2, 2D6, and 3A4 Correlates with Conformational Fluctuations

Water Exchange from the Buried Binding Sites of Cytochrome P450 Enzymes 1A2, 2D6, and 3A4 Correlates with Conformational Fluctuations

Human cytochrome P450 enzymes (CYPs) are critical for the metabolism of small-molecule pharmaceuticals (drugs). As such, the prediction of drug metabolism by and drug inhibition of CYP activity is an important component of the drug discovery and design process. Relative to the availability of a wide...

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Bibliographic Details
Main Author: Olgun Guvench
Format: Article
Language:English
Published: MDPI AG 2024-01-01
Series:Molecules
Subjects:
cytochrome P450
CYP
1A2
2D6
3A4
binding site
Online Access:https://www.mdpi.com/1420-3049/29/2/494

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