[phenixbb] correct space group for phenix.merging_statistics?

Murpholino Peligro murpholinox at gmail.com
Wed Feb 17 14:44:48 PST 2016


Thanks!

2016-02-17 13:32 GMT-06:00 Tim Gruene <tim.gruene at psi.ch>:

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> Dear Murpholino Peligro,
>
> merging statistics are not affected by screw axes (or glide planes), it
> only
> depends on the Laue group. as P422 and P4(3)2(1)2 belong to the same Laue
> group, it makes no difference.
>
> In fact it should not matter what you put into XDS_ASCII.HKL. If your data
> allows, it is advisable to integrate your data in P1 and assign the space
> group after data collection (This is not directly related to your
> question).
>
> Best, Tim
>
>
>
>
> On Wednesday, February 17, 2016 10:38:04 AM Murpholino Peligro wrote:
> > Hi.
> > Is it really important to have the correct space group in the mtz (or
> > XDS_ASCII.HKL) file which will be the input for
> phenix.merging_statistics?
> >
> > I have space group= 89
> > And I know it is space group=96
> >
> >
> > Thanks
> - --
> - --
> Paul Scherrer Institut
> Tim Gruene
> - - persoenlich -
> OFLC/102
> CH-5232 Villigen PSI
> phone: +41 (0)56 310 5754
>
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