INPUT Reading model from /net/marbles/raid1/dorothee/rerefine/cryoem/data_no_H/7pxg_13702/01_2022/7pxg_13702.pdb Reading option "hydrogens=False" from command line Writing effective parameters to 7pxg_13702.eff Preparation for phenix.refine Ligand restraint generation using eLBOW, phenix.elbow More than 20 percent of the atoms are missing for 6PL as compared to the Monomer Library More than 20 percent of the atoms are missing for 6PL as compared to the Chemical Components Build ligand and use monomer library to name atoms : CLR Using monomer library entry CLR as template Difficulties in the ring structures may lead to problems later Attempting to download Chemical Components file for 8H5 Running eLBOW on 8H5.cif Difficulties in the ring structures may lead to problems later Traceback (most recent call last): File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20-4459/build/../modules/elbow/elbow/command_line/ready_set.py", line 1104, in run(args) File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20-4459/build/../modules/elbow/elbow/command_line/ready_set.py", line 878, in run random_seed=working_params.ready_set.run_options.random_seed, File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20-4459/build/../modules/elbow/elbow/command_line/ready_set.py", line 263, in run_though_all_the_options None), File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20-4459/modules/elbow/elbow/scripts/elbow_on_pdb_file.py", line 2485, in run hydrogens=hydrogens, File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20-4459/modules/elbow/elbow/scripts/elbow_on_pdb_file.py", line 781, in elbow_on_pdb_file silent=True, File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20-4459/modules/elbow/elbow/command_line/builder.py", line 2368, in run molecule = builder(molecule, options) File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20-4459/modules/elbow/elbow/command_line/builder.py", line 918, in builder molecule.Ringise() File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20-4459/modules/elbow/elbow/chemistry/RingTopologyMixins.py", line 91, in Ringise self.Generic_Ringise(allow_boat_conformation=allow_boat_conformation) File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20-4459/modules/elbow/elbow/chemistry/RingTopologyMixins.py", line 329, in Generic_Ringise self._add_dihedrals_to_aromatic_rings() File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20-4459/modules/elbow/elbow/chemistry/RingTopologyMixins.py", line 311, in _add_dihedrals_to_aromatic_rings if abs(dihedral.value())<10.: File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20-4459/modules/elbow/elbow/chemistry/DihedralClass.py", line 77, in value return self[0].xyz.BondDihedral(self[1].xyz, self[2].xyz, self[3].xyz) File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20-4459/modules/elbow/elbow/chemistry/xyzClass.py", line 480, in BondDihedral return sign*crossABC.Angle(crossBCD) File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20-4459/modules/elbow/elbow/chemistry/xyzClass.py", line 383, in Angle raise RuntimeError("zero bond length") RuntimeError: zero bond length