[phenixbb] HA clusters

Thomas C. Terwilliger terwilliger at lanl.gov
Mon Nov 13 18:01:38 PST 2006


Hi Peter,
Yes, unfortunately no easy way to do clusters in the wizards. Solve can
phase with them but that is very laborious too...and not necessarily worth
the effort!
All the best,
TomT
ps...try running AutoSol or AutoBuild...I am running xtriage and posting
the output on the magnifying glass page!


> The super atom approach seems like the best way forward at this moment in
> time.
> No need for CNS, you can do this with hyss as well. You can place those
> coordinates manually
> in the Autosol wizard.
>
> HTH
>
> Peter
>
>
>
>
>
>> This is probably a stupid question but how do I tell AutoSol to
>> look for a
>> heavy-atom cluster rather than individual atoms? Or should I just
>> find the
>> cluster as a superatom in CNS and input the refined co-ordinates?
>>
>> Thanks,
>> --
>> Morten K Grøftehauge
>> PhD student
>> Department of Molecular Biology
>> Gustav Wieds Vej 10 C
>> 8000 Aarhus C - Denmark
>> Phone: +45 89 42 50 10
>> Fax: +45 86 12 31 78
>> www.bioxray.dk
>>
>
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