Dear all, I'm trying to use Ample from CCP4 (6.4) to solve a structure of 2x197 residues from 2.0 A data. After the generation of initial (120) models by Rosetta (3.3) Ample stops with the error-message below. Could anyone provide me information about the origin of this error and possibly how to solve the problem?
Thanks in advance for your replies! Best wishes, Florian *************************************************************************** * Information from CCP4Interface script *************************************************************************** The program run with command: /home/flo/crystallography/ccp4-6.4.0/bin/ccp4-python -u /home/flo/crystallography/ccp4-6.4.0/bin/ample -mtz /home/flo/crystallography/Virchow/ESRF_20140707/CM133A/ccp4/pos5wedge3scaled.mtz -fasta /home/flo/Desktop/arch.seq -name MVD0 -run_dir /home/flo/crystallography/Virchow/ESRF_20140707/pos7au/ccp4 -nproc 3 -F F_XDSdataset -SIGF SIGF_XDSdataset -FREE FreeR_flag -models_dir /home/flo/crystallography/Virchow/ESRF_20140707/pos7au/ccp4/ROSETTA_MR_0/models/models_1 -early_terminate True -use_shelxe True -use_arpwarp False has failed with error message Traceback (most recent call last): File "/home/flo/crystallography/ccp4-6.4.0/bin/ample", line 757, in ensemble.create_ensembles( amopt.d ) File "/home/flo/crystallography/ccp4-6.4.0/share/ample/python/ensemble.py", line 85, in create_ensembles ensembles = ensemble_models( amoptd['spicker_results'][ cluster-1 ].pdb_list, amoptd, ensemble_id=cluster ) File "/home/flo/crystallography/ccp4-6.4.0/share/ample/python/ensemble.py", line 58, in ensemble_models percent=amoptd['percent'] ) File "/home/flo/crystallography/ccp4-6.4.0/share/ample/python/ample_ensemble.py", line 168, in generate_ensembles self.make_truncated_ensembles() File "/home/flo/crystallography/ccp4-6.4.0/share/ample/python/ample_ensemble.py", line 312, in make_truncated_ensembles clusterer.generate_distance_matrix( self.truncated_models[tcount] ) File "/home/flo/crystallography/ccp4-6.4.0/share/ample/python/cluster_with_MAX.py", line 55, in generate_distance_matrix retcode = ample_util.run_command( cmd, logfile=log_name ) File "/home/flo/crystallography/ccp4-6.4.0/share/ample/python/ample_util.py", line 274, in run_command p = subprocess.Popen( cmd, stdin=stdin, stdout=logf, stderr=subprocess.STDOUT, cwd=directory, **kwargs ) File "/home/flo/crystallography/ccp4-6.4.0/lib/python2.7/subprocess.py", line 711, in __init__ errread, errwrite) File "/home/flo/crystallography/ccp4-6.4.0/lib/python2.7/subprocess.py", line 1308, in _execute_child raise child_exception OSError: [Errno 8] Exec format error *************************************************************************** -- Dr. Florian Sauer Rudolf Virchow Zentrum für Experimentelle Biomedizin Josef-Schneider-Str. 2, Haus D15 97080 Würzburg