Jana Horackova

This study reports co-crystal structures of a bioluminescent energy-transfer complex in Renilla reniformis, revealing the spatial arrangement of donor-acceptor chromophores and their role in efficient radiationless energy transfer.

ProtXAI combines molecular dynamics and explainable AI to identify residue-level determinants of protein conformational changes across diverse systems.

This study determines the crystal structures and dynamical behavior of an ancestral ABH-fold enzyme, revealing molecular features that enabled the transition from hydrolytic to oxygenolytic catalysis.