Water complexes of cytochrome P450 : insights from energy decomposition analysis
Water is a small molecule that nevertheless perturbs, sometimes significantly, the electronic properties of an enzyme's active site. In this study, interactions of a water molecule with the ferric heme and the compound I (Cpd I) intermediate of cytochrome P450 are studied. Energy decomposition...
Main Authors: | Thellamurege, Nandun, Hirao, Hajime |
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Other Authors: | School of Physical and Mathematical Sciences |
Format: | Journal Article |
Language: | English |
Published: |
2013
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Online Access: | https://hdl.handle.net/10356/98492 http://hdl.handle.net/10220/12427 |
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