data_2EYM

_pdbx_vrpt_database.id    PDB
_pdbx_vrpt_database.code  2EYM
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   x-ray
#
_pdbx_vrpt_summary.entry_id                    2EYM
_pdbx_vrpt_summary.PDB_deposition_date         2005-11-09
_pdbx_vrpt_summary.PDB_revision_number         6
_pdbx_vrpt_summary.PDB_revision_date           2021-10-20
_pdbx_vrpt_summary.report_creation_date        2021-10-12:16:49
_pdbx_vrpt_summary.attempted_validation_steps  molprobity,validation-pack,percentiles,writexml,writecif,writepdf
_pdbx_vrpt_summary.ligands_for_buster_report   N
#
loop_
_pdbx_vrpt_entity.id
_pdbx_vrpt_entity.type
_pdbx_vrpt_entity.description
1  polymer  "Staphylococcal nuclease"  
2  water    water  
#
loop_
_pdbx_vrpt_asym.label_asym_id
_pdbx_vrpt_asym.entity_id
A  1  
B  2  
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all  x-ray  
2  1.8  x-ray  
#
loop_
_pdbx_vrpt_percentile_type.id
_pdbx_vrpt_percentile_type.type
1  all_atom_clashscore           
2  Ramachandran_outlier_percent  
3  rotamer_outliers_percent      
#
loop_
_pdbx_vrpt_percentile_conditions.id
_pdbx_vrpt_percentile_conditions.percentile_list_id
_pdbx_vrpt_percentile_conditions.type_id
_pdbx_vrpt_percentile_conditions.rank
_pdbx_vrpt_percentile_conditions.number_entries_total
_pdbx_vrpt_percentile_conditions.res_high
_pdbx_vrpt_percentile_conditions.res_low
1  1  1  16.50  141614     ?     ?  
2  2  1   6.55    6793  1.80  1.80  
3  1  2   6.00  138981     ?     ?  
4  2  2   0.91    6697  1.80  1.80  
5  1  3   4.48  138945     ?     ?  
6  2  3   0.87    6696  1.80  1.80  
#
loop_
_pdbx_vrpt_percentile_entity_view.ordinal
_pdbx_vrpt_percentile_entity_view.conditions_id
_pdbx_vrpt_percentile_entity_view.type_id
_pdbx_vrpt_percentile_entity_view.label_asym_id
_pdbx_vrpt_percentile_entity_view.PDB_model_num
_pdbx_vrpt_percentile_entity_view.entity_id
_pdbx_vrpt_percentile_entity_view.auth_asym_id
_pdbx_vrpt_percentile_entity_view.rank
1  3  2  A  1  1  A  6.34  
2  4  2  A  1  1  A  0.97  
3  5  3  A  1  1  A  5.07  
4  6  3  A  1  1  A  0.99  
#
loop_
_pdbx_vrpt_summary_entity_geometry.ordinal
_pdbx_vrpt_summary_entity_geometry.PDB_model_num
_pdbx_vrpt_summary_entity_geometry.entity_id
_pdbx_vrpt_summary_entity_geometry.label_asym_id
_pdbx_vrpt_summary_entity_geometry.auth_asym_id
_pdbx_vrpt_summary_entity_geometry.angles_RMSZ
_pdbx_vrpt_summary_entity_geometry.bonds_RMSZ
_pdbx_vrpt_summary_entity_geometry.num_bonds_RMSZ
_pdbx_vrpt_summary_entity_geometry.num_angles_RMSZ
1  1  1  A  A  1.03  0.40  1152  1545  
2  1  2  B  A     ?     ?     ?     ?  
#
_pdbx_vrpt_summary_geometry.ordinal                        1
_pdbx_vrpt_summary_geometry.percent_ramachandran_outliers  2.26
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers       12.28
_pdbx_vrpt_summary_geometry.clashscore                     14.23
_pdbx_vrpt_summary_geometry.num_H_reduce                   1154
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ                 1152
_pdbx_vrpt_summary_geometry.bonds_RMSZ                     0.40
_pdbx_vrpt_summary_geometry.num_angles_RMSZ                1545
_pdbx_vrpt_summary_geometry.angles_RMSZ                    1.03
#
_pdbx_vrpt_summary_diffraction.exp_method           x-ray
_pdbx_vrpt_summary_diffraction.ordinal              1
_pdbx_vrpt_summary_diffraction.PDB_resolution_high  1.80
_pdbx_vrpt_summary_diffraction.PDB_resolution_low   8.00
_pdbx_vrpt_summary_diffraction.PDB_R                0.20
_pdbx_vrpt_summary_diffraction.PDB_Rfree            0.26
#
loop_
_pdbx_vrpt_model_instance.id
_pdbx_vrpt_model_instance.PDB_model_num
_pdbx_vrpt_model_instance.entity_id
_pdbx_vrpt_model_instance.label_asym_id
_pdbx_vrpt_model_instance.label_seq_id
_pdbx_vrpt_model_instance.label_comp_id
_pdbx_vrpt_model_instance.auth_asym_id
_pdbx_vrpt_model_instance.auth_seq_id
_pdbx_vrpt_model_instance.label_alt_id
_pdbx_vrpt_model_instance.PDB_ins_code
_pdbx_vrpt_model_instance.count_clashes
  1  1  1  A    7  LEU  A    7  .  ?        ?  
  2  1  1  A    8  HIS  A    8  .  ?        ?  
  3  1  1  A    9  LYS  A    9  .  ?        ?  
  4  1  1  A   10  GLU  A   10  .  ?        1  
  5  1  1  A   11  PRO  A   11  .  ?        ?  
  6  1  1  A   12  ALA  A   12  .  ?        ?  
  7  1  1  A   13  THR  A   13  .  ?        ?  
  8  1  1  A   14  LEU  A   14  .  ?        ?  
  9  1  1  A   15  ILE  A   15  .  ?        2  
 10  1  1  A   16  LYS  A   16  .  ?        ?  
 11  1  1  A   17  ALA  A   17  .  ?        ?  
 12  1  1  A   18  ILE  A   18  .  ?        ?  
 13  1  1  A   19  ASP  A   19  .  ?        ?  
 14  1  1  A   20  GLY  A   20  .  ?        ?  
 15  1  1  A   21  ASP  A   21  .  ?        1  
 16  1  1  A   22  THR  A   22  .  ?        ?  
 17  1  1  A   23  VAL  A   23  A  ?        ?  
 18  1  1  A   23  VAL  A   23  B  ?        ?  
 19  1  1  A   24  LYS  A   24  .  ?        ?  
 20  1  1  A   25  LEU  A   25  .  ?        ?  
 21  1  1  A   26  MET  A   26  .  ?        3  
 22  1  1  A   27  TYR  A   27  .  ?        ?  
 23  1  1  A   28  LYS  A   28  .  ?        3  
 24  1  1  A   29  GLY  A   29  .  ?        ?  
 25  1  1  A   30  GLN  A   30  .  ?        ?  
 26  1  1  A   31  PRO  A   31  .  ?        1  
 27  1  1  A   32  MET  A   32  .  ?        ?  
 28  1  1  A   33  THR  A   33  .  ?        ?  
 29  1  1  A   34  PHE  A   34  .  ?        ?  
 30  1  1  A   35  ARG  A   35  .  ?        ?  
 31  1  1  A   36  LEU  A   36  A  ?        1  
 32  1  1  A   36  LEU  A   36  B  ?        ?  
 33  1  1  A   37  LEU  A   37  .  ?        ?  
 34  1  1  A   38  LEU  A   38  .  ?        1  
 35  1  1  A   39  VAL  A   39  .  ?        ?  
 36  1  1  A   40  ASP  A   40  .  ?        1  
 37  1  1  A   41  THR  A   41  .  ?        ?  
 38  1  1  A   42  PRO  A   42  .  ?        ?  
 39  1  1  A   43  GLU  A   43  .  ?        ?  
 40  1  1  A   44  THR  A   44  .  ?        ?  
 41  1  1  A   45  LYS  A   45  .  ?        2  
 42  1  1  A   46  HIS  A   46  .  ?        2  
 43  1  1  A   47  PRO  A   47  .  ?        ?  
 44  1  1  A   48  LYS  A   48  .  ?        ?  
 45  1  1  A   49  LYS  A   49  .  ?        1  
 46  1  1  A   50  GLY  A   50  .  ?        2  
 47  1  1  A   51  VAL  A   51  .  ?        ?  
 48  1  1  A   52  GLU  A   52  .  ?        1  
 49  1  1  A   53  LYS  A   53  .  ?        ?  
 50  1  1  A   54  TYR  A   54  .  ?        ?  
 51  1  1  A   55  GLY  A   55  .  ?        ?  
 52  1  1  A   56  PRO  A   56  .  ?        ?  
 53  1  1  A   57  GLU  A   57  .  ?        ?  
 54  1  1  A   58  ALA  A   58  .  ?        ?  
 55  1  1  A   59  SER  A   59  .  ?        ?  
 56  1  1  A   60  ALA  A   60  .  ?        ?  
 57  1  1  A   61  PHE  A   61  .  ?        ?  
 58  1  1  A   62  THR  A   62  .  ?        ?  
 59  1  1  A   63  LYS  A   63  .  ?        2  
 60  1  1  A   64  LYS  A   64  .  ?        3  
 61  1  1  A   65  MET  A   65  .  ?        ?  
 62  1  1  A   66  VAL  A   66  .  ?        ?  
 63  1  1  A   67  GLU  A   67  .  ?        1  
 64  1  1  A   68  ASN  A   68  .  ?        ?  
 65  1  1  A   69  ALA  A   69  .  ?        ?  
 66  1  1  A   70  LYS  A   70  .  ?        ?  
 67  1  1  A   71  LYS  A   71  .  ?        3  
 68  1  1  A   72  ILE  A   72  A  ?        ?  
 69  1  1  A   72  ILE  A   72  B  ?        ?  
 70  1  1  A   73  GLU  A   73  .  ?        ?  
 71  1  1  A   74  VAL  A   74  .  ?        2  
 72  1  1  A   75  GLU  A   75  .  ?        ?  
 73  1  1  A   76  PHE  A   76  .  ?        ?  
 74  1  1  A   77  ASP  A   77  .  ?        ?  
 75  1  1  A   78  LYS  A   78  .  ?        ?  
 76  1  1  A   79  GLY  A   79  .  ?        ?  
 77  1  1  A   80  GLN  A   80  .  ?        ?  
 78  1  1  A   81  ARG  A   81  A  ?        ?  
 79  1  1  A   81  ARG  A   81  B  ?        ?  
 80  1  1  A   82  THR  A   82  .  ?        ?  
 81  1  1  A   83  ASP  A   83  .  ?        ?  
 82  1  1  A   84  LYS  A   84  .  ?        ?  
 83  1  1  A   85  TYR  A   85  .  ?        ?  
 84  1  1  A   86  GLY  A   86  .  ?        ?  
 85  1  1  A   87  ARG  A   87  .  ?        ?  
 86  1  1  A   88  GLY  A   88  .  ?        ?  
 87  1  1  A   89  LEU  A   89  .  ?        ?  
 88  1  1  A   90  ALA  A   90  .  ?        ?  
 89  1  1  A   91  TYR  A   91  .  ?        ?  
 90  1  1  A   92  ILE  A   92  A  ?        2  
 91  1  1  A   92  ILE  A   92  B  ?        ?  
 92  1  1  A   93  TYR  A   93  .  ?        ?  
 93  1  1  A   94  ALA  A   94  .  ?        ?  
 94  1  1  A   95  ASP  A   95  .  ?        ?  
 95  1  1  A   96  GLY  A   96  .  ?        ?  
 96  1  1  A   97  LYS  A   97  .  ?        1  
 97  1  1  A   98  MET  A   98  .  ?        ?  
 98  1  1  A   99  VAL  A   99  .  ?        ?  
 99  1  1  A  100  ASN  A  100  .  ?        ?  
100  1  1  A  101  GLU  A  101  .  ?        2  
101  1  1  A  102  ALA  A  102  .  ?        ?  
102  1  1  A  103  LEU  A  103  .  ?        ?  
103  1  1  A  104  VAL  A  104  .  ?        ?  
104  1  1  A  105  ARG  A  105  .  ?        ?  
105  1  1  A  106  GLN  A  106  .  ?        ?  
106  1  1  A  107  GLY  A  107  .  ?        ?  
107  1  1  A  108  LEU  A  108  .  ?        ?  
108  1  1  A  109  ALA  A  109  .  ?        ?  
109  1  1  A  110  LYS  A  110  .  ?        1  
110  1  1  A  111  VAL  A  111  .  ?        ?  
111  1  1  A  112  ALA  A  112  .  ?        1  
112  1  1  A  113  TYR  A  113  .  ?        1  
113  1  1  A  114  VAL  A  114  .  ?        1  
114  1  1  A  115  TYR  A  115  .  ?        1  
115  1  1  A  116  LYS  A  116  .  ?        ?  
116  1  1  A  117  PRO  A  117  .  ?        ?  
117  1  1  A  118  ASN  A  118  .  ?        ?  
118  1  1  A  119  ASN  A  119  .  ?        ?  
119  1  1  A  120  CYS  A  120  .  ?        ?  
120  1  1  A  121  HIS  A  121  .  ?        ?  
121  1  1  A  122  GLU  A  122  .  ?        1  
122  1  1  A  123  GLN  A  123  .  ?        ?  
123  1  1  A  124  HIS  A  124  .  ?        ?  
124  1  1  A  125  LEU  A  125  A  ?        ?  
125  1  1  A  125  LEU  A  125  B  ?        2  
126  1  1  A  126  ARG  A  126  .  ?        1  
127  1  1  A  127  LYS  A  127  .  ?        2  
128  1  1  A  128  SER  A  128  .  ?        ?  
129  1  1  A  129  GLU  A  129  .  ?        1  
130  1  1  A  130  ALA  A  130  .  ?        2  
131  1  1  A  131  GLN  A  131  .  ?        ?  
132  1  1  A  132  ALA  A  132  .  ?        ?  
133  1  1  A  133  LYS  A  133  .  ?        3  
134  1  1  A  134  LYS  A  134  .  ?        3  
135  1  1  A  135  GLU  A  135  .  ?        ?  
136  1  1  A  136  LYS  A  136  .  ?        1  
137  1  1  A  137  LEU  A  137  .  ?        ?  
138  1  1  A  138  ASN  A  138  .  ?        ?  
139  1  1  A  139  ILE  A  139  .  ?        ?  
140  1  1  A  140  TRP  A  140  .  ?        1  
141  1  1  A  141  SER  A  141  .  ?        1  
142  1  2  B    .  HOH  A  201  .  ?        ?  
143  1  2  B    .  HOH  A  202  .  ?        ?  
144  1  2  B    .  HOH  A  203  .  ?        ?  
145  1  2  B    .  HOH  A  204  .  ?        ?  
146  1  2  B    .  HOH  A  205  .  ?        ?  
147  1  2  B    .  HOH  A  206  .  ?        ?  
148  1  2  B    .  HOH  A  207  .  ?        ?  
149  1  2  B    .  HOH  A  208  .  ?        ?  
150  1  2  B    .  HOH  A  209  .  ?        ?  
151  1  2  B    .  HOH  A  210  .  ?        ?  
152  1  2  B    .  HOH  A  211  .  ?        ?  
153  1  2  B    .  HOH  A  212  .  ?        ?  
154  1  2  B    .  HOH  A  213  .  ?        ?  
155  1  2  B    .  HOH  A  214  .  ?        1  
156  1  2  B    .  HOH  A  215  .  ?        ?  
157  1  2  B    .  HOH  A  216  .  ?        1  
158  1  2  B    .  HOH  A  217  .  ?        ?  
159  1  2  B    .  HOH  A  218  .  ?        ?  
160  1  2  B    .  HOH  A  219  .  ?        ?  
161  1  2  B    .  HOH  A  220  .  ?        ?  
162  1  2  B    .  HOH  A  221  .  ?        ?  
163  1  2  B    .  HOH  A  222  .  ?        ?  
164  1  2  B    .  HOH  A  223  .  ?        ?  
165  1  2  B    .  HOH  A  224  .  ?        ?  
166  1  2  B    .  HOH  A  225  .  ?        1  
167  1  2  B    .  HOH  A  226  .  ?        ?  
168  1  2  B    .  HOH  A  227  .  ?        ?  
169  1  2  B    .  HOH  A  228  .  ?        ?  
170  1  2  B    .  HOH  A  229  .  ?        ?  
171  1  2  B    .  HOH  A  230  .  ?        ?  
172  1  2  B    .  HOH  A  231  .  ?        ?  
173  1  2  B    .  HOH  A  232  .  ?        ?  
174  1  2  B    .  HOH  A  233  .  ?        ?  
175  1  2  B    .  HOH  A  234  .  ?        ?  
176  1  2  B    .  HOH  A  235  .  ?        ?  
177  1  2  B    .  HOH  A  236  .  ?        ?  
178  1  2  B    .  HOH  A  237  .  ?        ?  
179  1  2  B    .  HOH  A  238  .  ?        ?  
180  1  2  B    .  HOH  A  239  .  ?        ?  
181  1  2  B    .  HOH  A  240  .  ?        ?  
182  1  2  B    .  HOH  A  241  .  ?        ?  
183  1  2  B    .  HOH  A  242  .  ?        ?  
184  1  2  B    .  HOH  A  243  .  ?        ?  
185  1  2  B    .  HOH  A  244  .  ?        ?  
186  1  2  B    .  HOH  A  245  .  ?        ?  
187  1  2  B    .  HOH  A  246  .  ?        ?  
188  1  2  B    .  HOH  A  247  .  ?        ?  
189  1  2  B    .  HOH  A  248  .  ?        ?  
190  1  2  B    .  HOH  A  249  .  ?        ?  
191  1  2  B    .  HOH  A  250  .  ?        ?  
192  1  2  B    .  HOH  A  251  .  ?        ?  
193  1  2  B    .  HOH  A  252  .  ?        ?  
194  1  2  B    .  HOH  A  253  .  ?        ?  
195  1  2  B    .  HOH  A  254  .  ?        ?  
196  1  2  B    .  HOH  A  255  .  ?        ?  
197  1  2  B    .  HOH  A  256  .  ?        ?  
198  1  2  B    .  HOH  A  257  .  ?        ?  
199  1  2  B    .  HOH  A  258  .  ?        ?  
200  1  2  B    .  HOH  A  259  .  ?        ?  
201  1  2  B    .  HOH  A  260  .  ?        ?  
202  1  2  B    .  HOH  A  261  .  ?        ?  
203  1  2  B    .  HOH  A  262  .  ?        ?  
#
loop_
_pdbx_vrpt_model_instance_geometry.ordinal
_pdbx_vrpt_model_instance_geometry.instance_id
_pdbx_vrpt_model_instance_geometry.rotamer_class
_pdbx_vrpt_model_instance_geometry.phi
_pdbx_vrpt_model_instance_geometry.psi
_pdbx_vrpt_model_instance_geometry.ramachandran_class
_pdbx_vrpt_model_instance_geometry.flippable_sidechain
_pdbx_vrpt_model_instance_geometry.cis_peptide
_pdbx_vrpt_model_instance_geometry.num_H_reduce
_pdbx_vrpt_model_instance_geometry.num_bonds_RMSZ
_pdbx_vrpt_model_instance_geometry.bonds_RMSZ
_pdbx_vrpt_model_instance_geometry.num_angles_RMSZ
_pdbx_vrpt_model_instance_geometry.angles_RMSZ
_pdbx_vrpt_model_instance_geometry.program_for_bond_angle_geometry
  1    1  mt            ?       ?  ?           ?  ?     10   8  0.28  11  0.75  molprobity  
  2    2  OUTLIER  -141.3   148.4  Favored     ?  ?      7  11  0.36  15  1.16  molprobity  
  3    3  mttm      -89.5   136.7  Favored     ?  ?     13   9  0.29  11  0.66  molprobity  
  4    4  mt-10    -120.4   150.9  Favored     ?  ?      6   9  0.56  13  0.94  molprobity  
  5    5  Cg_endo   -73.5   153.1  Favored     ?  ?      7   8  0.25  11  0.64  molprobity  
  6    6  ?        -152.2   170.8  Favored     ?  ?      5   5  0.46   7  1.26  molprobity  
  7    7  m        -124.9   132.7  Favored     ?  ?      7   7  0.46  10  0.82  molprobity  
  8    8  tp        -68.2   135.5  Favored     ?  ?     11   8  0.36  11  0.63  molprobity  
  9    9  mt       -106.2   -59.0  Favored     ?  ?     11   8  0.24  11  0.91  molprobity  
 10   10  OUTLIER  -159.8   140.5  Favored     ?  ?     13   9  0.52  11  1.54  molprobity  
 11   11  ?         -78.3   138.2  Favored     ?  ?      5   5  0.28   7  1.21  molprobity  
 12   12  mt       -108.5   -41.7  Favored     ?  ?     11   8  0.35  11  0.99  molprobity  
 13   13  t0       -153.6   178.9  Favored     ?  ?      4   8  0.36  11  0.98  molprobity  
 14   14  ?         -57.9   -28.3  Favored     ?  ?      3   4  0.49   5  0.90  molprobity  
 15   15  p30      -117.9     1.3  Favored     ?  ?      4   8  0.34  11  1.98  molprobity  
 16   16  m        -133.5   129.1  Favored     ?  ?      7   7  0.66  10  1.43  molprobity  
 17   17  p        -133.6   145.6  Favored     ?  ?      7   7  0.54  10  0.82  molprobity  
 18   18  p        -133.6   145.6  Favored     ?  ?      7   7  0.54  10  0.82  molprobity  
 19   19  ttmt     -101.1   127.6  Favored     ?  ?     13   9  0.51  11  0.92  molprobity  
 20   20  mt       -130.2   153.6  Favored     ?  ?     11   8  0.45  11  0.86  molprobity  
 21   21  tpp       -88.4   115.5  Favored     ?  ?      9   8  0.22  10  1.38  molprobity  
 22   22  t80      -125.0   122.2  Favored     ?  ?      9  13  0.39  18  0.50  molprobity  
 23   23  OUTLIER    58.6    36.9  Favored     ?  ?     13   9  0.30  11  0.78  molprobity  
 24   24  ?          75.8    18.5  Favored     ?  ?      3   4  0.67   5  1.39  molprobity  
 25   25  pt20     -140.9   142.2  Favored     1  ?      8   9  0.46  13  1.09  molprobity  
 26   26  Cg_exo    -66.3   131.4  Favored     ?  ?      7   8  0.30  11  0.91  molprobity  
 27   27  mtp      -146.6   151.9  Favored     ?  ?      9   8  0.49  10  1.77  molprobity  
 28   28  m         -85.5   130.8  Favored     ?  ?      7   7  0.34  10  1.06  molprobity  
 29   29  m-85     -112.5   134.4  Favored     ?  ?      9  12  0.47  16  1.62  molprobity  
 30   30  tpt85    -100.9   128.3  Favored     ?  ?     13  11  0.36  14  1.55  molprobity  
 31   31  mm?       -67.6   119.8  Favored     ?  ?      9   8  0.34  11  0.99  molprobity  
 32   32  mm?       -67.6   119.8  Favored     ?  ?      9   8  0.34  11  0.99  molprobity  
 33   33  mt        -60.0   140.2  Favored     ?  ?     11   8  0.45  11  1.49  molprobity  
 34   34  mt         73.3     7.2  Favored     ?  ?     11   8  0.46  11  1.22  molprobity  
 35   35  m        -125.3   153.9  Favored     ?  ?      9   7  0.38  10  1.08  molprobity  
 36   36  t70      -127.4   113.8  Favored     ?  ?      4   8  0.45  11  0.63  molprobity  
 37   37  p         -97.9   155.0  Favored     ?  ?      7   7  0.29  11  0.72  molprobity  
 38   38  Cg_exo    -64.6   150.8  Favored     ?  ?      7   8  0.33  11  1.27  molprobity  
 39   39  mt-10    -116.3   159.8  Favored     ?  ?      6   9  0.24  12  1.00  molprobity  
 40   40  p        -106.0   -25.9  Favored     ?  ?      7   7  0.33  10  0.96  molprobity  
 41   41  OUTLIER   -74.7  -152.3  OUTLIER     ?  ?     13   9  0.32  11  0.69  molprobity  
 42   42  OUTLIER    51.1   131.8  OUTLIER     ?  ?      7  11  0.25  16  0.56  molprobity  
 43   43  Cg_endo   -85.2     7.4  Favored     ?  ?      7   8  0.18  11  0.62  molprobity  
 44   44  OUTLIER   -49.7   -90.9  OUTLIER     ?  ?     13   9  0.27  11  0.70  molprobity  
 45   45  OUTLIER   -98.9   -11.2  Favored     ?  ?     13   9  0.24  11  0.55  molprobity  
 46   46  ?          86.0   -96.3  Favored     ?  ?      3   4  0.40   5  0.75  molprobity  
 47   47  t        -114.7   123.6  Favored     ?  ?      9   7  0.17  10  0.77  molprobity  
 48   48  mt-10     -96.5   153.6  Favored     ?  ?      6   9  0.29  12  0.99  molprobity  
 49   49  tptt      -57.4   131.5  Favored     ?  ?     13   9  0.35  11  0.80  molprobity  
 50   50  m-85       79.4     2.5  Favored     ?  ?      9  13  0.31  18  0.90  molprobity  
 51   51  ?         -64.8   -51.1  Favored     ?  ?      3   4  0.63   6  1.00  molprobity  
 52   52  Cg_exo    -59.4   -34.3  Favored     ?  ?      7   8  0.23  11  0.53  molprobity  
 53   53  mp0       -71.2   -45.3  Favored     ?  ?      6   9  0.18  12  0.94  molprobity  
 54   54  ?         -62.6   -39.2  Favored     ?  ?      5   5  0.46   7  1.01  molprobity  
 55   55  t         -66.8   -41.4  Favored     ?  ?      5   6  0.56   8  0.88  molprobity  
 56   56  ?         -65.7   -30.9  Favored     ?  ?      5   5  0.47   7  1.14  molprobity  
 57   57  t80       -62.0   -55.1  Favored     ?  ?      9  12  0.56  16  0.97  molprobity  
 58   58  m         -58.1   -45.4  Favored     ?  ?      7   7  0.43  10  1.01  molprobity  
 59   59  tttm      -56.5   -48.5  Favored     ?  ?     13   9  0.30  11  0.58  molprobity  
 60   60  mmpt?     -68.6   -37.3  Favored     ?  ?     13   9  0.27  11  0.31  molprobity  
 61   61  ttt       -65.5   -41.5  Favored     ?  ?      9   8  0.30  10  1.22  molprobity  
 62   62  m         -83.1   -29.3  Favored     ?  ?      9   7  0.53  10  1.30  molprobity  
 63   63  mt-10     -73.7   -24.4  Favored     ?  ?      6   9  0.25  12  0.56  molprobity  
 64   64  m120      -98.5     3.5  Favored     ?  ?      6   8  0.34  11  0.60  molprobity  
 65   65  ?         -81.8   149.2  Favored     ?  ?      5   5  0.15   7  1.60  molprobity  
 66   66  OUTLIER   -87.9   -26.5  Favored     ?  ?     13   9  0.36  11  1.01  molprobity  
 67   67  mtmt     -131.1   129.9  Favored     ?  ?     13   9  0.28  11  1.19  molprobity  
 68   68  mt       -109.6   134.9  Favored     ?  ?      5   8  0.56  11  1.11  molprobity  
 69   69  mt       -109.6   134.9  Favored     ?  ?      5   8  0.56  11  1.11  molprobity  
 70   70  mt-10    -130.4   146.8  Favored     ?  ?      6   9  0.52  12  0.67  molprobity  
 71   71  m        -116.4   143.6  Favored     ?  ?      9   7  0.45  10  0.96  molprobity  
 72   72  tt0      -128.6   109.6  Favored     ?  ?      6   9  0.47  12  1.23  molprobity  
 73   73  m-85      -74.6   153.2  Favored     ?  ?      9  12  0.49  16  0.65  molprobity  
 74   74  t0        -90.7  -163.8  Allowed     ?  ?      4   8  0.37  11  1.36  molprobity  
 75   75  OUTLIER  -102.6     8.1  Favored     ?  ?     13   9  0.48  11  1.07  molprobity  
 76   76  ?        -101.2  -147.3  Favored     ?  ?      3   4  0.20   5  1.81  molprobity  
 77   77  pt20      -69.0   152.7  Favored     1  ?      8   9  0.54  12  0.71  molprobity  
 78   78  mtt180   -104.4    -6.2  Favored     ?  ?      5  11  0.63  14  1.48  molprobity  
 79   79  mtt180   -104.4    -6.2  Favored     ?  ?      5  11  0.63  14  1.48  molprobity  
 80   80  p        -134.3   155.1  Favored     ?  ?      7   7  0.42  10  1.23  molprobity  
 81   81  p30      -100.2  -172.5  Favored     ?  ?      4   8  0.36  11  0.87  molprobity  
 82   82  pttt      -68.2   -15.2  Favored     ?  ?     13   9  0.37  11  0.76  molprobity  
 83   83  m-85      -96.5     4.8  Favored     ?  ?      9  13  0.41  18  1.34  molprobity  
 84   84  ?          88.6     1.8  Favored     ?  ?      3   4  0.52   5  0.77  molprobity  
 85   85  mtm180    -81.4   138.7  Favored     ?  ?     13  11  0.33  14  0.95  molprobity  
 86   86  ?         -62.9   141.0  Favored     ?  ?      3   4  0.41   5  0.77  molprobity  
 87   87  mt       -111.1   110.7  Favored     ?  ?     11   8  0.32  11  1.27  molprobity  
 88   88  ?        -157.8   171.4  Favored     ?  ?      5   5  0.49   7  1.51  molprobity  
 89   89  m-85      -92.6   128.7  Favored     ?  ?      9  13  0.64  18  1.62  molprobity  
 90   90  mm       -110.2   131.1  Favored     ?  ?      5   8  0.56  11  1.61  molprobity  
 91   91  mm       -110.2   131.1  Favored     ?  ?      5   8  0.56  11  1.61  molprobity  
 92   92  m-85     -112.0   131.3  Favored     ?  ?      9  13  0.43  18  1.23  molprobity  
 93   93  ?        -114.0   115.4  Favored     ?  ?      5   5  0.45   7  1.18  molprobity  
 94   94  m-20       48.3    43.4  Favored     ?  ?      4   8  0.37  11  1.00  molprobity  
 95   95  ?          84.6    -6.3  Favored     ?  ?      3   4  0.47   5  1.11  molprobity  
 96   96  mtmm     -101.4   133.2  Favored     ?  ?     13   9  0.30  11  1.07  molprobity  
 97   97  ttm       -77.9   120.3  Favored     ?  ?      9   8  0.30  10  0.51  molprobity  
 98   98  t         -60.0   -39.2  Favored     ?  ?      9   7  0.34  10  0.97  molprobity  
 99   99  OUTLIER   -58.4   -41.7  Favored     ?  ?      6   8  0.33  11  0.83  molprobity  
100  100  tm-20     -72.5   -40.8  Favored     ?  ?      6   9  0.44  12  0.39  molprobity  
101  101  ?         -54.8   -46.0  Favored     ?  ?      5   5  0.60   7  1.46  molprobity  
102  102  mt        -61.2   -42.8  Favored     ?  ?     11   8  0.36  11  0.66  molprobity  
103  103  t         -69.2   -38.4  Favored     ?  ?      9   7  0.23  10  0.73  molprobity  
104  104  tpt85     -62.9   -31.8  Favored     ?  ?     13  11  0.56  14  1.34  molprobity  
105  105  mm-40     -85.6     0.5  Favored     ?  ?      8   9  0.34  12  1.26  molprobity  
106  106  ?          72.1    24.7  Favored     ?  ?      3   4  0.09   5  1.12  molprobity  
107  107  mt       -110.7     7.5  Favored     ?  ?     11   8  0.61  11  0.75  molprobity  
108  108  ?        -156.9   149.3  Favored     ?  ?      5   5  0.41   7  0.42  molprobity  
109  109  OUTLIER  -103.9   155.5  Favored     ?  ?     13   9  0.31  11  0.61  molprobity  
110  110  t         -73.6   127.3  Favored     ?  ?      9   7  0.38  10  1.07  molprobity  
111  111  ?        -153.2   153.9  Favored     ?  ?      5   5  0.33   7  0.72  molprobity  
112  112  m-85       55.1    69.6  Allowed     ?  ?      9  13  0.36  18  0.81  molprobity  
113  113  t        -101.4   110.2  Favored     ?  ?      9   7  0.35  10  1.29  molprobity  
114  114  m-85     -119.1   107.2  Favored     ?  ?      9  13  0.26  18  0.74  molprobity  
115  115  mtmt      -60.9   149.4  Favored     ?  Y     13   9  0.37  12  0.88  molprobity  
116  116  Cg_endo   -91.9    14.2  Favored     ?  ?      7   8  0.44  11  1.10  molprobity  
117  117  m-20      -85.9    64.8  Favored     ?  ?      6   8  0.39  11  0.29  molprobity  
118  118  p-10     -137.4    24.8  Favored     ?  ?      6   8  0.30  11  0.33  molprobity  
119  119  m         -64.6   -33.1  Favored     ?  ?      5   6  0.29   8  0.80  molprobity  
120  120  m-70     -103.7    18.9  Favored     ?  ?      7  11  0.38  15  0.83  molprobity  
121  121  tt0       -61.2   -48.1  Favored     ?  ?      6   9  0.38  12  1.11  molprobity  
122  122  tt0       -52.8   -50.0  Favored     ?  ?      8   9  0.29  12  0.69  molprobity  
123  123  t-160     -58.7   -45.1  Favored     ?  ?      7  11  0.17  15  0.93  molprobity  
124  124  mp        -70.6   -35.6  Favored     ?  ?      7   8  0.34  11  1.02  molprobity  
125  125  mp        -70.6   -35.6  Favored     ?  ?      7   8  0.34  11  1.02  molprobity  
126  126  mtt-85    -62.0   -30.8  Favored     ?  ?     13  11  0.30  14  1.07  molprobity  
127  127  OUTLIER   -66.9   -45.2  Favored     ?  ?     13   9  0.27  11  0.68  molprobity  
128  128  m         -63.2   -39.2  Favored     ?  ?      5   6  0.47   8  0.77  molprobity  
129  129  tt0       -66.9   -40.1  Favored     ?  ?      6   9  0.63  12  0.82  molprobity  
130  130  ?         -60.4   -46.0  Favored     ?  ?      5   5  0.25   7  0.68  molprobity  
131  131  tp60      -60.0   -48.9  Favored     ?  ?      8   9  0.43  12  0.78  molprobity  
132  132  ?         -58.0   -33.9  Favored     ?  ?      5   5  0.32   7  0.74  molprobity  
133  133  mtmp?     -70.3   -43.9  Favored     ?  ?     13   9  0.36  11  1.19  molprobity  
134  134  OUTLIER   -56.8   -41.0  Favored     ?  ?     13   9  0.33  11  0.54  molprobity  
135  135  mt-10     -84.5    -2.1  Favored     ?  ?      6   9  0.35  12  1.04  molprobity  
136  136  OUTLIER    57.4    36.8  Favored     ?  ?     13   9  0.38  11  1.09  molprobity  
137  137  mt        -78.2   136.1  Favored     ?  ?     11   8  0.51  11  1.55  molprobity  
138  138  m-20       47.2  -101.0  Allowed     ?  ?      6   8  0.48  11  0.98  molprobity  
139  139  mt        -56.4   -35.6  Favored     ?  ?     11   8  0.30  11  0.51  molprobity  
140  140  m95       -87.9    -2.9  Favored     ?  ?     10  16  0.35  23  0.57  molprobity  
141  141  p             ?       ?  ?           ?  ?      5   5  0.31   5  0.73  molprobity  
#
loop_
_pdbx_vrpt_instance_clashes.ordinal
_pdbx_vrpt_instance_clashes.instance_id
_pdbx_vrpt_instance_clashes.label_atom_id
_pdbx_vrpt_instance_clashes.cid
_pdbx_vrpt_instance_clashes.clashmag
_pdbx_vrpt_instance_clashes.dist
 1    4  OE2    1  0.44  2.50  
 2    9  HD11   2  0.58  2.33  
 3    9  HD11   3  0.44  1.98  
 4   15  O      4  0.44  2.17  
 5   21  HE1    5  0.67  1.75  
 6   21  CE     2  0.58  2.33  
 7   21  HE3    3  0.44  1.98  
 8   23  NZ     1  0.44  2.50  
 9   23  HA     6  0.42  1.72  
10   23  HD2    6  0.42  1.72  
11   26  HG3    5  0.67  1.75  
12   31  HD23   4  0.44  2.17  
13   34  HD22   7  0.70  1.74  
14   36  HB2    8  0.42  2.01  
15   41  O      9  0.47  2.32  
16   41  O     10  0.45  2.35  
17   42  O     11  0.62  1.99  
18   42  O      9  0.47  2.32  
19   45  NZ    12  0.41  2.49  
20   46  HA2   11  0.62  1.99  
21   46  O     10  0.45  2.35  
22   48  OE1   12  0.41  2.49  
23   59  HZ2   13  0.46  2.29  
24   59  HZ2   14  0.42  1.84  
25   60  CE    13  0.46  2.29  
26   60  HE2   14  0.42  1.84  
27   60  NZ    15  0.41  2.50  
28   63  OE1   15  0.41  2.50  
29   67  HE2   16  0.47  1.60  
30   67  HB2   16  0.47  1.60  
31   67  NZ    17  0.44  2.50  
32   71  HG12  18  0.57  1.86  
33   71  HG12  19  0.53  2.39  
34   90  HD12  18  0.57  1.86  
35   90  CD1   19  0.53  2.39  
36   96  HD2   20  0.52  2.08  
37  100  HA    21  0.61  1.83  
38  100  HA    22  0.49  2.41  
39  109  HG2   23  0.44  2.18  
40  111  HB3    8  0.42  2.01  
41  112  HB3   24  0.59  2.36  
42  113  HG22   7  0.70  1.74  
43  114  CE1   24  0.59  2.36  
44  121  OE1   25  0.41  2.50  
45  125  HD21  21  0.61  1.83  
46  125  CD2   22  0.49  2.41  
47  126  NH2   25  0.41  2.50  
48  127  N     26  0.57  2.19  
49  127  HD2   26  0.57  2.19  
50  129  OE1   23  0.44  2.18  
51  130  HA    27  0.72  2.04  
52  130  HA    28  0.63  1.61  
53  133  NZ    27  0.72  2.04  
54  133  HZ2   28  0.63  1.61  
55  133  HG2   29  0.61  2.36  
56  134  HE2   30  0.71  1.90  
57  134  HB2   31  0.41  1.14  
58  134  HE3   31  0.41  1.14  
59  136  O     32  0.43  2.18  
60  140  CD2   29  0.61  2.36  
61  141  HA    32  0.43  2.18  
62  155  O     17  0.44  2.50  
63  157  O     20  0.52  2.08  
64  166  O     30  0.71  1.90  
#
loop_
_pdbx_vrpt_software.ordinal
_pdbx_vrpt_software.name
_pdbx_vrpt_software.version
_pdbx_vrpt_software.success_y_or_n
1  molprobity   4.02b-467                                                             Y  
2  percentiles  "20191225.v01 (using entries in the PDB archive December 25th 2019)"  Y  
##
