[phenixbb] picking rfree

[Mischa Machius]

We just had a monoclinic case with a beta angle of 90.02! That's just  
to show that such things do indeed occur. Best - MM

On Feb 7, 2008, at 2:07 PM, David Garboczi wrote:

> I am working with a dataset that I believe to be P21 even though the  
> beta angle is 89.9.  I picked the rfree set with phenix and expected  
> it to pick the set in the orthorhombic set, because  
> use_lattice_symmetry= True is the default.
>
> But the log file did not reflect that phenix recognized the almost  
> orthorhombic symmetry.  I'd like to know if it did pick the rfree  
> set in the higher symmetry or not.
>
> thanks,
>
> Dave
>
> -- 
> David N. Garboczi, PhD
> Phone: 301-496-4773
> Investigator, Structural Biology Section (SBS)
> Laboratory of Immunogenetics (LIG)
> National Institute of Allergy and Infectious Diseases (NIAID)
> National Institutes of Health (NIH)
> Twinbrook 2/Room 110
> 12441 Parklawn Drive
> Rockville, Maryland 20852-1742
> Fax:    301-402-0284
> Email: dgarboczi at niaid.nih.gov
>
>
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--------------------------------------------------------------------------------
Mischa Machius, PhD
Associate Professor
UT Southwestern Medical Center at Dallas
5323 Harry Hines Blvd.; ND10.214A
Dallas, TX 75390-8816; U.S.A.
Tel: +1 214 645 6381
Fax: +1 214 645 6353


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