BiophysicsbioRxivPreprint
The wild-type hERG cryo-EM structure fails to support conduction and evolve toward an inactivated-like selectivity filter conformation in molecular dynamics simulations
Maria Vittoria Leonardi, Antonio Michelucci, Ye. K. Aldakul…·Simone Furini
The study uses molecular dynamics simulations to show that wild-type hERG fails to conduct K+ and evolves toward an inactivated-like conformation, contrasting with the N629D mutant which maintains conductivity.