Re: [ccp4bb] Placing coordinates and mtz reflections file on a common new origin

2013-07-31 Thread Mo Wong
Many thanks for the reply. Unless I have not RTFM properly, cphasematch only modifies one column of phases at a time, and outputs the modified phases to a new column. It also doesn't appear to take a reference PDB (corresponding to the reference mtz) as a means to calculate the appropriate rot/tra

Re: [ccp4bb] Placing coordinates and mtz reflections file on a common new origin

2013-07-31 Thread Kevin Cowtan
cphasematch should do the job. I presume you did a structure factor calculation for one or both models? I'm not clear what the problem is with that. Is it that it is giving you the wrong shift? On 30 July 2013 14:33, Mo Wong wrote: > Hi all, > > I am trying to get multiple molecular replacemen

[ccp4bb] Placing coordinates and mtz reflections file on a common new origin

2013-07-30 Thread Mo Wong
Hi all, I am trying to get multiple molecular replacement solutions on the same origin. I know this has been asked before, however, in my case I want to stick to CCP4 programmes (I am aware PHENIX can do this). I have tried to get this to work using csymmatch which outputs the origin-shifted coor