I would like to do the MD simulation of Cytochrome P450. For that, I got
the heme group parameters for the pentacoordinate ferric(Fe(III)) complex
which is in a high spin state from Shahrokh, Orendt, et al. 2012. However,
I am unable to get the heme parameters for a native hexacoordinate
ferric(Fe(III)) form which is in a low spin state. I would appreciate it
very much if anyone can let me know, where can I get the low spin state(
native hexacoordinate ferric form) parameters of the heme group in Cytochrome
P450.
Thanks in advance,
Patil
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Received on Fri May 28 2021 - 13:00:03 PDT
