Science Advances · 2021 · 37 citations · 78 references
Life SciencesBiochemistryMolecular BiologyEnzyme MechanismEnzymologyStructural BiologyConformational DynamicsEnzyme BiophysicsMolecular DynamicsProtein DynamicsProtein StructureStructural EnzymologyEnzymatic Reaction MechanismsEnzyme Conformational DynamicsMolecular Dynamics Of BindingProtein Conformational ChangesProtein Phosphorylation DynamicsProtein-ligand Binding DynamicsSubstrate Binding DynamicsTime-resolved Structural Biology
Ala AdK mutant, which refolded in a closed, substrate-binding conformation. The observed structural dynamics agree with a “cracking mechanism” proposed to underlie global structural transformation, such as allostery, in proteins.
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CHARMM‐GUI: A web‐based graphical user interface for CHARMM
Sunhwan Jo, Taehoon Kim, Vidyashankara Iyer et al. · Journal of Computational Chemistry · 2008 · 9.7K citations