Trapped water molecules are essential to structural dynamics and function of a ribozyme

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Authors

RHODES Maria REBLOVA Kamila NILS Walter SPONER Jiri

Year of publication 2006
Type Article in Periodical
Magazine / Source The Proceedings of the National Academy of Sciences
MU Faculty or unit

Faculty of Science

Citation
Field Biophysics
Keywords coupled molecular motions; hairpin ribozyme; molecular dynamics; proton wire
Description Combining explicit-solvent molecular dynamics simulation and single molecule fluorescence spectroscopy approaches, we find that a ribozyme from a subviral plant pathogen exhibits a coupled hydrogen bonding network that communicates dynamic structural rearrangements throughout the catalytic core in response to site-specific chemical modification. Trapped long-residency water molecules are critical for this network.
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