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[ccp4bb]: DM script
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Dear All,
We are trying to run ccp4i DM for map averaging using a
predefined rotation matrix /
and translation vector from LSQKAB, following the example scripts, but
regardless of euler/polar, change of sequence etc we get the
following error message which does not appear to follow the
logic of the script...what are we missing here?
dm: (RCARDS) AVER: enter indentity matrix first
Well, looks like it is entered, so there must be another error in
our script?...
Regards, Gokulan & BR
Data line--- MODE SOLV AVER
Data line--- COMBINE PERT
Data line--- SCHEME ALL
Data line--- NCYCLE 10
Data line--- SOLCONT 0.7
Data line--- AVERAGE domain 1 REFI
Data line--- ROTATION MATRIX 1.0 0.0 0.0 0.0 1.0 0.0 0.0 0.0
1.0
Data line--- TRANSLAT 0.0 0.0 0.0
Data line--- AVERAGE domain 2 REFI
Data line--- ROTATION MATRIX -0.2862 -0.71842 -0.634 -0.71699
-0.27837 0.63909
-0.63562 0.63648 -0.43544
Data line--- TRANSLAT 78.126 77.857 -0.03
Data line--- NCSMASK nmer 2 update 10
Data line--- LABIN FP=FPsha SIGFP=SIGFPsha PHIO=PHIBsha FOMO=FOMsha
Data line--- >LABOUT FDM=FDM2 PHIDM=PHIDM2 FOMDM=FOMDM2
dm: (RCARDS) AVER: enter indentity matrix first
Times: User: 0.0s System: 0.0s Elapsed: 0:00
</pre>
</html>
************************************************************************
***
* Information from CCP4Interface script
************************************************************************
***
The program run with command: dm HKLIN
/u2/gokulan/sharpfiles/logfiles_local/test-lys.1/eden_flat_49.8pc.mtz
HKLOUT
/u2/gokulan/sharpfiles/logfiles_local/test-lys.1/eden_flat_49.8pc_dm2.mt
z
SOLOUT
/u2/gokulan/sharpfiles/logfiles_local/test-lys.1/eden_flat_49.8pc_dm2.ms
k
NCSOUT /u2/gokulan/acps/REFMAC/SHARP_48_ncs.msk VUOUT
/u2/gokulan/sharpfiles/logfiles.pompano/test-lys.1/SHARP_48_ncs.odat
has failed with error message
dm: (RCARDS) AVER: enter indentity matrix first
************************************************************************
***
#CCP4I TERMINATION STATUS 0 " dm: (RCARDS) AVER: enter indentity
matrix
first "
#CCP4I TERMINATION TIME 19 Sep 2002 18:59:21
#CCP4I TERMINATION OUTPUT_FILES
/u2/gokulan/acps/REFMAC/SHARP_48_ncs.msk
TEMPORARY
#CCP4I MESSAGE Task failed
------------------------------------
Bernhard Rupp
Dept. of Biochemistry and Biophysics
2128 Texas A&M University
College Station, TX 77843-2128
cell 925 209 7429
lab 979 862 7639
sec 979 862 7636
fax 801 880 3982
------------------------------------