Exploring the Mechanism of Shikimate Kinase through Quantum Mechanical and Molecular Mechanical (QM/MM) Methods

The chemical step of Shikimate Kinase <i>Helicobacter pylori</i>, involving the transfer of a phosphoryl group, has been studied by using quantum mechanical and molecular mechanical (QM/MM) methods. Understanding the mechanism of this chemical step, present in bacteria and other microorg...

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Bibliographic Details
Main Author: Pedro Ojeda-May
Format: Article
Language:English
Published: MDPI AG 2021-09-01
Series:Biophysica
Subjects:
Online Access:https://www.mdpi.com/2673-4125/1/3/25