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Unveiling functional protein motions with picosecond x-ray crystallography and molecular dynamics simulations
A joint analysis of all-atom molecular dynamics (MD) calculations and picosecond time-resolved x-ray structures was performed to gain single-molecule insights into mechanisms of protein function. Ensemble-averaged MD simulations of the L29F mutant of myoglobin after ligand dissociation reproduce the...
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| Main Authors: | , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado: |
National Academy of Sciences
2004
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| Assuntos: | |
| Acceso en liña: | https://ncbi.nlm.nih.gov/pmc/articles/PMC523450/ https://ncbi.nlm.nih.gov/pubmed/15489270 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.0405295101 |
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