Hi James, The easiest way I find is outside the GUI. On a command line type:
freerflag HKLIN foo.mtz HKLOUT bar.mtz end Then rename bar.mtz to foo.mtz, and you should find that the job is done, with 5% of your reflections in the free set. Cheers, Graeme -----Original Message----- From: CCP4 bulletin board [mailto:[EMAIL PROTECTED] On Behalf Of James Pauff Sent: 31 May 2007 13:39 To: [email protected] Subject: [ccp4bb] Rfree into an existing mtz... Good day all, What is the best means of getting a freeR column into an existing mtz file? I've noticed the "Edit MTZ" command bar in CCP4, but there are other options (such as conversion to XPLOR and then back to MTZ) that seem to be able to accomplish the same thing, although there appear to be changes in the reflection parameters upon this conversion. Basically, I just want to add a freeR column to monitor my refinement(s). Thank you as usual. ________________________________________________________________________ ____________Looking for a deal? Find great prices on flights and hotels with Yahoo! FareChase. http://farechase.yahoo.com/
