Free Energy Landscape of Magnesium Chelation Reveals Dynamic Pre-Chelate Complexes Stabilized by Meta-Sphere RNA-Ion Coordination
Akhilesh Jaiswar, Raju Sarkar, Avijit Mainan, Rimi Kundu, Susmita Roy
The paper uses simulations to analyze Mg2+ coordination with RNA, identifying dynamic pre-chelate complexes and a new meta-sphere coordination mechanism.
bioRxiv · May 20, 2025 · PreprintBiophysics