BiophysicsbioRxivPreprint
Allosteric effects in catalytic impaired variants of the enzyme cyclophilin A may be explained by changes in nano-microsecond time scale motions
Pattama Wapeesittipan, Antonia S. J. S. Mey, Malcolm D. Walkinshaw, Julien Michel
This study uses MD simulations to show that catalytic impairment in CypA mutants is linked to faster nano-microsecond motions of Phe113, challenging the role of millisecond-scale conformational changes in allosteric effects.