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QM/MM Investigation of the Role of a Second Coordination Shell Arginine in [NiFe]-Hydrogenases
[NiFe]-hydrogenases are highly efficient catalysts for the heterolytic splitting of molecular hydrogen (H(2)). The heterobimetallic cysteine-coordinated active site of these enzymes is covered by a highly conserved arginine residue, whose role in the reaction is not fully resolved yet. The structura...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Frontiers Media S.A.
2018
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5962704/ https://www.ncbi.nlm.nih.gov/pubmed/29868565 http://dx.doi.org/10.3389/fchem.2018.00164 |