QM/MM modeling of compound I active species in cytochrome P450, cytochrome C peroxidase, and ascorbate peroxidase
QM/MM calculations provide a means for predicting the electronic structure of the metal center in metalloproteins. Two heme peroxidases, Cytochrome c Peroxidase (CcP) and Ascorbate Peroxidase (APX), have a structurally very similar active site, yet have active intermediates with very different elect...
| Veröffentlicht in: | Journal of computational chemistry. - 1984. - 27(2006), 12 vom: 01. Sept., Seite 1352-62 |
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| Format: | Aufsatz |
| Sprache: | English |
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2006
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| Zugriff auf das übergeordnete Werk: | Journal of computational chemistry |
| Schlagworte: | Journal Article Research Support, Non-U.S. Gov't Cytochrome P-450 Enzyme System 9035-51-2 Iron E1UOL152H7 Peroxidases EC 1.11.1.- Ascorbate Peroxidases EC 1.11.1.11 mehr... |