I solved my own problem!
Within the lib the heme/cys were defined a single unit while in my full
protein they were two different units.
P
On Tue, Jul 2, 2013 at 10:58 PM, Parker de Waal <Parker.deWaal09.kzoo.edu>wrote:
> Hi AMBER Users!
>
> I'm trying to use custom heme parameters with my P450, however whenever I
> try to load the final protein-heme complex I am greeted with this error ->
> https://gist.github.com/ParkerdeWaal/89795cb358f8efbae6c5
>
> I don't quite understand the error as I have been able to successfully
> load and create the isolated heme/cys unit which I have named HEC.
>
> If it helps the full protein/hec unit can be found here ->
> research.parkerdewaal.com/3QM4_A_HEC.pdb
>
> And the HEC unit as a single can be found here ->
> research.parkerdewaal.com/heme_cys.pdb
>
> Best,
> Parker
>
>
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Received on Wed Jul 03 2013 - 11:30:03 PDT
