On Tue, Dec 01, 2009 at 04:57:38PM +0000, Eleanor Dodson wrote: > One easy suggestion - try buccaneer and refinement! > Eleanor > The Arp/warp people will have to fix this..
It's also possible that this is due to a ctruncate problem: if the CAD job adds the SHARP MTZ file (with C2) and a MTZ file coming from ctruncate (with 'C121' instead of 'C 1 2 1') you could see that too. See http://www.ccp4.ac.uk/ccp4bin/viewcvs/ccp4/lib/clipper/clipper/ccp4/ccp4_mtz_io.cpp?sortby=date and the changes of 6 weeks ago. So it might be rather something in CCP4/Clipper than ARP/wARP ;-) A simple solution: echo "SYMM C2" | mtzutils hklin cad.mtz hklout cad_fix.mtz Cheers Clemens -- *************************************************************** * Clemens Vonrhein, Ph.D. vonrhein AT GlobalPhasing DOT com * * Global Phasing Ltd. * Sheraton House, Castle Park * Cambridge CB3 0AX, UK *-------------------------------------------------------------- * BUSTER Development Group (http://www.globalphasing.com) ***************************************************************
