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Docking and Migration of Carbon Monoxide in Nitrogenase: The Case for Gated Pockets from IR Spectroscopy and Molecular Dynamics
Evidence for a CO docking site near the FeMo-cofactor in nitrogenase has been obtained by FT-IR monitored low temperature photolysis. We investigated the possible migration paths for CO from this docking site using molecular dynamics calculations. The simulations support the notion of a gas channel...
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| Publicado no: | Biochemistry |
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| Main Authors: | , , , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2015
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4522414/ https://ncbi.nlm.nih.gov/pubmed/25919807 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.biochem.5b00216 |
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