Re: [ccp4bb] PHENIX vs REFMAC refinement had me fooled

2011-12-10 Thread Yuri Pompeu
PHENIX has an otpion under the reflection editor program that will create R flags that are compatible with ccp4 programs. Another point worth mentioning is in phenix.refine it is appropriate to use the data.mtz files generated each round of refinement, as these are the raw data plus the Rfree fl

Re: [ccp4bb] Failure in Phaser EP

2011-12-10 Thread Tim Gruene
-BEGIN PGP SIGNED MESSAGE- Hash: SHA1 Dear Arko, your input script reads LABIN F+ = F(+) SIGF+ = SIGF(+) F- = F(-) SIGF- = SIGF(-) Try and replace SIGF+ with either SIG+ or SIGF(+); same for SIGF-. Tim On 12/10/2011 09:33 AM, arka chakraborty wrote: > Hi CCPers! > > I have a s

[ccp4bb] Failure in Phaser EP

2011-12-10 Thread arka chakraborty
Hi CCPers! I have a strange problem..I am trying to obtain phases for a dna decamer structure from cobalt SAD data. In the Phaser EP module when I input the mtz generated by Ctruncate and the heavy atom PDB file generated from shlelxC/D and run the program it fails. Below is the log file for one