INPUT Reading model from /net/marbles/raid1/dorothee/rerefine/cryoem/data_no_H/6nt4_0501/12_2022/6nt4_0501.pdb Reading option "hydrogens=False" from command line Writing effective parameters to 6nt4_0501.eff Ligand restraint generation using eLBOW, phenix.elbow Build ligand and use monomer library to name atoms : AJP Using monomer library entry AJP as template Difficulties in the ring structures may lead to problems later group index 8 change? False ChiralClass Atom C81(81) xyz:(-7.078, -3.649, -4.429) Atom C12(12) xyz:(-6.765, -2.692, -5.502) S ring index: 7 Atom C11(11) xyz:(-7.201, -1.595, -5.028) S ring index: 7 Atom C07( 7) xyz:(-7.788, -3.155, -6.543) R ring index: 7 Atom C13(13) xyz:(-4.778, -2.799, -5.537) ring index: 7 not correct chiralisation Difficulties in the ring structures may lead to problems later Build ligand and use monomer library to name atoms : LHG Using monomer library entry LHG as template Build ligand and use monomer library to name atoms : Y01 Using monomer library entry Y01 as template group index 6 change? False ChiralClass Atom HBD(59) xyz:( 0.394, -0.838, -1.088) Atom CBD(18) xyz:(-0.672, -0.274, -1.633) S ring index: 1 Atom CAK(19) xyz:(-0.174, -0.043, -3.246) ring index: 1 Atom CBF(17) xyz:(-0.640, 1.411, -0.772) S ring index: 1 Atom CBG(12) xyz:(-1.587, -0.799, -1.485) S ring index: 1 not correct chiralisation Difficulties in the ring structures may lead to problems later Attempting to download Chemical Components file for 76F Running eLBOW on 76F.cif MoleculeClass : C:41 N: 1 O: 8 P: 1 (CHEMICAL COMPONENTS format) 126 atoms 125 bonds 235 angles 322 dihedrals 0 rings (groups, rings, atoms) 0 0 1 chirals : R Build ligand and use user provided restraints : 76F Traceback (most recent call last): File "/net/cci-filer2/raid1/xp/phenix/phenix-dev-4807/build/../modules/elbow/elbow/command_line/ready_set.py", line 1108, in run(args) File "/net/cci-filer2/raid1/xp/phenix/phenix-dev-4807/build/../modules/elbow/elbow/command_line/ready_set.py", line 882, in run random_seed=working_params.ready_set.run_options.random_seed, File "/net/cci-filer2/raid1/xp/phenix/phenix-dev-4807/build/../modules/elbow/elbow/command_line/ready_set.py", line 266, in run_though_all_the_options None), File "/net/cci-filer2/raid1/xp/phenix/phenix-dev-4807/modules/elbow/elbow/scripts/elbow_on_pdb_file.py", line 2487, in run hydrogens=hydrogens, File "/net/cci-filer2/raid1/xp/phenix/phenix-dev-4807/modules/elbow/elbow/scripts/elbow_on_pdb_file.py", line 2027, in elbow_on_pdb_file line.name = atom.atom_name_in_input AttributeError: AtomClass instance has no attribute 'atom_name_in_input'