Article 1 Binding free energy 1 Binding site 1 Catalysis 1 Keywords G6PD mutants MD simulations 1 Structural stability 1 X ray analysis 1 X ray crystallography 1 amino acid sequence 1 binding site 1 catalysis 1 cholesterol metabolism 1 comparative study 1 computer model 1 conformational transition 1 controlled study 1 crystal structure 1 enzyme active site 1 enzyme activity 1 enzyme kinetics 1 enzyme structure 1 gene mutation 1 genetic polymorphism 1 glucose 6 phosphate dehydrogenase 1 glucose 6 phosphate dehydrogenase deficiency 1 human 1 hydrophobicity 1 ligand binding 1 mathematical analysis 1