[phenixbb] Merging Already-Scaled MTZs

Tim Gruene tim.gruene at psi.ch
Wed Apr 20 12:05:28 PDT 2016


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Dear Jacob,

it is technically not possible to merge relfection data twice, unless you 
change to a higher symmetry space group: merging means replacing symmetry 
related reflections with their mean.

For scaling this is different - couldn't you repeat the scaling step? I am not 
sure if phenix contains data processing software, I thought it starts at data 
analysis and structure solution.

Cheers,
Tim

On Wednesday, April 20, 2016 06:59:04 PM Keller, Jacob wrote:
> Dear Crystallographers,
> 
> I guess it is bad practice to merge/scale already-merged/scaled mtz's, but I
> have a special reason for wanting to do so. Does anyone know how this can
> be done in Phenix?
> 
> The reason is, if you're interested, that I want to detwin several different
> datasets to varying degrees, then merge them.
> 
> JPK
> 
> *******************************************
> Jacob Pearson Keller, PhD
> Looger Lab/HHMI Janelia Research Campus
> 19700 Helix Dr, Ashburn, VA 20147
> email: kellerj at janelia.hhmi.org
> *******************************************
> 
> 
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Tim Gruene
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