Re: [phenixbb] symmetry file for Phenix merging statistics

Hi Xiao, now I would try with providing the crystal symmetry information, space group and unit cell. Pavel On 8/3/15 07:42, Xiao Lei wrote:

Hi Pavel,

Thanks for your information. I tried it without giving the symmetry file and I failed with an error message immediately after I click "run". It says "Phenix error: missing unit cell information".

Xiao

On Sat, Aug 1, 2015 at 5:27 PM, Pavel Afonine mailto:[email protected]> wrote:

Hi Xiao,

if you run phenix.merging_statistics without giving it arguments it will print out available parameters that you can change. Among them are unit_cell and space_group.

I'm guessing you can define them just like this

unit_cell="10,20,30,90,90,90" space_group="P212121"

Pavel

On 7/30/15 16:56, Xiao Lei wrote:

Hi Phenixbb members,

I am trying to use "phenix merging statistics" tool, and I have an unmerged sca file from HKL2000, because the unmerged HKL2000 output does not have unit cell information, so I also need to input a symmetry file, how can I find the symmetry file? Is there a way to generate a symmetry file?

Thanks ahead.

Xiao