Dear Eleanor, I think it would be a good idea to use CAD from the CCP4i GUI: you can change/add cell parameters, crystal, wavelength, dataset and project names.
All the best, Philippe Philippe BENAS, Ph.D. ARN UPR 9002 CNRS IBMC Strasbourg 2, Allée Conrad Roentgen F-67084 STRASBOURG cedex (Google Maps Code Plus: HQH7+VV Strasbourg)+33.3.8841.7109 E-mails: p.be...@ibmc-cnrs.unistra.fr, philippe_be...@yahoo.fr URLs: https://ibmc.cnrs.fr/, https://ibmc.cnrs.fr/laboratoire/arn/ Le mardi 5 avril 2022 à 15:47:15 UTC+2, Eleanor Dodson <0000176a9d5ebad7-dmarc-requ...@jiscmail.ac.uk> a écrit : Does ANYONE know how to use this useful but ultra-frustrating program?? I have an mtz file which lacks WAVElength AND Dataset name. I try to follow the sftools documentation, and get an output file which - lacks WAVElength AND Dataset name. Grrrr sftools <<eof READ "detwin_job1-IMEANa.mtz" mtz SET DWAVE 1.2 WAVElength AND Dataset name. write "detwin_job1-IMEANab.mtz" mtz EXIT YES eof To unsubscribe from the CCP4BB list, click the following link: https://www.jiscmail.ac.uk/cgi-bin/WA-JISC.exe?SUBED1=CCP4BB&A=1 ######################################################################## To unsubscribe from the CCP4BB list, click the following link: https://www.jiscmail.ac.uk/cgi-bin/WA-JISC.exe?SUBED1=CCP4BB&A=1 This message was issued to members of www.jiscmail.ac.uk/CCP4BB, a mailing list hosted by www.jiscmail.ac.uk, terms & conditions are available at https://www.jiscmail.ac.uk/policyandsecurity/
