Atomistic Insights into TRPC6/Caveolin-1 Interactions Interface via All- Atom Molecular Dynamics Simulations: Structural and Energetic Basis for Selective Modulation
Shayesteh Bazsefidpar, Alejandro Rodriguez, Masayuki X. Mori, Hamid Mosadeghi, Ajay K. Israni, Kyle M. Koss, Onur Kerem Polat
This study uses molecular dynamics simulations to characterize the TRPC6-CAV1 interaction, revealing an acidic patch in TRPC6 and a basic segment in CAV1 that form a cooperative binding interface with favorable binding free energy.
bioRxiv · Sep 10, 2026 · PreprintBiophysics