Statistics: Model class (with restraints) from pdb failed. /net/marbles/raid1/dorothee/rerefine/cryoem/data_no_H/6sae_10129/12_2021/6sae_10129.pdb /net/marbles/raid1/dorothee/rerefine/cryoem/data_no_H/6sae_10129/12_2021/6sae_10129.map 1.9 Traceback (most recent call last): File "/net/marbles/raid1/dorothee/rerefine/cryoem/rerefine_script.py", line 345, in get_statistics model.process(make_restraints=True) File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20rc4-4434/modules/cctbx_project/mmtbx/model/model.py", line 1708, in process allow_missing_symmetry = True) File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20rc4-4434/modules/cctbx_project/mmtbx/utils/__init__.py", line 287, in process_pdb_files allow_missing_symmetry = allow_missing_symmetry) File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20rc4-4434/modules/cctbx_project/mmtbx/utils/__init__.py", line 358, in _process_pdb_file substitute_non_crystallographic_unit_cell_if_necessary=allow_missing_symmetry) File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20rc4-4434/modules/cctbx_project/mmtbx/monomer_library/pdb_interpretation.py", line 5741, in __init__ restraints_loading_flags=restraints_loading_flags) File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20rc4-4434/modules/cctbx_project/mmtbx/monomer_library/pdb_interpretation.py", line 3324, in __init__ self.counts.raise_duplicate_atom_labels_if_necessary() File "/net/cci-filer2/raid1/xp/phenix/phenix-1.20rc4-4434/modules/cctbx_project/iotbx/pdb/hierarchy.py", line 342, in raise_duplicate_atom_labels_if_necessary if (len(msg) != 0): raise Sorry(msg.rstrip()) Sorry: number of groups of duplicate atom labels: 1372 total number of affected atoms: 4116 group "HETA .*. C ACE A 0 .*. C " "HETA .*. C ACE A 0 .*. C " "HETA .*. C ACE A 0 .*. C " group "HETA .*. O ACE A 0 .*. O " "HETA .*. O ACE A 0 .*. O " "HETA .*. O ACE A 0 .*. O " group "HETA .*. CH3 ACE A 0 .*. C " "HETA .*. CH3 ACE A 0 .*. C " "HETA .*. CH3 ACE A 0 .*. C " group "ATOM .*. N SER A 1 .*. N " "ATOM .*. N SER A 1 .*. N " "ATOM .*. N SER A 1 .*. N " group "ATOM .*. CA SER A 1 .*. C " "ATOM .*. CA SER A 1 .*. C " "ATOM .*. CA SER A 1 .*. C " group "ATOM .*. C SER A 1 .*. C " "ATOM .*. C SER A 1 .*. C " "ATOM .*. C SER A 1 .*. C " group "ATOM .*. O SER A 1 .*. O " "ATOM .*. O SER A 1 .*. O " "ATOM .*. O SER A 1 .*. O " group "ATOM .*. CB SER A 1 .*. C " "ATOM .*. CB SER A 1 .*. C " "ATOM .*. CB SER A 1 .*. C " group "ATOM .*. OG SER A 1 .*. O " "ATOM .*. OG SER A 1 .*. O " "ATOM .*. OG SER A 1 .*. O " group "ATOM .*. N TYR A 2 .*. N " "ATOM .*. N TYR A 2 .*. N " "ATOM .*. N TYR A 2 .*. N " ... 1362 remaining groups not shown