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Molecular Dynamics Simulation of Sperm Whale Myoglobin: Effects of Mutations and Trapped CO on the Structure and Dynamics of Cavities

✍ Scribed by Bossa, Cecilia; Amadei, Andrea; Daidone, Isabella; Anselmi, Massimiliano; Vallone, Beatrice; Brunori, Maurizio; Di Nola, Alfredo


Book ID
119919201
Publisher
Biophysical Society
Year
2005
Tongue
English
Weight
406 KB
Volume
89
Category
Article
ISSN
0006-3495

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The effects of the L29F mutation on the
✍ Massimiliano Anselmi; Alfredo Di Nola; Andrea Amadei πŸ“‚ Article πŸ“… 2010 πŸ› John Wiley and Sons 🌐 English βš– 919 KB

## Abstract By using multiple molecular dynamics (MD) trajectories, a quantitative description of carbon monoxide (CO) migration within crystal of L29F myoglobin mutant (L29F‐Mb) was obtained. The aim was to provide a detailed model for ligand diffusion in the protein to be compared to the availabl