data_1C25

_pdbx_vrpt_database.id    PDB
_pdbx_vrpt_database.code  1C25
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   x-ray
#
_pdbx_vrpt_summary.entry_id                    1C25
_pdbx_vrpt_summary.PDB_deposition_date         1998-04-17
_pdbx_vrpt_summary.PDB_revision_number         4
_pdbx_vrpt_summary.PDB_revision_date           2024-02-07
_pdbx_vrpt_summary.report_creation_date        2024-01-27:17:19
_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  CDC25A  
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  2.3  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  52.89  141614     ?     ?  
2  2  1  62.96    5643  2.30  2.30  
3  1  2   2.95  138981     ?     ?  
4  2  2   1.42    5575  2.30  2.30  
5  1  3  21.29  138945     ?     ?  
6  2  3  29.69    5575  2.30  2.30  
#
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   2.95  
2  4  2  A  1  1  A   1.42  
3  5  3  A  1  1  A  21.29  
4  6  3  A  1  1  A  29.69  
#
_pdbx_vrpt_summary_entity_geometry.ordinal          1
_pdbx_vrpt_summary_entity_geometry.PDB_model_num    1
_pdbx_vrpt_summary_entity_geometry.entity_id        1
_pdbx_vrpt_summary_entity_geometry.label_asym_id    A
_pdbx_vrpt_summary_entity_geometry.auth_asym_id     A
_pdbx_vrpt_summary_entity_geometry.angles_RMSZ      0.73
_pdbx_vrpt_summary_entity_geometry.bonds_RMSZ       0.60
_pdbx_vrpt_summary_entity_geometry.num_bonds_RMSZ   1374
_pdbx_vrpt_summary_entity_geometry.num_angles_RMSZ  1847
#
_pdbx_vrpt_summary_geometry.ordinal                        1
_pdbx_vrpt_summary_geometry.percent_ramachandran_outliers  3.77
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers       5.52
_pdbx_vrpt_summary_geometry.clashscore                     5.41
_pdbx_vrpt_summary_geometry.num_H_reduce                   1306
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ                 1374
_pdbx_vrpt_summary_geometry.bonds_RMSZ                     0.60
_pdbx_vrpt_summary_geometry.num_angles_RMSZ                1847
_pdbx_vrpt_summary_geometry.angles_RMSZ                    0.73
#
_pdbx_vrpt_summary_diffraction.exp_method           x-ray
_pdbx_vrpt_summary_diffraction.ordinal              1
_pdbx_vrpt_summary_diffraction.PDB_resolution_high  2.30
_pdbx_vrpt_summary_diffraction.PDB_resolution_low   99.00
_pdbx_vrpt_summary_diffraction.PDB_R                0.23
_pdbx_vrpt_summary_diffraction.PDB_Rfree            0.30
#
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    1  MET  A  335  .  ?        ?  
  2  1  1  A    2  LEU  A  336  .  ?        ?  
  3  1  1  A    3  ILE  A  337  .  ?        ?  
  4  1  1  A    4  GLY  A  338  .  ?        ?  
  5  1  1  A    5  ASP  A  339  .  ?        ?  
  6  1  1  A    6  PHE  A  340  .  ?        ?  
  7  1  1  A    7  SER  A  341  .  ?        ?  
  8  1  1  A    8  LYS  A  342  .  ?        ?  
  9  1  1  A    9  GLY  A  343  .  ?        ?  
 10  1  1  A   10  TYR  A  344  .  ?        ?  
 11  1  1  A   11  LEU  A  345  .  ?        ?  
 12  1  1  A   12  PHE  A  346  .  ?        ?  
 13  1  1  A   13  HIS  A  347  .  ?        ?  
 14  1  1  A   14  THR  A  348  .  ?        ?  
 15  1  1  A   15  VAL  A  349  .  ?        1  
 16  1  1  A   16  ALA  A  350  .  ?        1  
 17  1  1  A   17  GLY  A  351  .  ?        ?  
 18  1  1  A   18  LYS  A  352  .  ?        ?  
 19  1  1  A   19  HIS  A  353  .  ?        1  
 20  1  1  A   20  GLN  A  354  .  ?        ?  
 21  1  1  A   21  ASP  A  355  .  ?        ?  
 22  1  1  A   22  LEU  A  356  .  ?        ?  
 23  1  1  A   23  LYS  A  357  .  ?        ?  
 24  1  1  A   24  TYR  A  358  .  ?        ?  
 25  1  1  A   25  ILE  A  359  .  ?        ?  
 26  1  1  A   26  SER  A  360  .  ?        ?  
 27  1  1  A   27  PRO  A  361  .  ?        ?  
 28  1  1  A   28  GLU  A  362  .  ?        ?  
 29  1  1  A   29  ILE  A  363  .  ?        ?  
 30  1  1  A   30  MET  A  364  .  ?        ?  
 31  1  1  A   31  ALA  A  365  .  ?        ?  
 32  1  1  A   32  SER  A  366  .  ?        ?  
 33  1  1  A   33  VAL  A  367  .  ?        ?  
 34  1  1  A   34  LEU  A  368  .  ?        ?  
 35  1  1  A   35  ASN  A  369  .  ?        ?  
 36  1  1  A   36  GLY  A  370  .  ?        ?  
 37  1  1  A   37  LYS  A  371  .  ?        ?  
 38  1  1  A   38  PHE  A  372  .  ?        ?  
 39  1  1  A   39  ALA  A  373  .  ?        ?  
 40  1  1  A   40  ASN  A  374  .  ?        2  
 41  1  1  A   41  LEU  A  375  .  ?        ?  
 42  1  1  A   42  ILE  A  376  .  ?        ?  
 43  1  1  A   43  LYS  A  377  .  ?        ?  
 44  1  1  A   44  GLU  A  378  .  ?        ?  
 45  1  1  A   45  PHE  A  379  .  ?        ?  
 46  1  1  A   46  VAL  A  380  .  ?        ?  
 47  1  1  A   47  ILE  A  381  .  ?        ?  
 48  1  1  A   48  ILE  A  382  .  ?        2  
 49  1  1  A   49  ASP  A  383  .  ?        ?  
 50  1  1  A   50  CYS  A  384  .  ?        ?  
 51  1  1  A   51  ARG  A  385  .  ?        ?  
 52  1  1  A   52  TYR  A  386  .  ?        1  
 53  1  1  A   53  PRO  A  387  .  ?        ?  
 54  1  1  A   54  TYR  A  388  .  ?        ?  
 55  1  1  A   55  GLU  A  389  .  ?        2  
 56  1  1  A   56  TYR  A  390  .  ?        ?  
 57  1  1  A   57  GLU  A  391  .  ?        ?  
 58  1  1  A   58  GLY  A  392  .  ?        ?  
 59  1  1  A   59  GLY  A  393  .  ?        ?  
 60  1  1  A   60  HIS  A  394  .  ?        ?  
 61  1  1  A   61  ILE  A  395  .  ?        ?  
 62  1  1  A   62  LYS  A  396  .  ?        ?  
 63  1  1  A   63  GLY  A  397  .  ?        ?  
 64  1  1  A   64  ALA  A  398  .  ?        ?  
 65  1  1  A   65  VAL  A  399  .  ?        ?  
 66  1  1  A   66  ASN  A  400  .  ?        ?  
 67  1  1  A   67  LEU  A  401  .  ?        2  
 68  1  1  A   68  HIS  A  402  .  ?        ?  
 69  1  1  A   69  MET  A  403  .  ?        ?  
 70  1  1  A   70  GLU  A  404  .  ?        ?  
 71  1  1  A   71  GLU  A  405  .  ?        ?  
 72  1  1  A   72  GLU  A  406  .  ?        ?  
 73  1  1  A   73  VAL  A  407  .  ?        ?  
 74  1  1  A   74  GLU  A  408  .  ?        ?  
 75  1  1  A   75  ASP  A  409  .  ?        1  
 76  1  1  A   76  PHE  A  410  .  ?        ?  
 77  1  1  A   77  LEU  A  411  .  ?        ?  
 78  1  1  A   78  LEU  A  412  .  ?        ?  
 79  1  1  A   79  LYS  A  413  .  ?        1  
 80  1  1  A   80  LYS  A  414  .  ?        ?  
 81  1  1  A   81  PRO  A  415  .  ?        ?  
 82  1  1  A   82  ILE  A  416  .  ?        ?  
 83  1  1  A   83  VAL  A  417  .  ?        1  
 84  1  1  A   84  PRO  A  418  .  ?        1  
 85  1  1  A   85  THR  A  419  .  ?        ?  
 86  1  1  A   86  ASP  A  420  .  ?        ?  
 87  1  1  A   87  GLY  A  421  .  ?        ?  
 88  1  1  A   88  LYS  A  422  .  ?        ?  
 89  1  1  A   89  ARG  A  423  .  ?        ?  
 90  1  1  A   90  VAL  A  424  .  ?        ?  
 91  1  1  A   91  ILE  A  425  .  ?        ?  
 92  1  1  A   92  VAL  A  426  .  ?        ?  
 93  1  1  A   93  VAL  A  427  .  ?        ?  
 94  1  1  A   94  PHE  A  428  .  ?        ?  
 95  1  1  A   95  HIS  A  429  .  ?        ?  
 96  1  1  A   96  CYS  A  430  .  ?        1  
 97  1  1  A   97  GLU  A  431  .  ?        1  
 98  1  1  A   98  PHE  A  432  .  ?        ?  
 99  1  1  A   99  SER  A  433  .  ?        ?  
100  1  1  A  100  SER  A  434  .  ?        ?  
101  1  1  A  101  GLU  A  435  .  ?        1  
102  1  1  A  102  ARG  A  436  .  ?        ?  
103  1  1  A  103  GLY  A  437  .  ?        ?  
104  1  1  A  104  PRO  A  438  .  ?        ?  
105  1  1  A  105  ARG  A  439  .  ?        1  
106  1  1  A  106  MET  A  440  .  ?        ?  
107  1  1  A  107  CYS  A  441  .  ?        ?  
108  1  1  A  108  ARG  A  442  .  ?        1  
109  1  1  A  109  TYR  A  443  .  ?        ?  
110  1  1  A  110  VAL  A  444  .  ?        ?  
111  1  1  A  111  ARG  A  445  .  ?        ?  
112  1  1  A  112  GLU  A  446  .  ?        1  
113  1  1  A  113  ARG  A  447  .  ?        1  
114  1  1  A  114  ASP  A  448  .  ?        ?  
115  1  1  A  115  ARG  A  449  .  ?        ?  
116  1  1  A  116  LEU  A  450  .  ?        2  
117  1  1  A  117  GLY  A  451  .  ?        ?  
118  1  1  A  118  ASN  A  452  .  ?        ?  
119  1  1  A  119  GLU  A  453  .  ?        ?  
120  1  1  A  120  TYR  A  454  .  ?        ?  
121  1  1  A  121  PRO  A  455  .  ?        ?  
122  1  1  A  122  LYS  A  456  .  ?        ?  
123  1  1  A  123  LEU  A  457  .  ?        ?  
124  1  1  A  124  HIS  A  458  .  ?        ?  
125  1  1  A  125  TYR  A  459  .  ?        ?  
126  1  1  A  126  PRO  A  460  .  ?        ?  
127  1  1  A  127  GLU  A  461  .  ?        ?  
128  1  1  A  128  LEU  A  462  .  ?        ?  
129  1  1  A  129  TYR  A  463  .  ?        ?  
130  1  1  A  130  VAL  A  464  .  ?        ?  
131  1  1  A  131  LEU  A  465  .  ?        ?  
132  1  1  A  132  LYS  A  466  .  ?        ?  
133  1  1  A  133  GLY  A  467  .  ?        ?  
134  1  1  A  134  GLY  A  468  .  ?        ?  
135  1  1  A  135  TYR  A  469  .  ?        ?  
136  1  1  A  136  LYS  A  470  .  ?        ?  
137  1  1  A  137  GLU  A  471  .  ?        ?  
138  1  1  A  138  PHE  A  472  .  ?        ?  
139  1  1  A  139  PHE  A  473  .  ?        ?  
140  1  1  A  140  MET  A  474  .  ?        ?  
141  1  1  A  141  LYS  A  475  .  ?        ?  
142  1  1  A  142  CYS  A  476  .  ?        1  
143  1  1  A  143  GLN  A  477  .  ?        ?  
144  1  1  A  144  SER  A  478  .  ?        ?  
145  1  1  A  145  TYR  A  479  .  ?        1  
146  1  1  A  146  CYS  A  480  .  ?        ?  
147  1  1  A  147  GLU  A  481  .  ?        ?  
148  1  1  A  148  PRO  A  482  .  ?        ?  
149  1  1  A  149  PRO  A  483  .  ?        ?  
150  1  1  A  150  SER  A  484  .  ?        ?  
151  1  1  A  151  TYR  A  485  .  ?        ?  
152  1  1  A  152  ARG  A  486  .  ?        ?  
153  1  1  A  153  PRO  A  487  .  ?        ?  
154  1  1  A  154  MET  A  488  .  ?        1  
155  1  1  A  155  HIS  A  489  .  ?        ?  
156  1  1  A  156  HIS  A  490  .  ?        ?  
157  1  1  A  157  GLU  A  491  .  ?        ?  
158  1  1  A  158  ASP  A  492  .  ?        ?  
159  1  1  A  159  PHE  A  493  .  ?        ?  
160  1  1  A  160  LYS  A  494  .  ?        ?  
161  1  1  A  161  GLU  A  495  .  ?        ?  
162  1  2  B    .  HOH  A    4  .  ?        ?  
163  1  2  B    .  HOH  A    5  .  ?        ?  
164  1  2  B    .  HOH  A    6  .  ?        ?  
165  1  2  B    .  HOH  A    7  .  ?        ?  
166  1  2  B    .  HOH  A    8  .  ?        ?  
167  1  2  B    .  HOH  A    9  .  ?        ?  
168  1  2  B    .  HOH  A   10  .  ?        ?  
169  1  2  B    .  HOH  A   11  .  ?        ?  
170  1  2  B    .  HOH  A   12  .  ?        ?  
171  1  2  B    .  HOH  A   13  .  ?        ?  
172  1  2  B    .  HOH  A   14  .  ?        ?  
173  1  2  B    .  HOH  A   15  .  ?        ?  
174  1  2  B    .  HOH  A   17  .  ?        ?  
175  1  2  B    .  HOH  A   18  .  ?        ?  
176  1  2  B    .  HOH  A   19  .  ?        ?  
177  1  2  B    .  HOH  A   20  .  ?        ?  
178  1  2  B    .  HOH  A   21  .  ?        ?  
179  1  2  B    .  HOH  A   22  .  ?        ?  
180  1  2  B    .  HOH  A   23  .  ?        ?  
181  1  2  B    .  HOH  A   24  .  ?        ?  
182  1  2  B    .  HOH  A   26  .  ?        ?  
183  1  2  B    .  HOH  A   28  .  ?        ?  
184  1  2  B    .  HOH  A   29  .  ?        ?  
185  1  2  B    .  HOH  A   30  .  ?        ?  
186  1  2  B    .  HOH  A   32  .  ?        ?  
187  1  2  B    .  HOH  A   33  .  ?        ?  
188  1  2  B    .  HOH  A   34  .  ?        ?  
189  1  2  B    .  HOH  A   35  .  ?        ?  
190  1  2  B    .  HOH  A   36  .  ?        ?  
191  1  2  B    .  HOH  A   37  .  ?        ?  
192  1  2  B    .  HOH  A   38  .  ?        ?  
193  1  2  B    .  HOH  A   39  .  ?        ?  
194  1  2  B    .  HOH  A   40  .  ?        ?  
195  1  2  B    .  HOH  A   43  .  ?        ?  
196  1  2  B    .  HOH  A   45  .  ?        ?  
197  1  2  B    .  HOH  A   47  .  ?        ?  
198  1  2  B    .  HOH  A   49  .  ?        ?  
199  1  2  B    .  HOH  A   50  .  ?        ?  
200  1  2  B    .  HOH  A   51  .  ?        ?  
201  1  2  B    .  HOH  A   52  .  ?        ?  
202  1  2  B    .  HOH  A   53  .  ?        ?  
203  1  2  B    .  HOH  A   55  .  ?        ?  
204  1  2  B    .  HOH  A   56  .  ?        ?  
205  1  2  B    .  HOH  A   57  .  ?        ?  
206  1  2  B    .  HOH  A   60  .  ?        ?  
207  1  2  B    .  HOH  A   65  .  ?        ?  
208  1  2  B    .  HOH  A   66  .  ?        ?  
209  1  2  B    .  HOH  A   67  .  ?        ?  
210  1  2  B    .  HOH  A   71  .  ?        ?  
211  1  2  B    .  HOH  A   73  .  ?        ?  
212  1  2  B    .  HOH  A   78  .  ?        ?  
213  1  2  B    .  HOH  A   80  .  ?        ?  
214  1  2  B    .  HOH  A   81  .  ?        ?  
215  1  2  B    .  HOH  A   82  .  ?        ?  
216  1  2  B    .  HOH  A   84  .  ?        ?  
217  1  2  B    .  HOH  A   85  .  ?        ?  
218  1  2  B    .  HOH  A   87  .  ?        ?  
219  1  2  B    .  HOH  A   96  .  ?        ?  
220  1  2  B    .  HOH  A  102  .  ?        ?  
221  1  2  B    .  HOH  A  103  .  ?        ?  
222  1  2  B    .  HOH  A  104  .  ?        ?  
223  1  2  B    .  HOH  A  105  .  ?        ?  
224  1  2  B    .  HOH  A  106  .  ?        ?  
225  1  2  B    .  HOH  A  107  .  ?        ?  
226  1  2  B    .  HOH  A  113  .  ?        ?  
227  1  2  B    .  HOH  A  114  .  ?        ?  
228  1  2  B    .  HOH  A  115  .  ?        ?  
229  1  2  B    .  HOH  A  116  .  ?        ?  
230  1  2  B    .  HOH  A  117  .  ?        ?  
231  1  2  B    .  HOH  A  901  .  ?        ?  
232  1  2  B    .  HOH  A  902  .  ?        ?  
233  1  2  B    .  HOH  A  905  .  ?        ?  
234  1  2  B    .  HOH  A  906  .  ?        ?  
235  1  2  B    .  HOH  A  907  .  ?        ?  
236  1  2  B    .  HOH  A  908  .  ?        ?  
237  1  2  B    .  HOH  A  909  .  ?        ?  
238  1  2  B    .  HOH  A  910  .  ?        ?  
239  1  2  B    .  HOH  A  911  .  ?        ?  
240  1  2  B    .  HOH  A  913  .  ?        ?  
241  1  2  B    .  HOH  A  915  .  ?        ?  
242  1  2  B    .  HOH  A  916  .  ?        ?  
243  1  2  B    .  HOH  A  917  .  ?        ?  
#
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  ptt?          ?       ?  ?           ?  ?      8   8  1.15  10  0.49  molprobity  
  2    2  mt        -93.9   168.7  Favored     ?  ?     11   8  0.24  11  0.61  molprobity  
  3    3  pt        -77.9   172.5  Allowed     ?  ?     11   8  0.55  11  0.59  molprobity  
  4    4  ?         -42.4   -33.4  Allowed     ?  ?      3   4  0.37   5  1.58  molprobity  
  5    5  p-10     -102.5    11.8  Favored     ?  ?      4   8  0.32  11  0.72  molprobity  
  6    6  m-85       52.8    21.7  Favored     ?  ?      9  12  0.64  16  0.59  molprobity  
  7    7  p         -87.6   -15.7  Favored     ?  ?      5   6  0.43   8  0.67  molprobity  
  8    8  ptpt     -170.9   177.0  Favored     ?  ?     13   9  0.36  11  0.61  molprobity  
  9    9  ?         -94.5   172.2  Favored     ?  ?      3   4  0.52   5  0.53  molprobity  
 10   10  m-85      -65.9   138.9  Favored     ?  ?      9  13  0.41  18  0.36  molprobity  
 11   11  tp        -71.4   -42.9  Favored     ?  ?     11   8  0.47  11  0.50  molprobity  
 12   12  m-85      -91.0   161.7  Favored     ?  ?      9  12  0.78  16  0.81  molprobity  
 13   13  m80       -82.3   145.9  Favored     ?  ?      7  11  0.25  15  0.67  molprobity  
 14   14  p        -120.2   148.6  Favored     ?  ?      7   7  0.43  10  0.94  molprobity  
 15   15  t        -107.4   157.0  Favored     ?  ?      9   7  0.82  10  1.01  molprobity  
 16   16  ?         -69.5   150.7  Favored     ?  ?      5   5  0.43   7  0.69  molprobity  
 17   17  ?        -145.3   177.1  Favored     ?  ?      3   4  0.49   5  1.26  molprobity  
 18   18  tttt      -59.5   -40.6  Favored     ?  ?     13   9  0.34  11  0.62  molprobity  
 19   19  m80      -100.1    99.6  Favored     ?  ?      7  11  0.40  15  0.43  molprobity  
 20   20  mm-40     -60.6   -11.7  Favored     ?  ?      8   9  0.76  12  0.81  molprobity  
 21   21  p-10      -89.1    -2.9  Favored     ?  ?      4   8  0.44  11  0.46  molprobity  
 22   22  mt       -117.2   156.8  Favored     ?  ?     11   8  0.26  11  0.91  molprobity  
 23   23  mmtm      -97.5   126.3  Favored     ?  ?     13   9  0.53  11  0.30  molprobity  
 24   24  m-85     -110.6   146.1  Favored     ?  ?      9  13  0.45  18  0.46  molprobity  
 25   25  pt       -128.6   152.5  Favored     ?  ?     11   8  0.57  11  1.10  molprobity  
 26   26  p         -87.4   167.7  Favored     ?  ?      5   6  0.62   9  0.78  molprobity  
 27   27  Cg_endo   -65.1   -29.9  Favored     ?  ?      7   8  0.52  11  0.39  molprobity  
 28   28  mp0       -65.0   -46.4  Favored     ?  ?      6   9  0.86  12  0.62  molprobity  
 29   29  mm        -62.1   -46.6  Favored     ?  ?     11   8  0.25  11  0.71  molprobity  
 30   30  tpt       -54.7   -45.0  Favored     ?  ?      9   8  1.35  10  0.98  molprobity  
 31   31  ?         -65.5   -35.4  Favored     ?  ?      5   5  0.40   7  0.41  molprobity  
 32   32  p         -65.8   -36.8  Favored     ?  ?      5   6  0.66   8  0.72  molprobity  
 33   33  t         -64.7   -42.9  Favored     ?  ?      9   7  0.65  10  0.98  molprobity  
 34   34  mt        -66.1   -28.9  Favored     ?  ?     11   8  0.42  11  0.49  molprobity  
 35   35  m-20      -75.2    -7.3  Favored     ?  ?      6   8  0.41  11  0.43  molprobity  
 36   36  ?          96.3    12.4  Favored     ?  ?      3   4  0.42   5  0.63  molprobity  
 37   37  tttt      -49.9   -36.8  Favored     ?  ?     13   9  0.41  11  0.78  molprobity  
 38   38  m-85     -119.7    22.2  Favored     ?  ?      9  12  0.79  16  0.35  molprobity  
 39   39  ?         -47.8   -31.2  Favored     ?  ?      5   5  0.40   7  0.61  molprobity  
 40   40  OUTLIER   -81.8   -25.4  Favored     1  ?      6   8  0.41  11  0.45  molprobity  
 41   41  mt        -93.2   -18.8  Favored     ?  ?     11   8  0.50  11  0.77  molprobity  
 42   42  mt       -102.4   126.9  Favored     ?  ?     11   8  0.27  11  1.00  molprobity  
 43   43  tptt      -82.9   -40.3  Favored     ?  ?     13   9  0.48  11  0.50  molprobity  
 44   44  tp10     -154.4   132.3  Favored     ?  ?      6   9  0.82  12  0.81  molprobity  
 45   45  t80      -117.7   117.7  Favored     ?  ?      9  12  0.52  16  0.68  molprobity  
 46   46  t        -115.1   127.4  Favored     ?  ?      9   7  0.66  10  0.64  molprobity  
 47   47  mt       -113.7   119.7  Favored     ?  ?     11   8  0.44  11  1.14  molprobity  
 48   48  mm       -105.4   105.9  Favored     ?  ?     11   8  0.45  11  0.63  molprobity  
 49   49  t0        -89.8   115.3  Favored     ?  ?      4   8  0.45  11  0.82  molprobity  
 50   50  m         -90.9     4.7  Favored     ?  ?      5   6  0.28   8  1.06  molprobity  
 51   51  mtm180    -73.0   170.2  Favored     ?  ?     13  11  0.67  14  0.72  molprobity  
 52   52  m-85      -64.9   143.4  Favored     ?  ?      9  13  0.84  19  0.70  molprobity  
 53   53  Cg_exo    -49.1   -37.0  Favored     ?  ?      7   8  0.60  11  0.68  molprobity  
 54   54  t80       -66.3   -35.5  Favored     ?  ?      9  13  0.41  18  0.52  molprobity  
 55   55  mt-10     -69.3   -58.3  Favored     ?  ?      6   9  0.76  12  1.01  molprobity  
 56   56  t80       -45.8   -47.8  Favored     ?  ?      9  13  0.83  18  0.47  molprobity  
 57   57  tt0       -60.1   -33.5  Favored     ?  ?      6   9  0.46  12  0.43  molprobity  
 58   58  ?         -77.4    -3.8  Favored     ?  ?      3   4  0.29   5  0.69  molprobity  
 59   59  ?         152.2   115.5  Allowed     ?  ?      3   4  0.75   5  0.62  molprobity  
 60   60  p-80     -138.8   162.2  Favored     ?  ?      7  11  0.29  15  0.41  molprobity  
 61   61  mt        -58.7   132.6  Favored     ?  ?     11   8  0.27  11  0.62  molprobity  
 62   62  mttt      -55.1   128.5  Favored     ?  ?     13   9  0.46  11  0.55  molprobity  
 63   63  ?          90.6   -15.7  Favored     ?  ?      3   4  0.60   5  0.38  molprobity  
 64   64  ?         -64.0   145.5  Favored     ?  ?      5   5  0.44   7  0.86  molprobity  
 65   65  t        -108.9   133.8  Favored     ?  ?      9   7  0.60  10  0.94  molprobity  
 66   66  t-20      -89.9   108.9  Favored     ?  ?      6   8  0.51  11  0.50  molprobity  
 67   67  mt       -130.2    88.9  Favored     ?  ?     11   8  0.38  11  1.11  molprobity  
 68   68  t60       -79.3   -35.7  Favored     ?  ?      7  11  0.32  15  0.73  molprobity  
 69   69  mmt      -103.3   149.0  Favored     ?  ?      9   8  0.67  10  0.75  molprobity  
 70   70  mt-10     -56.8   -37.8  Favored     ?  ?      6   9  0.34  12  0.36  molprobity  
 71   71  pt-20     -62.7   -33.3  Favored     ?  ?      6   9  0.41  12  0.33  molprobity  
 72   72  mt-10     -73.3   -38.1  Favored     ?  ?      6   9  0.75  12  0.59  molprobity  
 73   73  t         -64.6   -41.0  Favored     ?  ?      9   7  0.64  10  0.74  molprobity  
 74   74  tp10      -58.6   -57.3  Favored     ?  ?      6   9  0.52  12  0.62  molprobity  
 75   75  m-20      -58.3   -41.3  Favored     ?  ?      4   8  0.25  11  0.67  molprobity  
 76   76  t80       -74.7   -68.1  Allowed     ?  ?      9  12  0.51  16  0.66  molprobity  
 77   77  mt        -75.6   -55.8  Favored     ?  ?     11   8  0.48  11  0.69  molprobity  
 78   78  mt        -70.5   -21.9  Favored     ?  ?     11   8  0.39  11  1.25  molprobity  
 79   79  mptm?     -82.8   -34.2  Favored     ?  ?     13   9  0.34  11  0.48  molprobity  
 80   80  pttp     -116.4    91.3  Favored     ?  ?     13   9  0.59  12  0.65  molprobity  
 81   81  Cg_endo  -110.3  -159.8  OUTLIER     ?  ?      7   8  0.80  11  0.73  molprobity  
 82   82  mt         66.5   -92.1  OUTLIER     ?  ?     11   8  0.73  11  0.94  molprobity  
 83   83  OUTLIER    57.7   172.8  OUTLIER     ?  ?      9   7  1.23  11  0.88  molprobity  
 84   84  Cg_endo   -67.4    91.4  Allowed     ?  ?      7   8  0.34  11  0.67  molprobity  
 85   85  p         -58.7   -34.5  Favored     ?  ?      7   7  0.64  10  0.96  molprobity  
 86   86  OUTLIER    35.2    12.4  OUTLIER     ?  ?      4   8  0.42  11  1.43  molprobity  
 87   87  ?          91.8    -6.9  Favored     ?  ?      3   4  0.13   5  0.27  molprobity  
 88   88  mttt      -93.7   164.7  Favored     ?  ?     13   9  0.48  11  0.72  molprobity  
 89   89  mtt-85    -86.5   140.6  Favored     ?  ?     13  11  0.39  14  1.16  molprobity  
 90   90  t        -107.8   120.2  Favored     ?  ?      9   7  0.51  10  1.24  molprobity  
 91   91  mt       -125.0   140.7  Favored     ?  ?     11   8  0.54  11  0.50  molprobity  
 92   92  t        -128.2   131.5  Favored     ?  ?      9   7  0.72  10  0.70  molprobity  
 93   93  t        -117.6   135.2  Favored     ?  ?      9   7  0.46  10  0.71  molprobity  
 94   94  m-85     -117.2   141.0  Favored     ?  ?      9  12  1.06  16  0.66  molprobity  
 95   95  p80      -157.4   158.1  Favored     ?  ?      7  11  0.43  15  0.51  molprobity  
 96   96  p        -134.4  -128.6  Allowed     ?  ?      5   6  1.05   8  0.85  molprobity  
 97   97  mp0       -69.2   -61.4  Allowed     ?  ?      6   9  1.59  12  1.13  molprobity  
 98   98  m-85     -131.4    27.4  Favored     ?  ?      9  12  0.66  16  0.79  molprobity  
 99   99  m          42.7    50.7  Favored     ?  ?      5   6  0.45   8  1.24  molprobity  
100  100  m        -134.8   117.1  Favored     ?  ?      5   6  0.73   8  1.57  molprobity  
101  101  OUTLIER    82.9   -71.0  OUTLIER     ?  ?      6   9  0.88  12  1.39  molprobity  
102  102  OUTLIER   -62.5   -43.3  Favored     ?  ?     13  11  0.50  14  0.69  molprobity  
103  103  ?         -57.8   -56.3  Favored     ?  ?      3   4  0.44   6  0.63  molprobity  
104  104  Cg_exo    -60.7   -35.1  Favored     ?  ?      7   8  0.40  11  0.67  molprobity  
105  105  ttp180    -65.4   -50.6  Favored     ?  ?     13  11  0.53  14  0.79  molprobity  
106  106  tpp       -61.8   -37.2  Favored     ?  ?      9   8  0.49  10  0.62  molprobity  
107  107  t         -60.9   -47.7  Favored     ?  ?      5   6  0.64   8  0.49  molprobity  
108  108  mtt85     -69.4   -29.9  Favored     ?  ?     13  11  0.56  14  0.45  molprobity  
109  109  t80       -65.8   -50.7  Favored     ?  ?      9  13  0.66  18  0.36  molprobity  
110  110  t         -56.5   -40.0  Favored     ?  ?      9   7  0.39  10  0.61  molprobity  
111  111  tpp85     -65.2   -47.4  Favored     ?  ?     13  11  0.64  14  0.50  molprobity  
112  112  mm-40     -61.5   -45.1  Favored     ?  ?      6   9  0.71  12  0.37  molprobity  
113  113  mmm180    -65.4   -34.8  Favored     ?  ?     13  11  0.61  14  0.55  molprobity  
114  114  t0        -69.1   -44.3  Favored     ?  ?      4   8  0.45  11  0.76  molprobity  
115  115  mmt180    -57.1   -50.6  Favored     ?  ?     13  11  0.29  14  1.07  molprobity  
116  116  mt        -52.5   -49.9  Favored     ?  ?     11   8  0.51  11  1.54  molprobity  
117  117  ?         -83.7    24.0  Favored     ?  ?      3   4  0.20   5  0.52  molprobity  
118  118  m-80     -146.5   159.4  Favored     ?  ?      6   8  0.34  11  0.73  molprobity  
119  119  tt0       -89.1   123.8  Favored     ?  ?      6   9  0.66  12  0.64  molprobity  
120  120  t80       -47.5   132.1  Favored     ?  Y      9  13  0.49  19  0.50  molprobity  
121  121  OUTLIER  -105.9    25.2  Favored     ?  ?      7   8  0.49  11  0.78  molprobity  
122  122  mttt      -60.7   145.2  Favored     ?  ?     13   9  0.48  11  0.58  molprobity  
123  123  mt       -149.5   147.2  Favored     ?  ?     11   8  0.65  11  0.72  molprobity  
124  124  m80       -84.0   -21.3  Favored     ?  ?      7  11  0.46  15  0.67  molprobity  
125  125  m-85     -131.0    73.4  Favored     ?  ?      9  13  0.68  19  0.53  molprobity  
126  126  Cg_endo   -71.9    -5.8  Favored     ?  ?      7   8  0.39  11  0.69  molprobity  
127  127  tt0      -137.0   114.1  Favored     ?  ?      6   9  0.55  12  0.78  molprobity  
128  128  mt       -129.8   144.8  Favored     ?  ?     11   8  0.25  11  0.76  molprobity  
129  129  m-85     -137.2   158.4  Favored     ?  ?      9  13  0.50  18  0.73  molprobity  
130  130  t        -117.3   133.4  Favored     ?  ?      9   7  0.53  10  1.15  molprobity  
131  131  tp        -78.5   108.4  Favored     ?  ?     11   8  0.39  11  0.92  molprobity  
132  132  tttt      -61.3   127.4  Favored     ?  ?     13   9  0.94  11  0.55  molprobity  
133  133  ?          93.0    -8.2  Favored     ?  ?      3   4  0.21   5  0.32  molprobity  
134  134  ?          61.6  -154.8  Favored     ?  ?      3   4  0.48   5  0.60  molprobity  
135  135  t80       -76.7   -26.3  Favored     ?  ?      9  13  0.99  18  0.63  molprobity  
136  136  tttt      -58.9   -55.6  Favored     ?  ?     13   9  0.49  11  0.49  molprobity  
137  137  mm-40     -62.5   -50.5  Favored     ?  ?      6   9  0.49  12  0.41  molprobity  
138  138  t80       -54.8   -43.9  Favored     ?  ?      9  12  0.92  16  0.35  molprobity  
139  139  t80       -60.8   -51.3  Favored     ?  ?      9  12  0.76  16  0.27  molprobity  
140  140  mtt       -57.2   -37.5  Favored     ?  ?      9   8  0.82  10  0.40  molprobity  
141  141  mttt      -90.7   -32.5  Favored     ?  ?     13   9  0.41  11  0.84  molprobity  
142  142  m        -132.5    53.1  Favored     ?  ?      5   6  0.96   8  0.60  molprobity  
143  143  tt0       -54.2   -35.0  Favored     ?  ?      8   9  0.55  12  0.52  molprobity  
144  144  p         -68.2   -12.9  Favored     ?  ?      5   6  0.44   8  0.59  molprobity  
145  145  m-85      -96.7     2.9  Favored     ?  ?      9  13  0.76  18  0.60  molprobity  
146  146  m         -97.7   150.0  Favored     ?  ?      5   6  0.58   8  0.49  molprobity  
147  147  tt0      -134.9   109.6  Favored     ?  Y      6   9  0.68  13  0.38  molprobity  
148  148  Cg_endo   -76.0   164.9  Favored     ?  ?      7   8  0.46  12  0.90  molprobity  
149  149  Cg_endo   -70.3    57.7  Allowed     ?  ?      7   8  0.31  11  0.54  molprobity  
150  150  t        -141.8   167.6  Favored     ?  ?      5   6  0.58   8  0.47  molprobity  
151  151  t80      -133.1   120.8  Favored     ?  ?      9  13  0.74  18  1.01  molprobity  
152  152  ttp180   -122.9    85.7  Favored     ?  ?     13  11  0.39  15  0.73  molprobity  
153  153  Cg_endo   -74.2   161.3  Favored     ?  ?      7   8  0.75  11  0.56  molprobity  
154  154  mmm       -79.2   158.3  Favored     ?  ?      9   8  0.59  10  0.87  molprobity  
155  155  m-70      -82.9   157.6  Favored     ?  ?      7  11  0.40  15  0.35  molprobity  
156  156  m-70     -132.7   157.3  Favored     ?  ?      7  11  0.43  15  0.57  molprobity  
157  157  mm-40     -76.8   123.3  Favored     ?  ?      6   9  0.53  12  0.78  molprobity  
158  158  p-10      -81.3   -10.9  Favored     ?  ?      4   8  0.14  11  0.45  molprobity  
159  159  OUTLIER   -75.0   115.7  Favored     ?  ?      9  12  0.84  16  0.81  molprobity  
160  160  OUTLIER  -170.5    33.2  OUTLIER     ?  ?     13   9  0.37  11  1.46  molprobity  
161  161  pt-20         ?       ?  ?           ?  ?      6   8  0.60   9  0.57  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   15  HG12   1  0.50  2.26  
 2   16  N      1  0.50  2.26  
 3   19  CD2    2  0.45  2.34  
 4   40  HD22   3  0.64  1.45  
 5   40  H      3  0.64  1.45  
 6   48  HD12   4  0.53  1.90  
 7   48  HD12   5  0.41  2.50  
 8   52  HB2    6  0.43  2.01  
 9   55  HG3    6  0.43  2.01  
10   55  HG2    7  0.41  2.61  
11   67  HD12   4  0.53  1.90  
12   67  CD1    5  0.41  2.50  
13   75  O      8  0.61  2.00  
14   79  HB2    8  0.61  2.00  
15   83  HG22   9  0.86  1.57  
16   84  HD2    9  0.86  1.57  
17   96  HB2   10  0.52  2.09  
18   97  OE1   10  0.52  2.09  
19  101  O     11  0.56  2.04  
20  105  HB2   11  0.56  2.04  
21  108  HH22   2  0.45  2.34  
22  112  O     12  0.50  2.12  
23  113  HH11  13  0.41  1.84  
24  116  HG    12  0.50  2.12  
25  116  HD12  13  0.41  1.84  
26  142  HB3   14  0.67  2.29  
27  145  CD1   14  0.67  2.29  
28  154  SD     7  0.41  2.61  
#
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  
##
