[ccp4bb] Postdoc positions in Hao Wu lab, Boston

Dear Colleagues, The Hao Wu lab at Boston Children’s Hospital and Harvard Medical School in Boston, MA (https://www.wulab.tch.harvard.edu/) has openings for postdoctoral positions to study structures and functions of supramolecular complexes, especially those in the inflammasome pathway, using

[ccp4bb] Labeling centric and acentric reflections

Hi, Is there a way to label centric and acentric reflections in the .mtz file and output an additional column, let's say, with values 0 (acentric) and 1 (centric), similar to R_free flagging? With the keyword CENTRIC_ONLY, CAD does something similar but only outputs centric reflections without

Re: [ccp4bb] Labeling centric and acentric reflections

Thank you for the perfect answer, Alejandro. I have been Googling the subject since this morning and missed the CALC documentation entirely. The keyword "CALC COL centric = 1 c -" did the job! All the best. Em qua., 21 de dez. de 2022 às 16:40, Alejandro Buschiazzo < ale...@pasteur.edu.uy>

Re: [ccp4bb] Labeling centric and acentric reflections

Hi AndreI think you can use SFTOOLS. Check it with the documentation (cause not sure exactly), but after reading your mtz, you can use the command CALC. This  calculates lots of stuff, and even has some builtin functions, including the one you want (which  I think can be called with a