data_5MT6

_pdbx_vrpt_database.id    PDB
_pdbx_vrpt_database.code  5MT6
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   x-ray
#
_pdbx_vrpt_summary.entry_id                    5MT6
_pdbx_vrpt_summary.PDB_deposition_date         2017-01-06
_pdbx_vrpt_summary.PDB_revision_number         6
_pdbx_vrpt_summary.PDB_revision_date           2024-01-17
_pdbx_vrpt_summary.report_creation_date        2024-01-08:13:42
_pdbx_vrpt_summary.attempted_validation_steps  molprobity,validation-pack,xtriage,eds,mogul,buster-report,percentiles,writexml,writecif,writepdf
_pdbx_vrpt_summary.ligands_for_buster_report   Y
#
loop_
_pdbx_vrpt_entity.id
_pdbx_vrpt_entity.type
_pdbx_vrpt_entity.description
1  polymer      "Rhomboid protease GlpG"  
2  polymer      ACE-ARG-VAL-ARG-HIS-ALA-V9C  
3  non-polymer  "nonyl beta-D-glucopyranoside"  
4  water        water  
#
loop_
_pdbx_vrpt_asym.label_asym_id
_pdbx_vrpt_asym.entity_id
A  1  
B  2  
C  3  
D  3  
E  4  
F  4  
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all   x-ray  
2  2.16  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      
4  RSRZ_outliers_percent         
5  R_value_R_free                
#
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   96.17  141614     ?     ?  
 2  2  1   95.90    1585  2.16  2.16  
 3  1  2  100.00  138981     ?     ?  
 4  2  2  100.00    1560  2.16  2.16  
 5  1  3   83.60  138945     ?     ?  
 6  2  3   88.52    1559  2.16  2.16  
 7  1  4   61.66  127900     ?     ?  
 8  2  4   69.30    1456  2.16  2.16  
 9  1  5   19.18  130704     ?     ?  
10  2  5   14.89    1479  2.16  2.16  
#
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  100.00  
 2  4  2  A  1  1  A  100.00  
 3  5  3  A  1  1  A   83.60  
 4  6  3  A  1  1  A   88.52  
 5  7  4  A  1  1  A   61.66  
 6  8  4  A  1  1  A   69.30  
 7  3  2  B  1  2  B  100.00  
 8  4  2  B  1  2  B  100.00  
 9  5  3  B  1  2  B  100.00  
10  6  3  B  1  2  B  100.00  
11  7  4  B  1  2  B  100.00  
12  8  4  B  1  2  B  100.00  
#
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  0.69  0.60  1480  2013  
2  1  2  B  B  1.25  0.68    45    59  
#
_pdbx_vrpt_summary_geometry.ordinal                        1
_pdbx_vrpt_summary_geometry.percent_ramachandran_outliers  0.00
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers       0.68
_pdbx_vrpt_summary_geometry.clashscore                     1.00
_pdbx_vrpt_summary_geometry.num_H_reduce                   1497
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ                 1525
_pdbx_vrpt_summary_geometry.bonds_RMSZ                     0.61
_pdbx_vrpt_summary_geometry.num_angles_RMSZ                2072
_pdbx_vrpt_summary_geometry.angles_RMSZ                    0.71
#
_pdbx_vrpt_summary_diffraction.exp_method                x-ray
_pdbx_vrpt_summary_diffraction.ordinal                   1
_pdbx_vrpt_summary_diffraction.Babinet_b                 38.296
_pdbx_vrpt_summary_diffraction.bulk_solvent_b            46.820
_pdbx_vrpt_summary_diffraction.Wilson_B_estimate         44.488
_pdbx_vrpt_summary_diffraction.I_over_sigma              2.04(2.16A)
_pdbx_vrpt_summary_diffraction.num_miller_indices        16096
_pdbx_vrpt_summary_diffraction.Babinet_k                 0.025
_pdbx_vrpt_summary_diffraction.bulk_solvent_k            0.326
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L_mean     0.456
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L2_mean    0.284
_pdbx_vrpt_summary_diffraction.Fo_Fc_correlation         0.937
_pdbx_vrpt_summary_diffraction.DCC_R                     0.22
_pdbx_vrpt_summary_diffraction.DCC_Rfree                 0.27
_pdbx_vrpt_summary_diffraction.EDS_R                     0.22
_pdbx_vrpt_summary_diffraction.EDS_res_high              2.16
_pdbx_vrpt_summary_diffraction.EDS_res_low               52.27
_pdbx_vrpt_summary_diffraction.Wilson_B_aniso            "[43.347,43.347,46.341,-0.000,0.000,0.000]"
_pdbx_vrpt_summary_diffraction.data_anisotropy           0.068
_pdbx_vrpt_summary_diffraction.trans_NCS_details         "The largest off-origin peak in the Patterson function is 4.24% of the height of the origin peak. No significant pseudotranslation is detected."
_pdbx_vrpt_summary_diffraction.B_factor_type             FULL
_pdbx_vrpt_summary_diffraction.acentric_outliers         0
_pdbx_vrpt_summary_diffraction.centric_outliers          1
_pdbx_vrpt_summary_diffraction.data_completeness         99.33
_pdbx_vrpt_summary_diffraction.number_reflns_R_free      781
_pdbx_vrpt_summary_diffraction.percent_free_reflections  4.85
_pdbx_vrpt_summary_diffraction.percent_RSRZ_outliers     2.16
_pdbx_vrpt_summary_diffraction.PDB_resolution_high       2.16
_pdbx_vrpt_summary_diffraction.PDB_resolution_low        52.31
_pdbx_vrpt_summary_diffraction.PDB_R                     0.22
_pdbx_vrpt_summary_diffraction.PDB_Rfree                 0.27
#
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
_pdbx_vrpt_model_instance.count_mogul_torsion_outliers
  1  1  1  A    1  GLU  A   91  .  ?        ?     ?  
  2  1  1  A    2  ARG  A   92  .  ?        ?     ?  
  3  1  1  A    3  ALA  A   93  .  ?        ?     ?  
  4  1  1  A    4  GLY  A   94  .  ?        ?     ?  
  5  1  1  A    5  PRO  A   95  .  ?        ?     ?  
  6  1  1  A    6  VAL  A   96  .  ?        ?     ?  
  7  1  1  A    7  THR  A   97  .  ?        ?     ?  
  8  1  1  A    8  TRP  A   98  .  ?        ?     ?  
  9  1  1  A    9  VAL  A   99  .  ?        ?     ?  
 10  1  1  A   10  MET  A  100  .  ?        ?     ?  
 11  1  1  A   11  MET  A  101  .  ?        ?     ?  
 12  1  1  A   12  ILE  A  102  .  ?        ?     ?  
 13  1  1  A   13  ALA  A  103  .  ?        ?     ?  
 14  1  1  A   14  CYS  A  104  .  ?        ?     ?  
 15  1  1  A   15  VAL  A  105  .  ?        ?     ?  
 16  1  1  A   16  VAL  A  106  .  ?        ?     ?  
 17  1  1  A   17  VAL  A  107  .  ?        ?     ?  
 18  1  1  A   18  PHE  A  108  .  ?        ?     ?  
 19  1  1  A   19  ILE  A  109  .  ?        ?     ?  
 20  1  1  A   20  ALA  A  110  .  ?        ?     ?  
 21  1  1  A   21  MET  A  111  .  ?        ?     ?  
 22  1  1  A   22  GLN  A  112  .  ?        ?     ?  
 23  1  1  A   23  ILE  A  113  .  ?        ?     ?  
 24  1  1  A   24  LEU  A  114  .  ?        ?     ?  
 25  1  1  A   25  GLY  A  115  .  ?        ?     ?  
 26  1  1  A   26  ASP  A  116  .  ?        ?     ?  
 27  1  1  A   27  GLN  A  117  .  ?        1     ?  
 28  1  1  A   28  GLU  A  118  .  ?        ?     ?  
 29  1  1  A   29  VAL  A  119  .  ?        ?     ?  
 30  1  1  A   30  MET  A  120  .  ?        ?     ?  
 31  1  1  A   31  LEU  A  121  .  ?        ?     ?  
 32  1  1  A   32  TRP  A  122  .  ?        ?     ?  
 33  1  1  A   33  LEU  A  123  .  ?        ?     ?  
 34  1  1  A   34  ALA  A  124  .  ?        ?     ?  
 35  1  1  A   35  TRP  A  125  .  ?        ?     ?  
 36  1  1  A   36  PRO  A  126  .  ?        ?     ?  
 37  1  1  A   37  PHE  A  127  .  ?        ?     ?  
 38  1  1  A   38  ASP  A  128  .  ?        ?     ?  
 39  1  1  A   39  PRO  A  129  .  ?        ?     ?  
 40  1  1  A   40  THR  A  130  .  ?        ?     ?  
 41  1  1  A   41  LEU  A  131  .  ?        ?     ?  
 42  1  1  A   42  LYS  A  132  .  ?        ?     ?  
 43  1  1  A   43  PHE  A  133  .  ?        ?     ?  
 44  1  1  A   44  GLU  A  134  .  ?        ?     ?  
 45  1  1  A   45  PHE  A  135  .  ?        ?     ?  
 46  1  1  A   46  TRP  A  136  .  ?        ?     ?  
 47  1  1  A   47  ARG  A  137  .  ?        ?     ?  
 48  1  1  A   48  TYR  A  138  .  ?        ?     ?  
 49  1  1  A   49  PHE  A  139  .  ?        ?     ?  
 50  1  1  A   50  THR  A  140  .  ?        ?     ?  
 51  1  1  A   51  HIS  A  141  .  ?        ?     ?  
 52  1  1  A   52  ALA  A  142  .  ?        ?     ?  
 53  1  1  A   53  LEU  A  143  .  ?        ?     ?  
 54  1  1  A   54  MET  A  144  .  ?        ?     ?  
 55  1  1  A   55  HIS  A  145  .  ?        ?     ?  
 56  1  1  A   56  PHE  A  146  .  ?        ?     ?  
 57  1  1  A   57  SER  A  147  .  ?        ?     ?  
 58  1  1  A   58  LEU  A  148  .  ?        ?     ?  
 59  1  1  A   59  MET  A  149  .  ?        ?     ?  
 60  1  1  A   60  HIS  A  150  .  ?        ?     ?  
 61  1  1  A   61  ILE  A  151  .  ?        ?     ?  
 62  1  1  A   62  LEU  A  152  .  ?        ?     ?  
 63  1  1  A   63  PHE  A  153  .  ?        ?     ?  
 64  1  1  A   64  ASN  A  154  .  ?        ?     ?  
 65  1  1  A   65  LEU  A  155  .  ?        ?     ?  
 66  1  1  A   66  LEU  A  156  .  ?        ?     ?  
 67  1  1  A   67  TRP  A  157  .  ?        ?     ?  
 68  1  1  A   68  TRP  A  158  .  ?        ?     ?  
 69  1  1  A   69  TRP  A  159  .  ?        ?     ?  
 70  1  1  A   70  TYR  A  160  .  ?        1     ?  
 71  1  1  A   71  LEU  A  161  .  ?        ?     ?  
 72  1  1  A   72  GLY  A  162  .  ?        ?     ?  
 73  1  1  A   73  GLY  A  163  .  ?        ?     ?  
 74  1  1  A   74  ALA  A  164  .  ?        ?     ?  
 75  1  1  A   75  VAL  A  165  .  ?        ?     ?  
 76  1  1  A   76  GLU  A  166  .  ?        ?     ?  
 77  1  1  A   77  LYS  A  167  .  ?        ?     ?  
 78  1  1  A   78  ARG  A  168  .  ?        ?     ?  
 79  1  1  A   79  LEU  A  169  .  ?        ?     ?  
 80  1  1  A   80  GLY  A  170  .  ?        ?     ?  
 81  1  1  A   81  SER  A  171  .  ?        ?     ?  
 82  1  1  A   82  GLY  A  172  .  ?        ?     ?  
 83  1  1  A   83  LYS  A  173  .  ?        ?     ?  
 84  1  1  A   84  LEU  A  174  .  ?        ?     ?  
 85  1  1  A   85  ILE  A  175  .  ?        ?     ?  
 86  1  1  A   86  VAL  A  176  .  ?        ?     ?  
 87  1  1  A   87  ILE  A  177  .  ?        ?     ?  
 88  1  1  A   88  THR  A  178  .  ?        ?     ?  
 89  1  1  A   89  LEU  A  179  .  ?        ?     ?  
 90  1  1  A   90  ILE  A  180  .  ?        ?     ?  
 91  1  1  A   91  SER  A  181  .  ?        ?     ?  
 92  1  1  A   92  ALA  A  182  .  ?        ?     ?  
 93  1  1  A   93  LEU  A  183  .  ?        ?     ?  
 94  1  1  A   94  LEU  A  184  .  ?        ?     ?  
 95  1  1  A   95  SER  A  185  .  ?        ?     ?  
 96  1  1  A   96  GLY  A  186  .  ?        ?     ?  
 97  1  1  A   97  TYR  A  187  .  ?        ?     ?  
 98  1  1  A   98  VAL  A  188  .  ?        1     ?  
 99  1  1  A   99  GLN  A  189  .  ?        ?     ?  
100  1  1  A  100  GLN  A  190  .  ?        ?     ?  
101  1  1  A  101  LYS  A  191  .  ?        ?     ?  
102  1  1  A  102  PHE  A  192  .  ?        ?     ?  
103  1  1  A  103  SER  A  193  .  ?        ?     ?  
104  1  1  A  104  GLY  A  194  .  ?        ?     ?  
105  1  1  A  105  PRO  A  195  .  ?        ?     ?  
106  1  1  A  106  TRP  A  196  .  ?        ?     ?  
107  1  1  A  107  PHE  A  197  .  ?        ?     ?  
108  1  1  A  108  GLY  A  198  .  ?        ?     ?  
109  1  1  A  109  GLY  A  199  .  ?        ?     ?  
110  1  1  A  110  LEU  A  200  .  ?        ?     ?  
111  1  1  A  111  SER  A  201  .  ?        ?     ?  
112  1  1  A  112  GLY  A  202  .  ?        ?     ?  
113  1  1  A  113  VAL  A  203  .  ?        ?     ?  
114  1  1  A  114  VAL  A  204  .  ?        ?     ?  
115  1  1  A  115  TYR  A  205  .  ?        ?     ?  
116  1  1  A  116  ALA  A  206  .  ?        ?     ?  
117  1  1  A  117  LEU  A  207  .  ?        ?     ?  
118  1  1  A  118  MET  A  208  .  ?        ?     ?  
119  1  1  A  119  GLY  A  209  .  ?        ?     ?  
120  1  1  A  120  TYR  A  210  .  ?        ?     ?  
121  1  1  A  121  VAL  A  211  .  ?        ?     ?  
122  1  1  A  122  TRP  A  212  .  ?        ?     ?  
123  1  1  A  123  LEU  A  213  .  ?        ?     ?  
124  1  1  A  124  ARG  A  214  .  ?        ?     ?  
125  1  1  A  125  GLY  A  215  .  ?        ?     ?  
126  1  1  A  126  GLU  A  216  .  ?        ?     ?  
127  1  1  A  127  ARG  A  217  .  ?        ?     ?  
128  1  1  A  128  ASP  A  218  .  ?        ?     ?  
129  1  1  A  129  PRO  A  219  .  ?        ?     ?  
130  1  1  A  130  GLN  A  220  .  ?        ?     ?  
131  1  1  A  131  SER  A  221  .  ?        ?     ?  
132  1  1  A  132  GLY  A  222  .  ?        ?     ?  
133  1  1  A  133  ILE  A  223  .  ?        ?     ?  
134  1  1  A  134  TYR  A  224  .  ?        ?     ?  
135  1  1  A  135  LEU  A  225  .  ?        ?     ?  
136  1  1  A  136  GLN  A  226  .  ?        ?     ?  
137  1  1  A  137  ARG  A  227  .  ?        ?     ?  
138  1  1  A  138  GLY  A  228  .  ?        ?     ?  
139  1  1  A  139  LEU  A  229  .  ?        1     ?  
140  1  1  A  140  ILE  A  230  .  ?        ?     ?  
141  1  1  A  141  ILE  A  231  .  ?        ?     ?  
142  1  1  A  142  PHE  A  232  .  ?        ?     ?  
143  1  1  A  143  ALA  A  233  .  ?        ?     ?  
144  1  1  A  144  LEU  A  234  .  ?        ?     ?  
145  1  1  A  145  ILE  A  235  .  ?        ?     ?  
146  1  1  A  146  TRP  A  236  .  ?        ?     ?  
147  1  1  A  147  ILE  A  237  .  ?        ?     ?  
148  1  1  A  148  VAL  A  238  .  ?        ?     ?  
149  1  1  A  149  ALA  A  239  .  ?        ?     ?  
150  1  1  A  150  GLY  A  240  .  ?        ?     ?  
151  1  1  A  151  TRP  A  241  .  ?        ?     ?  
152  1  1  A  152  PHE  A  242  .  ?        ?     ?  
153  1  1  A  153  ASP  A  243  .  ?        ?     ?  
154  1  1  A  154  LEU  A  244  .  ?        ?     ?  
155  1  1  A  155  PHE  A  245  .  ?        ?     ?  
156  1  1  A  156  GLY  A  246  .  ?        ?     ?  
157  1  1  A  157  MET  A  247  .  ?        ?     ?  
158  1  1  A  158  SER  A  248  .  ?        ?     ?  
159  1  1  A  159  MET  A  249  .  ?        ?     ?  
160  1  1  A  160  ALA  A  250  .  ?        ?     ?  
161  1  1  A  161  ASN  A  251  .  ?        ?     ?  
162  1  1  A  162  GLY  A  252  .  ?        ?     ?  
163  1  1  A  163  ALA  A  253  .  ?        ?     ?  
164  1  1  A  164  HIS  A  254  .  ?        ?     ?  
165  1  1  A  165  ILE  A  255  .  ?        ?     ?  
166  1  1  A  166  ALA  A  256  .  ?        1     ?  
167  1  1  A  167  GLY  A  257  .  ?        ?     ?  
168  1  1  A  168  LEU  A  258  .  ?        ?     ?  
169  1  1  A  169  ALA  A  259  .  ?        ?     ?  
170  1  1  A  170  VAL  A  260  .  ?        ?     ?  
171  1  1  A  171  GLY  A  261  .  ?        ?     ?  
172  1  1  A  172  LEU  A  262  .  ?        ?     ?  
173  1  1  A  173  ALA  A  263  .  ?        ?     ?  
174  1  1  A  174  MET  A  264  .  ?        ?     ?  
175  1  1  A  175  ALA  A  265  .  ?        ?     ?  
176  1  1  A  176  PHE  A  266  .  ?        ?     ?  
177  1  1  A  177  VAL  A  267  .  ?        ?     ?  
178  1  1  A  178  ASP  A  268  .  ?        ?     ?  
179  1  1  A  179  SER  A  269  .  ?        ?     ?  
180  1  1  A  180  LEU  A  270  .  ?        ?     ?  
181  1  2  B    1  ACE  B    1  .  ?        ?     ?  
182  1  2  B    2  ARG  B    2  .  ?        ?     ?  
183  1  2  B    3  VAL  B    3  .  ?        ?     ?  
184  1  2  B    4  ARG  B    4  .  ?        ?     ?  
185  1  2  B    5  HIS  B    5  .  ?        ?     ?  
186  1  2  B    6  ALA  B    6  .  ?        ?     ?  
187  1  2  B    7  V9C  B    7  .  ?        ?     ?  
188  1  3  C    .  BNG  A  301  .  ?        ?     ?  
189  1  3  D    .  BNG  A  302  .  ?        ?     1  
190  1  4  E    .  HOH  A  401  .  ?        1     ?  
191  1  4  E    .  HOH  A  402  .  ?        ?     ?  
192  1  4  E    .  HOH  A  403  .  ?        ?     ?  
193  1  4  E    .  HOH  A  404  .  ?        ?     ?  
194  1  4  E    .  HOH  A  405  .  ?        ?     ?  
195  1  4  E    .  HOH  A  406  .  ?        ?     ?  
196  1  4  E    .  HOH  A  407  .  ?        ?     ?  
197  1  4  E    .  HOH  A  408  .  ?        ?     ?  
198  1  4  E    .  HOH  A  409  .  ?        ?     ?  
199  1  4  E    .  HOH  A  410  .  ?        ?     ?  
200  1  4  E    .  HOH  A  411  .  ?        ?     ?  
201  1  4  E    .  HOH  A  412  .  ?        ?     ?  
202  1  4  E    .  HOH  A  413  .  ?        ?     ?  
203  1  4  E    .  HOH  A  414  .  ?        ?     ?  
204  1  4  E    .  HOH  A  415  .  ?        ?     ?  
205  1  4  E    .  HOH  A  416  .  ?        ?     ?  
206  1  4  E    .  HOH  A  417  .  ?        ?     ?  
207  1  4  E    .  HOH  A  418  .  ?        ?     ?  
208  1  4  E    .  HOH  A  419  .  ?        ?     ?  
209  1  4  E    .  HOH  A  420  .  ?        ?     ?  
210  1  4  E    .  HOH  A  421  .  ?        ?     ?  
211  1  4  E    .  HOH  A  422  .  ?        ?     ?  
212  1  4  E    .  HOH  A  423  .  ?        ?     ?  
213  1  4  E    .  HOH  A  424  .  ?        ?     ?  
214  1  4  E    .  HOH  A  425  .  ?        ?     ?  
215  1  4  E    .  HOH  A  426  .  ?        ?     ?  
216  1  4  E    .  HOH  A  427  .  ?        ?     ?  
217  1  4  F    .  HOH  B  201  .  ?        ?     ?  
#
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.num_H_reduce
_pdbx_vrpt_model_instance_geometry.OWAB
_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
_pdbx_vrpt_model_instance_geometry.average_occupancy
  1    1  ?             ?       ?  ?           1  97.620     5  0.81     7  0.24  molprobity  1.000  
  2    2  ptt180   -157.7   154.6  Favored    13  82.350    11  0.42    14  1.11  molprobity  1.000  
  3    3  ?         -45.2   120.9  Favored     5  54.010     5  0.52     7  0.48  molprobity  1.000  
  4    4  ?         -63.8   179.9  Favored     3  45.190     4  1.13     6  0.71  molprobity  1.000  
  5    5  Cg_endo   -60.6   -39.4  Favored     7  46.500     8  0.32    11  0.78  molprobity  1.000  
  6    6  t         -70.8   -37.1  Favored     9  41.250     7  0.62    10  0.38  molprobity  1.000  
  7    7  m         -63.6   -45.5  Favored     7  39.750     7  0.81    10  0.94  molprobity  1.000  
  8    8  t-105     -63.1   -54.7  Favored    10  60.240    16  0.64    23  0.45  molprobity  1.000  
  9    9  t         -63.4   -36.0  Favored     9  47.440     7  0.43    10  0.82  molprobity  1.000  
 10   10  tpp       -61.6   -43.0  Favored     9  45.020     8  0.77    10  0.85  molprobity  1.000  
 11   11  mtp       -59.9   -46.2  Favored     9  40.550     8  0.69    10  0.72  molprobity  1.000  
 12   12  pt        -65.3   -40.1  Favored    11  53.800     8  0.67    11  0.86  molprobity  1.000  
 13   13  ?         -62.0   -43.9  Favored     5  38.660     5  0.33     7  0.41  molprobity  1.000  
 14   14  m         -61.1   -38.9  Favored     5  37.770     6  0.81     8  0.59  molprobity  1.000  
 15   15  t         -67.7   -47.1  Favored     9  42.290     7  0.33    10  0.41  molprobity  1.000  
 16   16  t         -57.6   -45.7  Favored     9  44.030     7  0.37    10  0.45  molprobity  1.000  
 17   17  t         -63.5   -40.6  Favored     9  34.270     7  0.40    10  0.28  molprobity  1.000  
 18   18  t80       -63.1   -41.0  Favored     9  40.670    12  0.78    16  0.45  molprobity  1.000  
 19   19  mt        -58.2   -52.3  Favored    11  43.490     8  0.45    11  0.51  molprobity  1.000  
 20   20  ?         -58.0   -33.9  Favored     5  40.960     5  0.34     7  0.71  molprobity  1.000  
 21   21  mtp       -63.8   -38.0  Favored     9  42.850     8  0.53    10  0.81  molprobity  1.000  
 22   22  mm-40     -68.8   -41.0  Favored     8  46.040     9  0.65    12  0.90  molprobity  1.000  
 23   23  mt        -74.6   -51.0  Favored    11  53.890     8  0.21    11  0.73  molprobity  1.000  
 24   24  mt        -86.2   -15.7  Favored    11  54.810     8  0.42    11  0.99  molprobity  1.000  
 25   25  ?          88.1   148.0  Favored     3  44.710     4  0.56     5  0.59  molprobity  1.000  
 26   26  m-20      -62.7   -36.9  Favored     4  47.870     8  0.42    11  1.29  molprobity  1.000  
 27   27  mp0       -65.0   -41.0  Favored     8  53.940     9  0.65    12  0.65  molprobity  1.000  
 28   28  mm-40     -66.4   -39.5  Favored     6  54.550     9  0.61    12  1.01  molprobity  1.000  
 29   29  t         -68.3   -44.0  Favored     9  41.600     7  0.79    10  0.96  molprobity  1.000  
 30   30  mtm       -56.1   -36.1  Favored     9  53.250     8  0.65    10  0.60  molprobity  1.000  
 31   31  mt        -58.5   -33.1  Favored    11  46.900     8  0.39    11  0.89  molprobity  1.000  
 32   32  m95       -88.0   -40.2  Favored    10  64.130    16  0.65    23  0.32  molprobity  1.000  
 33   33  mt       -111.2    -8.9  Favored    11  41.280     8  0.57    11  0.83  molprobity  1.000  
 34   34  ?         -74.5   153.9  Favored     5  35.570     5  0.73     7  0.63  molprobity  1.000  
 35   35  t-105     -45.8   141.8  Favored    10  33.780    16  0.64    24  0.54  molprobity  1.000  
 36   36  Cg_exo    -51.8   124.4  Favored     7  38.720     8  0.39    11  0.32  molprobity  1.000  
 37   37  p90      -108.7     3.9  Favored     9  42.240    12  0.67    16  0.59  molprobity  1.000  
 38   38  t70      -148.0   142.0  Favored     4  56.820     8  0.74    12  0.63  molprobity  1.000  
 39   39  Cg_exo    -55.2   -25.0  Favored     7  51.160     8  0.67    11  0.48  molprobity  1.000  
 40   40  p         -67.2   -15.1  Favored     7  44.760     7  0.42    10  0.73  molprobity  1.000  
 41   41  mt       -101.9     5.3  Favored    11  41.830     8  0.43    11  0.44  molprobity  1.000  
 42   42  pttm      -67.5   -25.3  Favored    13  48.270     9  0.32    11  0.55  molprobity  1.000  
 43   43  m-85      -93.6     1.0  Favored     9  48.590    12  0.72    16  0.62  molprobity  1.000  
 44   44  mt-10     -83.9    83.3  Favored     6  46.120     9  0.63    12  1.16  molprobity  1.000  
 45   45  m-85      -62.0   -29.8  Favored     9  48.280    12  0.90    16  0.40  molprobity  1.000  
 46   46  p90       -58.0   -34.5  Favored    10  38.870    16  0.59    23  0.35  molprobity  1.000  
 47   47  mtt-85    -57.6   -25.9  Favored    13  37.660    11  0.55    14  1.63  molprobity  1.000  
 48   48  m-85      -70.0   -13.8  Favored     9  36.590    13  0.83    18  0.57  molprobity  1.000  
 49   49  m-85     -118.4   -37.2  Favored     9  41.060    12  0.65    16  0.63  molprobity  1.000  
 50   50  p         -71.9   -18.5  Favored     7  35.360     7  0.50    10  1.01  molprobity  1.000  
 51   51  p80       -47.8   -30.0  Favored     7  31.780    11  0.37    15  0.33  molprobity  1.000  
 52   52  ?         -65.6   -23.8  Favored     5  33.410     5  0.80     7  0.67  molprobity  1.000  
 53   53  mt        -85.9    -5.2  Favored    11  39.320     8  0.48    11  0.48  molprobity  1.000  
 54   54  mtm       -99.1   124.9  Favored     9  35.360     8  0.67    10  0.63  molprobity  1.000  
 55   55  m80      -126.9   142.7  Favored     7  35.660    11  0.60    15  0.49  molprobity  1.000  
 56   56  m-85     -101.7    -6.8  Favored     9  42.210    12  0.45    16  0.73  molprobity  1.000  
 57   57  p        -157.1   168.3  Favored     5  42.660     6  0.46     8  0.77  molprobity  1.000  
 58   58  tp        -53.0   -48.7  Favored    11  48.280     8  0.26    11  0.43  molprobity  1.000  
 59   59  mmt       -70.9   -39.3  Favored     9  60.090     8  0.53    10  0.69  molprobity  1.000  
 60   60  t-160     -52.1   -53.7  Favored     7  38.480    11  0.36    15  0.27  molprobity  1.000  
 61   61  tt        -67.7   -44.5  Favored    11  38.420     8  0.40    11  0.73  molprobity  1.000  
 62   62  mt        -58.2   -50.9  Favored    11  48.510     8  0.46    11  0.66  molprobity  1.000  
 63   63  m-85      -60.5   -45.2  Favored     9  64.880    12  0.73    16  0.67  molprobity  1.000  
 64   64  m-80      -59.0   -47.0  Favored     6  37.750     8  0.80    11  0.72  molprobity  1.000  
 65   65  mt        -75.9   -32.1  Favored    11  38.850     8  0.36    11  0.59  molprobity  1.000  
 66   66  mt        -58.1   -51.1  Favored    11  45.800     8  0.37    11  0.46  molprobity  1.000  
 67   67  m95       -61.3   -46.1  Favored    10  38.710    16  0.64    23  0.27  molprobity  1.000  
 68   68  t-105     -58.4   -46.7  Favored    10  33.660    16  0.40    23  0.38  molprobity  1.000  
 69   69  t90       -58.6   -44.0  Favored    10  55.860    16  0.73    23  0.55  molprobity  1.000  
 70   70  t80       -71.6   -54.8  Favored     9  60.270    13  0.59    18  0.62  molprobity  1.000  
 71   71  mt        -78.4   -45.8  Favored    11  42.170     8  0.30    11  0.30  molprobity  1.000  
 72   72  ?         -57.6   -46.6  Favored     3  44.760     4  0.51     5  0.44  molprobity  1.000  
 73   73  ?         -50.7   -48.9  Favored     3  45.310     4  1.30     5  0.43  molprobity  1.000  
 74   74  ?         -61.8   -48.1  Favored     5  47.490     5  0.49     7  0.38  molprobity  1.000  
 75   75  t         -56.7   -51.4  Favored     9  42.060     7  0.43    10  0.68  molprobity  1.000  
 76   76  tt0       -61.5   -44.8  Favored     6  46.660     9  0.61    12  0.47  molprobity  1.000  
 77   77  tttp      -61.6   -50.2  Favored    13  69.840     9  0.45    11  0.36  molprobity  1.000  
 78   78  mmt180    -82.1   -37.6  Favored    13  66.910    11  0.38    14  1.07  molprobity  1.000  
 79   79  mt       -117.0    -0.6  Favored    11  42.070     8  0.38    11  0.86  molprobity  1.000  
 80   80  ?          89.0   156.7  Favored     3  43.360     4  0.63     5  1.26  molprobity  1.000  
 81   81  m         -45.6   -50.4  Favored     5  47.130     6  0.81     8  1.30  molprobity  1.000  
 82   82  ?         -53.8   -44.8  Favored     3  43.010     4  0.56     5  0.58  molprobity  1.000  
 83   83  tppt?     -62.5   -40.7  Favored    13  45.200     9  0.52    11  0.62  molprobity  1.000  
 84   84  tp        -65.8   -40.4  Favored    11  37.560     8  0.73    11  0.83  molprobity  1.000  
 85   85  mt        -58.7   -45.1  Favored    11  39.280     8  0.45    11  0.64  molprobity  1.000  
 86   86  t         -72.9   -43.8  Favored     9  44.920     7  0.42    10  0.65  molprobity  1.000  
 87   87  mt        -56.7   -41.8  Favored    11  41.980     8  0.40    11  0.37  molprobity  1.000  
 88   88  m         -67.1   -44.6  Favored     7  35.520     7  1.30    10  1.05  molprobity  1.000  
 89   89  mt        -61.9   -46.0  Favored    11  40.420     8  0.53    11  0.73  molprobity  1.000  
 90   90  mt        -69.2   -47.0  Favored    11  37.830     8  0.44    11  0.54  molprobity  1.000  
 91   91  p         -64.6   -38.0  Favored     5  37.210     6  0.70     8  0.78  molprobity  1.000  
 92   92  ?         -65.9   -45.8  Favored     5  36.210     5  0.88     7  0.76  molprobity  1.000  
 93   93  tp        -63.4   -52.2  Favored    11  36.710     8  0.54    11  0.50  molprobity  1.000  
 94   94  mp        -68.3   -43.4  Favored    11  46.260     8  0.25    11  0.63  molprobity  1.000  
 95   95  p         -59.4   -42.8  Favored     5  39.080     6  0.35     8  1.19  molprobity  1.000  
 96   96  ?         -60.9   -43.1  Favored     3  34.650     4  0.97     5  0.68  molprobity  1.000  
 97   97  t80       -63.7   -44.7  Favored     9  46.620    13  0.62    18  0.76  molprobity  1.000  
 98   98  t         -66.0   -42.2  Favored     9  37.010     7  0.44    10  0.50  molprobity  1.000  
 99   99  tp60      -60.0   -50.2  Favored     8  38.150     9  0.61    12  0.57  molprobity  1.000  
100  100  pp0?      -63.1   -35.2  Favored     8  47.800     9  0.39    12  0.84  molprobity  1.000  
101  101  tptt      -60.2   -45.8  Favored    13  58.720     9  0.63    11  1.14  molprobity  1.000  
102  102  m-85      -62.2   -53.2  Favored     9  72.900    12  0.96    16  0.65  molprobity  1.000  
103  103  m        -140.1    15.8  Favored     5  44.880     6  0.79     8  1.39  molprobity  1.000  
104  104  ?          78.1  -178.4  Favored     3  40.530     4  0.91     6  0.79  molprobity  1.000  
105  105  Cg_endo   -88.5     2.2  Favored     7  38.000     8  0.47    11  0.65  molprobity  1.000  
106  106  m95       -96.3    95.8  Favored    10  42.860    16  0.67    23  0.79  molprobity  1.000  
107  107  p90      -167.7   161.7  Favored     9  32.850    12  0.79    16  0.72  molprobity  1.000  
108  108  ?        -170.2   163.8  Favored     3  35.150     4  0.96     5  0.82  molprobity  1.000  
109  109  ?         132.6   170.2  Favored     3  28.450     4  0.58     5  0.41  molprobity  1.000  
110  110  tp        -97.0     8.8  Favored    11  32.810     8  1.02    11  1.21  molprobity  1.000  
111  111  p         -79.7   -21.1  Favored     4  32.940     6  1.17     8  0.57  molprobity  1.000  
112  112  ?         -58.8   -46.8  Favored     3  33.310     4  0.81     5  0.59  molprobity  1.000  
113  113  t         -70.5   -38.2  Favored     9  32.770     7  0.71    10  0.60  molprobity  1.000  
114  114  t         -64.8   -51.9  Favored     9  35.880     7  0.47    10  0.51  molprobity  1.000  
115  115  m-85      -54.9   -41.8  Favored     9  38.410    13  1.00    18  0.71  molprobity  1.000  
116  116  ?         -55.9   -49.6  Favored     5  37.660     5  0.49     7  0.86  molprobity  1.000  
117  117  mt        -59.9   -40.5  Favored    11  37.130     8  0.32    11  0.47  molprobity  1.000  
118  118  mtt       -59.5   -52.6  Favored     9  42.420     8  0.32    10  0.66  molprobity  1.000  
119  119  ?         -57.5   -42.9  Favored     3  42.070     4  0.72     5  0.50  molprobity  1.000  
120  120  t80       -70.1   -53.2  Favored     9  40.310    13  0.92    18  0.57  molprobity  1.000  
121  121  t         -60.7   -45.8  Favored     9  44.610     7  0.60    10  0.55  molprobity  1.000  
122  122  t90       -56.1   -60.7  Favored    10  48.760    16  0.68    23  0.53  molprobity  1.000  
123  123  tp        -67.3   -28.4  Favored    11  48.200     8  0.43    11  0.49  molprobity  1.000  
124  124  tpt180    -70.7   -43.6  Favored    13  50.380    11  0.49    14  1.35  molprobity  1.000  
125  125  ?         -59.2   -46.9  Favored     3  59.210     4  0.48     5  0.48  molprobity  1.000  
126  126  mm-40     -59.9   -49.2  Favored     6  69.020     9  0.33    12  0.60  molprobity  1.000  
127  127  mtp85     -85.7   -17.9  Favored    13  66.170    11  0.49    14  1.65  molprobity  1.000  
128  128  t0       -150.8    63.0  Favored     4  67.870     8  0.55    12  1.02  molprobity  1.000  
129  129  Cg_exo    -50.1   -32.9  Favored     7  77.110     8  0.58    11  0.46  molprobity  1.000  
130  130  ?         -62.9   -18.2  Favored     2  75.830     5  0.46     7  0.49  molprobity  1.000  
131  131  p         -53.4   -34.7  Favored     5  64.140     6  0.75     8  0.61  molprobity  1.000  
132  132  ?          92.4     5.8  Favored     3  56.160     4  0.66     5  0.35  molprobity  1.000  
133  133  tt       -126.9   148.5  Favored    11  56.460     8  0.39    11  0.70  molprobity  1.000  
134  134  p90      -168.9   159.6  Favored     9  70.810    13  0.54    18  0.48  molprobity  1.000  
135  135  tp        -94.9   113.6  Favored    11  48.200     8  0.30    11  0.68  molprobity  1.000  
136  136  tt0       -60.3   145.6  Favored     8  70.210     9  0.52    12  0.53  molprobity  1.000  
137  137  mtt180    -48.5   -48.4  Favored    13  65.800    11  0.51    14  1.04  molprobity  1.000  
138  138  ?         -59.7   -41.2  Favored     3  46.210     4  0.46     5  0.22  molprobity  1.000  
139  139  mt        -75.3   -27.3  Favored    11  51.740     8  0.54    11  0.86  molprobity  1.000  
140  140  mt        -53.9   -44.3  Favored    11  45.690     8  0.31    11  0.77  molprobity  1.000  
141  141  mm        -64.3   -50.0  Favored    11  46.150     8  0.54    11  0.67  molprobity  1.000  
142  142  m-85      -68.4   -36.9  Favored     9  50.970    12  0.50    16  0.81  molprobity  1.000  
143  143  ?         -60.2   -46.3  Favored     5  41.910     5  0.26     7  0.42  molprobity  1.000  
144  144  tp        -61.0   -39.4  Favored    11  53.410     8  0.40    11  0.68  molprobity  1.000  
145  145  mt        -61.9   -44.7  Favored    11  42.170     8  0.61    11  0.51  molprobity  1.000  
146  146  OUTLIER   -53.3   -45.0  Favored    10  48.840    16  0.87    23  0.48  molprobity  1.000  
147  147  mt        -66.2   -45.2  Favored    11  46.760     8  0.22    11  0.52  molprobity  1.000  
148  148  t         -59.0   -42.2  Favored     9  41.560     7  0.65    10  0.32  molprobity  1.000  
149  149  ?         -65.2   -29.4  Favored     5  44.610     5  0.46     7  0.50  molprobity  1.000  
150  150  ?         -69.9   -54.3  Favored     3  44.870     4  0.38     5  0.42  molprobity  1.000  
151  151  t-105     -52.7   -37.0  Favored    10  72.050    16  0.53    23  0.47  molprobity  1.000  
152  152  m-85     -110.2     9.2  Favored     9  52.090    12  1.04    16  0.47  molprobity  1.000  
153  153  m-20       51.4    57.5  Favored     4  68.130     8  0.45    11  0.75  molprobity  1.000  
154  154  mt        -96.8     5.1  Favored    11  51.990     8  0.42    11  0.47  molprobity  1.000  
155  155  m-85      -83.7   -11.3  Favored     9  49.200    12  0.46    16  0.47  molprobity  1.000  
156  156  ?          71.2    42.0  Favored     3  59.280     4  0.80     5  0.35  molprobity  1.000  
157  157  ptt?     -164.2   161.4  Favored     9  72.510     8  0.34    10  0.64  molprobity  1.000  
158  158  t         -63.4   124.9  Favored     5  50.100     6  0.75     8  0.68  molprobity  1.000  
159  159  mmm      -109.5   136.2  Favored     9  53.310     8  0.43    10  0.93  molprobity  1.000  
160  160  ?         -84.2    83.0  Favored     5  44.710     5  0.42     7  0.40  molprobity  1.000  
161  161  m120      -62.2   -41.1  Favored     6  43.740     8  0.84    11  0.59  molprobity  1.000  
162  162  ?         -67.7   -47.6  Favored     3  34.570     4  0.53     5  0.20  molprobity  1.000  
163  163  ?         -53.1   -42.2  Favored     5  40.480     5  0.37     7  0.47  molprobity  1.000  
164  164  m170      -69.4   -49.5  Favored     7  41.770    11  0.63    15  0.43  molprobity  1.000  
165  165  tp        -65.4   -45.3  Favored    11  47.350     8  0.57    11  0.54  molprobity  1.000  
166  166  ?         -62.7   -38.7  Favored     5  42.570     5  0.46     7  0.37  molprobity  1.000  
167  167  ?         -62.1   -50.6  Favored     3  42.490     4  0.71     5  0.41  molprobity  1.000  
168  168  tp        -58.0   -45.7  Favored    11  50.120     8  0.36    11  0.38  molprobity  1.000  
169  169  ?         -56.7   -44.0  Favored     5  43.960     5  0.84     7  0.82  molprobity  1.000  
170  170  t         -65.2   -40.4  Favored     9  47.100     7  0.27    10  0.66  molprobity  1.000  
171  171  ?         -65.0   -40.1  Favored     3  41.220     4  0.33     5  0.56  molprobity  1.000  
172  172  mt        -65.8   -47.2  Favored    11  46.120     8  0.34    11  0.64  molprobity  1.000  
173  173  ?         -60.2   -42.9  Favored     5  46.710     5  0.32     7  0.45  molprobity  1.000  
174  174  mtp       -69.6   -37.0  Favored     9  46.540     8  0.58    10  0.73  molprobity  1.000  
175  175  ?         -62.6   -48.1  Favored     5  45.760     5  0.33     7  0.62  molprobity  1.000  
176  176  t80       -51.6   -50.6  Favored     9  62.510    12  0.61    16  0.51  molprobity  1.000  
177  177  t         -63.9   -44.6  Favored     9  46.460     7  0.37    10  0.49  molprobity  1.000  
178  178  m-20      -71.3   -24.0  Favored     4  54.090     8  0.42    11  0.50  molprobity  1.000  
179  179  p         -79.6    -4.5  Favored     5  69.010     6  0.56     8  0.48  molprobity  1.000  
180  180  mt            ?       ?  ?          11  70.360     8  0.44     8  0.45  molprobity  1.000  
181  181  ?             ?       ?  ?           3  69.180     1  1.12     2  2.64  molprobity  1.000  
182  182  tpt180    -60.0   133.6  Favored    13  79.770    11  0.71    14  0.91  molprobity  1.000  
183  183  p         -45.2   140.2  Allowed     9  48.980     7  0.57    10  0.20  molprobity  1.000  
184  184  mtt-85    -85.2   136.1  Favored    13  45.650    11  0.60    14  1.72  molprobity  1.000  
185  185  m80       -97.9   120.5  Favored     7  43.510    11  0.26    15  0.62  molprobity  1.000  
186  186  ?             ?       ?  ?           5  40.150     4  1.29     4  2.21  molprobity  1.000  
187  187  ?             ?       ?  ?           ?  50.520     ?     ?     ?     ?  ?           1.000  
188  188  ?             ?       ?  ?           8  67.240     5  0.31     4  0.37  mogul       1.000  
189  189  ?             ?       ?  ?           6  70.050     4  0.30     3  0.36  mogul       1.000  
190  190  ?             ?       ?  ?           ?  56.400     ?     ?     ?     ?  ?           1.000  
191  191  ?             ?       ?  ?           ?  48.010     ?     ?     ?     ?  ?           1.000  
192  192  ?             ?       ?  ?           ?  42.930     ?     ?     ?     ?  ?           1.000  
193  193  ?             ?       ?  ?           ?  35.350     ?     ?     ?     ?  ?           1.000  
194  194  ?             ?       ?  ?           ?  62.800     ?     ?     ?     ?  ?           1.000  
195  195  ?             ?       ?  ?           ?  42.800     ?     ?     ?     ?  ?           1.000  
196  196  ?             ?       ?  ?           ?  51.980     ?     ?     ?     ?  ?           1.000  
197  197  ?             ?       ?  ?           ?  36.010     ?     ?     ?     ?  ?           1.000  
198  198  ?             ?       ?  ?           ?  60.000     ?     ?     ?     ?  ?           1.000  
199  199  ?             ?       ?  ?           ?  45.180     ?     ?     ?     ?  ?           1.000  
200  200  ?             ?       ?  ?           ?  45.310     ?     ?     ?     ?  ?           1.000  
201  201  ?             ?       ?  ?           ?  59.380     ?     ?     ?     ?  ?           1.000  
202  202  ?             ?       ?  ?           ?  67.300     ?     ?     ?     ?  ?           1.000  
203  203  ?             ?       ?  ?           ?  51.690     ?     ?     ?     ?  ?           1.000  
204  204  ?             ?       ?  ?           ?  45.530     ?     ?     ?     ?  ?           1.000  
205  205  ?             ?       ?  ?           ?  35.310     ?     ?     ?     ?  ?           1.000  
206  206  ?             ?       ?  ?           ?  56.440     ?     ?     ?     ?  ?           1.000  
207  207  ?             ?       ?  ?           ?  33.520     ?     ?     ?     ?  ?           1.000  
208  208  ?             ?       ?  ?           ?  56.110     ?     ?     ?     ?  ?           1.000  
209  209  ?             ?       ?  ?           ?  27.230     ?     ?     ?     ?  ?           1.000  
210  210  ?             ?       ?  ?           ?  48.730     ?     ?     ?     ?  ?           1.000  
211  211  ?             ?       ?  ?           ?  58.800     ?     ?     ?     ?  ?           1.000  
212  212  ?             ?       ?  ?           ?  24.320     ?     ?     ?     ?  ?           1.000  
213  213  ?             ?       ?  ?           ?  59.470     ?     ?     ?     ?  ?           1.000  
214  214  ?             ?       ?  ?           ?  71.630     ?     ?     ?     ?  ?           1.000  
215  215  ?             ?       ?  ?           ?  41.460     ?     ?     ?     ?  ?           1.000  
216  216  ?             ?       ?  ?           ?  71.440     ?     ?     ?     ?  ?           1.000  
217  217  ?             ?       ?  ?           ?  60.050     ?     ?     ?     ?  ?           1.000  
#
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   27  NE2   1  0.42  2.50  
2   70  CE2   2  0.44  2.52  
3   98  HG21  3  0.44  2.00  
4  139  HD13  2  0.44  2.52  
5  166  HB2   3  0.44  2.00  
6  190  O     1  0.42  2.50  
#
_pdbx_vrpt_instance_mogul_torsion_outliers.ordinal        1
_pdbx_vrpt_instance_mogul_torsion_outliers.instance_id    189
_pdbx_vrpt_instance_mogul_torsion_outliers.atom_1         "C2'"
_pdbx_vrpt_instance_mogul_torsion_outliers.atom_2         "C3'"
_pdbx_vrpt_instance_mogul_torsion_outliers.atom_3         "C4'"
_pdbx_vrpt_instance_mogul_torsion_outliers.atom_4         "C5'"
_pdbx_vrpt_instance_mogul_torsion_outliers.obsval         -123.66
_pdbx_vrpt_instance_mogul_torsion_outliers.mean           50.04
_pdbx_vrpt_instance_mogul_torsion_outliers.numobs         10000
_pdbx_vrpt_instance_mogul_torsion_outliers.stdev          12.68
_pdbx_vrpt_instance_mogul_torsion_outliers.mindiff        0.02
_pdbx_vrpt_instance_mogul_torsion_outliers.local_density  1.39
#
loop_
_pdbx_vrpt_model_instance_density.ordinal
_pdbx_vrpt_model_instance_density.instance_id
_pdbx_vrpt_model_instance_density.natoms_eds
_pdbx_vrpt_model_instance_density.RSRCC
_pdbx_vrpt_model_instance_density.RSR
_pdbx_vrpt_model_instance_density.RSRZ
  1    1   5  0.723  0.287   1.777  
  2    2  11  0.860  0.156   0.127  
  3    3   5  0.961  0.094  -0.411  
  4    4   4  0.949  0.061  -0.916  
  5    5   7  0.971  0.084  -0.599  
  6    6   7  0.979  0.110  -0.276  
  7    7   7  0.969  0.088  -0.582  
  8    8  14  0.951  0.133   0.430  
  9    9   7  0.981  0.130   0.127  
 10   10   8  0.967  0.102  -0.376  
 11   11   8  0.976  0.105  -0.321  
 12   12   8  0.956  0.159   0.633  
 13   13   5  0.986  0.110  -0.113  
 14   14   6  0.972  0.104  -0.032  
 15   15   7  0.979  0.129   0.107  
 16   16   7  0.982  0.088  -0.720  
 17   17   7  0.971  0.123  -0.014  
 18   18  11  0.945  0.079  -0.853  
 19   19   8  0.966  0.096  -0.658  
 20   20   5  0.981  0.139   0.426  
 21   21   8  0.977  0.073  -0.908  
 22   22   9  0.953  0.080  -0.936  
 23   23   8  0.965  0.155   0.551  
 24   24   8  0.949  0.222   1.885  
 25   25   4  0.968  0.143   0.467  
 26   26   8  0.954  0.144   0.175  
 27   27   9  0.923  0.124  -0.283  
 28   28   9  0.963  0.102  -0.736  
 29   29   7  0.966  0.130   0.127  
 30   30   8  0.916  0.128   0.101  
 31   31   8  0.977  0.098  -0.615  
 32   32  14  0.956  0.155   0.934  
 33   33   8  0.952  0.128  -0.010  
 34   34   5  0.975  0.092  -0.448  
 35   35  14  0.971  0.096  -0.416  
 36   36   7  0.961  0.099  -0.336  
 37   37  11  0.965  0.089  -0.647  
 38   38   8  0.932  0.128  -0.068  
 39   39   7  0.950  0.103  -0.266  
 40   40   7  0.978  0.061  -1.081  
 41   41   8  0.980  0.104  -0.494  
 42   42   9  0.951  0.137  -0.341  
 43   43  11  0.963  0.088  -0.667  
 44   44   9  0.952  0.079  -1.049  
 45   45  11  0.943  0.154   0.696  
 46   46  14  0.966  0.089  -0.577  
 47   47  11  0.974  0.104  -0.641  
 48   48  12  0.963  0.094  -0.501  
 49   49  11  0.959  0.132   0.242  
 50   50   7  0.962  0.094  -0.471  
 51   51  10  0.955  0.090  -0.571  
 52   52   5  0.970  0.103  -0.243  
 53   53   8  0.979  0.093  -0.716  
 54   54   8  0.986  0.084  -0.706  
 55   55  10  0.963  0.148   0.400  
 56   56  11  0.955  0.120  -0.006  
 57   57   6  0.968  0.104  -0.309  
 58   58   8  0.982  0.144   0.312  
 59   59   8  0.913  0.200   1.422  
 60   60  10  0.932  0.145   0.350  
 61   61   8  0.979  0.155   0.551  
 62   62   8  0.989  0.169   0.817  
 63   63  11  0.953  0.175   1.130  
 64   64   8  0.971  0.127  -0.032  
 65   65   8  0.973  0.148   0.393  
 66   66   8  0.985  0.147   0.373  
 67   67  14  0.958  0.112  -0.050  
 68   68  14  0.963  0.101  -0.302  
 69   69  14  0.930  0.140   0.590  
 70   70  12  0.931  0.154   0.767  
 71   71   8  0.940  0.113  -0.312  
 72   72   4  0.981  0.093  -0.376  
 73   73   4  0.911  0.066  -0.831  
 74   74   5  0.967  0.071  -0.838  
 75   75   7  0.975  0.062  -1.244  
 76   76   9  0.919  0.116  -0.546  
 77   77   9  0.952  0.189   0.371  
 78   78  11  0.871  0.175   0.408  
 79   79   8  0.933  0.146   0.353  
 80   80   4  0.983  0.169   0.906  
 81   81   6  0.964  0.085  -0.634  
 82   82   4  0.974  0.085  -0.511  
 83   83   9  0.972  0.101  -0.834  
 84   84   8  0.965  0.092  -0.736  
 85   85   8  0.984  0.088  -0.822  
 86   86   7  0.959  0.116  -0.155  
 87   87   8  0.968  0.112  -0.330  
 88   88   7  0.972  0.106  -0.250  
 89   89   8  0.973  0.145   0.333  
 90   90   8  0.974  0.104  -0.494  
 91   91   6  0.979  0.088  -0.583  
 92   92   5  0.982  0.096  -0.374  
 93   93   8  0.981  0.108  -0.413  
 94   94   8  0.971  0.119  -0.192  
 95   95   6  0.982  0.118  -0.070  
 96   96   4  0.973  0.101  -0.241  
 97   97  12  0.917  0.142   0.514  
 98   98   7  0.971  0.120  -0.075  
 99   99   9  0.936  0.118  -0.372  
100  100   9  0.912  0.112  -0.461  
101  101   9  0.935  0.207   0.618  
102  102  11  0.905  0.226   2.184  
103  103   6  0.963  0.071  -0.874  
104  104   4  0.988  0.055  -1.017  
105  105   7  0.985  0.075  -0.757  
106  106  14  0.967  0.108  -0.142  
107  107  11  0.976  0.134   0.283  
108  108   4  0.980  0.160   0.754  
109  109   4  0.986  0.139   0.400  
110  110   8  0.980  0.125  -0.071  
111  111   6  0.966  0.100  -0.378  
112  112   4  0.982  0.120   0.079  
113  113   7  0.977  0.092  -0.639  
114  114   7  0.989  0.089  -0.700  
115  115  12  0.974  0.089  -0.607  
116  116   5  0.957  0.106  -0.188  
117  117   8  0.987  0.097  -0.635  
118  118   8  0.974  0.095  -0.505  
119  119   4  0.974  0.074  -0.696  
120  120  12  0.976  0.077  -0.860  
121  121   7  0.969  0.080  -0.881  
122  122  14  0.966  0.096  -0.416  
123  123   8  0.953  0.177   0.978  
124  124  11  0.947  0.097  -0.744  
125  125   4  0.974  0.054  -1.034  
126  126   9  0.919  0.185   0.391  
127  127  11  0.936  0.180   0.482  
128  128   8  0.917  0.236   1.575  
129  129   7  0.907  0.132   0.242  
130  130   5  0.927  0.210   0.993  
131  131   6  0.919  0.220   1.674  
132  132   4  0.949  0.243   2.153  
133  133   8  0.952  0.110  -0.371  
134  134  12  0.955  0.122   0.091  
135  135   8  0.937  0.075  -1.079  
136  136   9  0.913  0.109  -0.506  
137  137  11  0.940  0.117  -0.449  
138  138   4  0.976  0.073  -0.713  
139  139   8  0.978  0.103  -0.514  
140  140   8  0.981  0.119  -0.186  
141  141   8  0.987  0.107  -0.432  
142  142  11  0.935  0.128   0.159  
143  143   5  0.980  0.080  -0.671  
144  144   8  0.979  0.108  -0.413  
145  145   8  0.979  0.102  -0.535  
146  146  14  0.952  0.144   0.682  
147  147   8  0.941  0.170   0.859  
148  148   7  0.969  0.117  -0.135  
149  149   5  0.972  0.117   0.017  
150  150   4  0.923  0.099  -0.275  
151  151  14  0.920  0.227   2.581  
152  152  11  0.922  0.168   0.986  
153  153   8  0.909  0.186   0.814  
154  154   8  0.973  0.124  -0.091  
155  155  11  0.968  0.112  -0.171  
156  156   4  0.927  0.106  -0.157  
157  157   8  0.900  0.159   0.670  
158  158   6  0.934  0.090  -0.549  
159  159   8  0.954  0.100  -0.413  
160  160   5  0.973  0.076  -0.745  
161  161   8  0.952  0.078  -0.810  
162  162   4  0.969  0.089  -0.444  
163  163   5  0.954  0.106  -0.188  
164  164  10  0.978  0.072  -0.873  
165  165   8  0.980  0.159   0.633  
166  166   5  0.982  0.041  -1.396  
167  167   4  0.959  0.063  -0.882  
168  168   8  0.983  0.106  -0.454  
169  169   5  0.951  0.102  -0.262  
170  170   7  0.971  0.096  -0.558  
171  171   4  0.968  0.073  -0.713  
172  172   8  0.951  0.108  -0.413  
173  173   5  0.983  0.094  -0.411  
174  174   8  0.945  0.093  -0.541  
175  175   5  0.966  0.110  -0.113  
176  176  11  0.952  0.219   2.039  
177  177   7  0.962  0.107  -0.337  
178  178   8  0.965  0.109  -0.358  
179  179   6  0.933  0.230   1.844  
180  180   9  0.901  0.186   1.159  
181  181   3  0.893  0.147       ?  
182  182  11  0.933  0.162   0.216  
183  183   7  0.967  0.120  -0.075  
184  184  11  0.918  0.138  -0.139  
185  185  10  0.969  0.071  -0.889  
186  186   5  0.923  0.111  -0.095  
187  187  11  0.881  0.175       ?  
188  188   6  0.811  0.153       ?  
189  189   5  0.917  0.092       ?  
190  190   1  0.812  0.280       ?  
191  191   1  0.968  0.136       ?  
192  192   1  0.967  0.107       ?  
193  193   1  0.969  0.202       ?  
194  194   1  0.972  0.241       ?  
195  195   1  0.922  0.303       ?  
196  196   1  0.791  0.114       ?  
197  197   1  0.952  0.118       ?  
198  198   1  0.827  0.232       ?  
199  199   1  0.952  0.154       ?  
200  200   1  0.975  0.177       ?  
201  201   1  0.924  0.183       ?  
202  202   1  0.273  0.595       ?  
203  203   1  0.914  0.192       ?  
204  204   1  0.971  0.112       ?  
205  205   1  0.941  0.106       ?  
206  206   1  0.765  0.519       ?  
207  207   1  0.984  0.156       ?  
208  208   1  0.936  0.100       ?  
209  209   1  0.967  0.089       ?  
210  210   1  0.936  0.289       ?  
211  211   1  0.431  0.322       ?  
212  212   1  0.984  0.091       ?  
213  213   1  0.728  0.211       ?  
214  214   1  0.657  0.277       ?  
215  215   1  0.922  0.116       ?  
216  216   1  0.413  0.222       ?  
217  217   1  0.452  0.350       ?  
#
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  mogul        "1.8.4, CSD as541be (2020)"                                           Y  
3  eds          2.36                                                                  Y  
4  dcc          '"2.27  (2023-04-10)"'                                                Y  
5  xtriage      1.13                                                                  Y  
6  percentiles  "20191225.v01 (using entries in the PDB archive December 25th 2019)"  Y  
##
