Identify the effect of As(III) on the structural stability of monomeric PKM2 and its carcinogenicity: A molecular dynamics and QM/MM based approach
Priyani Paligaspe, Samantha Weerasinghe, D. P. Dissanayake, R. Senthilnithy
Topics & Concepts
PKM2ChemistryMolecular mechanicsPyruvate kinaseMonomerEnzymeMolecular dynamicsIsozymeBiochemistryBiophysicsGlycolysisComputational chemistryPolymerOrganic chemistryBiologyAmino Acid Enzymes and MetabolismArsenic contamination and mitigationEnzyme Structure and Function