The phosphorylation mechanism of mevalonate diphosphate decarboxylase: a QM/MM study
Author:
Affiliation:
1. School of Chemistry and Chemical Engineering
2. Queen's University Belfast
3. Northern Ireland
4. UK
5. Shanghai Jiaotong University
6. Shanghai 200025
7. China
Abstract
Combined MD and QM/MM studies suggested that mevalonate diphosphate decarboxylase requires two magnesium ions for a phosphorylation reaction.
Funder
Department of Education and Learning, Northern Ireland
Publisher
Royal Society of Chemistry (RSC)
Subject
Organic Chemistry,Physical and Theoretical Chemistry,Biochemistry
Link
http://pubs.rsc.org/en/content/articlepdf/2020/OB/C9OB02254F
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1. Targeting Isoprenoid Biosynthesis for Drug Discovery: Bench to Bedside
2. Reaction Mechanism of Isopentenyl Phosphate Kinase: A QM/MM Study
3. Catalytic mechanism of mevalonate kinase revisited, a QM/MM study
4. Structural Basis for Nucleotide Binding and Reaction Catalysis in Mevalonate Diphosphate Decarboxylase
5. Allosteric Mechanism of Pyruvate Kinase from Leishmania mexicana Uses a Rock and Lock Model
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