[phenixbb] Hires input file problem
Troy E Messick
messickbb at gmail.com
Thu Oct 11 12:15:04 PDT 2007
Hi all,
I seem to be having a problem specifying the labels for the Hires
dataset for an Autobuild run.
Here is my input script:
input_data_file sharp.mtz
input_labels 'Fdm' 'SIGFPsha' 'PHIdm' 'FOMdm' 'HLAdm' 'HLBdm' 'HLCdm'
'HLDdm' 'FreeR_flag'
input_pdb_file ab.pdb
input_seq_file seq.dat
input_hires_file output.native.sca
Here is the error from the AutoBuild.log file:
************************************************************
Failed to carry out AutoBuild_datafile_info_inputs:
'all_input_hires_labels'
************************************************************
I've tried to use the mtz file from the ImportRawData_run directory
and specify the columns by substituting the last line in my input
script file with:
input_hires_file output_PHX.mtz
input_hires_labels 'output.native' 'SIGoutput.native'
which are the only labels I could find from mtzdump and that doesn't
work either. What am I missing here? Any suggestions would be
greatly appreciated.
Thanks,
Troy
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