Does anyone here have experience running sf_convert? I know it's not part of CCP4, but it does rely on CCP4 for converting structure factors to MTZ format.
When I try to run it, I get errors that suggest that my shell isn't bash, but it really is. The program output is as follows. sf_convert -o MTZ -sf 2hr0-sf.cif -pdb 2hr0.pdb -out 2hr0-sf.mtz Input file FORMAT=MMCIF Data type is Amplitude (F). If the guessed input format (MMCIF) is wrong, please use command: sf_convert -i input_format -o output_format -sf data_file Input File Name = 2hr0-sf.cif : (format=MMCIF) Doing mmcif to mmcif conversion.. Number of data blocks = 1 Data_block_id=r2hr0sf, pdbid=2hr0 Converting to mtz .. export: Command not found. export: Command not found. export: Command not found. export: Command not found. ccp4_first_in_path=1: Command not found. export: Command not found. export: Command not found. export: Command not found. export: Command not found. if: Expression Syntax. Output File Name = 2hr0-sf.mtz : (MTZ format) No output file is produced. I recognize some of the output from ccp4-setup.sh, but I don't know what's going wrong. Ideas? Suggestions? Eric
