data_4YGI

_pdbx_vrpt_database.id    PDB
_pdbx_vrpt_database.code  4YGI
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   x-ray
#
_pdbx_vrpt_summary.entry_id                    4YGI
_pdbx_vrpt_summary.PDB_deposition_date         2015-02-26
_pdbx_vrpt_summary.PDB_revision_number         3
_pdbx_vrpt_summary.PDB_revision_date           2023-11-08
_pdbx_vrpt_summary.report_creation_date        2023-10-30:10:09
_pdbx_vrpt_summary.attempted_validation_steps  molprobity,validation-pack,xtriage,eds,mogul,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      "Histone-lysine N-methyltransferase, H3 lysine-9 specific SUVH5"  
2  polymer      Polydeoxyribonucleotide  
3  non-polymer  "MAGNESIUM ION"  
4  water        water  
#
loop_
_pdbx_vrpt_asym.label_asym_id
_pdbx_vrpt_asym.entity_id
A  1  
B  2  
C  3  
D  3  
E  3  
F  4  
G  4  
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all  x-ray  
2  2.6  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   75.45  141614     ?     ?  
 2  2  1   87.38    3518  2.60  2.60  
 3  1  2   21.91  138981     ?     ?  
 4  2  2   43.04    3455  2.60  2.60  
 5  1  3  100.00  138945     ?     ?  
 6  2  3  100.00    3455  2.60  2.60  
 7  1  4   57.00  127900     ?     ?  
 8  2  4   50.93    3104  2.60  2.60  
 9  1  5   12.99  130704     ?     ?  
10  2  5   24.89    3163  2.60  2.60  
#
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   21.91  
2  4  2  A  1  1  A   43.04  
3  5  3  A  1  1  A  100.00  
4  6  3  A  1  1  A  100.00  
5  7  4  A  1  1  A   54.05  
6  8  4  A  1  1  A   48.36  
7  7  4  B  1  2  B  100.00  
8  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  0.39  0.21  1153  1560  
2  1  2  B  B  0.93  0.55   204   311  
#
_pdbx_vrpt_summary_geometry.ordinal                        1
_pdbx_vrpt_summary_geometry.percent_ramachandran_outliers  0.69
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers       0.00
_pdbx_vrpt_summary_geometry.clashscore                     3.13
_pdbx_vrpt_summary_geometry.num_H_reduce                   1218
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ                 1357
_pdbx_vrpt_summary_geometry.bonds_RMSZ                     0.29
_pdbx_vrpt_summary_geometry.num_angles_RMSZ                1871
_pdbx_vrpt_summary_geometry.angles_RMSZ                    0.52
#
_pdbx_vrpt_summary_diffraction.exp_method                x-ray
_pdbx_vrpt_summary_diffraction.ordinal                   1
_pdbx_vrpt_summary_diffraction.Babinet_b                 134.402
_pdbx_vrpt_summary_diffraction.bulk_solvent_b            50.336
_pdbx_vrpt_summary_diffraction.Wilson_B_estimate         70.359
_pdbx_vrpt_summary_diffraction.I_over_sigma              2.42(2.61A)
_pdbx_vrpt_summary_diffraction.num_miller_indices        7041
_pdbx_vrpt_summary_diffraction.Babinet_k                 0.071
_pdbx_vrpt_summary_diffraction.bulk_solvent_k            0.310
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L_mean     0.498
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L2_mean    0.333
_pdbx_vrpt_summary_diffraction.Fo_Fc_correlation         0.927
_pdbx_vrpt_summary_diffraction.DCC_R                     0.24
_pdbx_vrpt_summary_diffraction.DCC_Rfree                 0.28
_pdbx_vrpt_summary_diffraction.EDS_R                     0.25
_pdbx_vrpt_summary_diffraction.EDS_res_high              2.60
_pdbx_vrpt_summary_diffraction.EDS_res_low               33.96
_pdbx_vrpt_summary_diffraction.Wilson_B_aniso            "[69.050,69.050,73.466,0.000,0.000,0.000]"
_pdbx_vrpt_summary_diffraction.data_anisotropy           0.063
_pdbx_vrpt_summary_diffraction.trans_NCS_details         "The largest off-origin peak in the Patterson function is 4.61% 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         2
_pdbx_vrpt_summary_diffraction.centric_outliers          0
_pdbx_vrpt_summary_diffraction.data_completeness         99.00
_pdbx_vrpt_summary_diffraction.number_reflns_R_free      331
_pdbx_vrpt_summary_diffraction.percent_free_reflections  4.70
_pdbx_vrpt_summary_diffraction.percent_RSRZ_outliers     2.52
_pdbx_vrpt_summary_diffraction.PDB_resolution_high       2.60
_pdbx_vrpt_summary_diffraction.PDB_resolution_low        33.96
_pdbx_vrpt_summary_diffraction.PDB_R                     0.24
_pdbx_vrpt_summary_diffraction.PDB_Rfree                 0.28
#
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_bond_outliers
_pdbx_vrpt_model_instance.count_mogul_angle_outliers
_pdbx_vrpt_model_instance.count_mogul_torsion_outliers
  1  1  1  A    1  GLN  A  362  .  ?        ?     ?     ?     ?  
  2  1  1  A    2  ILE  A  363  .  ?        ?     ?     ?     ?  
  3  1  1  A    3  ILE  A  364  .  ?        ?     ?     ?     ?  
  4  1  1  A    4  GLY  A  365  .  ?        ?     ?     ?     ?  
  5  1  1  A    5  THR  A  366  .  ?        ?     ?     ?     ?  
  6  1  1  A    6  VAL  A  367  .  ?        ?     ?     ?     ?  
  7  1  1  A    7  PRO  A  368  .  ?        ?     ?     ?     ?  
  8  1  1  A    8  GLY  A  369  .  ?        ?     ?     ?     ?  
  9  1  1  A    9  VAL  A  370  .  ?        ?     ?     ?     ?  
 10  1  1  A   10  GLU  A  371  .  ?        ?     ?     ?     ?  
 11  1  1  A   11  VAL  A  372  .  ?        ?     ?     ?     ?  
 12  1  1  A   12  GLY  A  373  .  ?        ?     ?     ?     ?  
 13  1  1  A   13  ASP  A  374  .  ?        ?     ?     ?     ?  
 14  1  1  A   14  GLU  A  375  .  ?        ?     ?     ?     ?  
 15  1  1  A   15  PHE  A  376  .  ?        ?     ?     ?     ?  
 16  1  1  A   16  GLN  A  377  .  ?        ?     ?     ?     ?  
 17  1  1  A   17  TYR  A  378  .  ?        ?     ?     ?     ?  
 18  1  1  A   18  ARG  A  379  .  ?        1     ?     ?     ?  
 19  1  1  A   19  MET  A  380  .  ?        ?     ?     ?     ?  
 20  1  1  A   20  GLU  A  381  .  ?        ?     ?     ?     ?  
 21  1  1  A   21  LEU  A  382  .  ?        ?     ?     ?     ?  
 22  1  1  A   22  ASN  A  383  .  ?        ?     ?     ?     ?  
 23  1  1  A   23  LEU  A  384  .  ?        ?     ?     ?     ?  
 24  1  1  A   24  LEU  A  385  .  ?        ?     ?     ?     ?  
 25  1  1  A   25  GLY  A  386  .  ?        ?     ?     ?     ?  
 26  1  1  A   26  ILE  A  387  .  ?        ?     ?     ?     ?  
 27  1  1  A   27  HIS  A  388  .  ?        ?     ?     ?     ?  
 28  1  1  A   28  ARG  A  389  .  ?        ?     ?     ?     ?  
 29  1  1  A   29  PRO  A  390  .  ?        ?     ?     ?     ?  
 30  1  1  A   30  SER  A  391  .  ?        ?     ?     ?     ?  
 31  1  1  A   31  GLN  A  392  .  ?        ?     ?     ?     ?  
 32  1  1  A   32  SER  A  393  .  ?        ?     ?     ?     ?  
 33  1  1  A   33  GLY  A  394  .  ?        ?     ?     ?     ?  
 34  1  1  A   34  ILE  A  395  .  ?        ?     ?     ?     ?  
 35  1  1  A   35  ASP  A  396  .  ?        ?     ?     ?     ?  
 36  1  1  A   36  TYR  A  397  .  ?        ?     ?     ?     ?  
 37  1  1  A   37  MET  A  398  .  ?        ?     ?     ?     ?  
 38  1  1  A   38  LYS  A  399  .  ?        ?     ?     ?     ?  
 39  1  1  A   39  ASP  A  400  .  ?        ?     ?     ?     ?  
 40  1  1  A   40  ASP  A  401  .  ?        ?     ?     ?     ?  
 41  1  1  A   41  GLY  A  402  .  ?        1     ?     ?     ?  
 42  1  1  A   42  GLY  A  403  .  ?        ?     ?     ?     ?  
 43  1  1  A   43  GLU  A  404  .  ?        1     ?     ?     ?  
 44  1  1  A   44  LEU  A  405  .  ?        1     ?     ?     ?  
 45  1  1  A   45  VAL  A  406  .  ?        ?     ?     ?     ?  
 46  1  1  A   46  ALA  A  407  .  ?        ?     ?     ?     ?  
 47  1  1  A   47  THR  A  408  .  ?        ?     ?     ?     ?  
 48  1  1  A   48  SER  A  409  .  ?        ?     ?     ?     ?  
 49  1  1  A   49  ILE  A  410  .  ?        ?     ?     ?     ?  
 50  1  1  A   50  VAL  A  411  .  ?        1     ?     ?     ?  
 51  1  1  A   51  SER  A  412  .  ?        ?     ?     ?     ?  
 52  1  1  A   52  SER  A  413  .  ?        ?     ?     ?     ?  
 53  1  1  A   53  GLY  A  414  .  ?        ?     ?     ?     ?  
 54  1  1  A   54  GLY  A  415  .  ?        ?     ?     ?     ?  
 55  1  1  A   55  TYR  A  416  .  ?        ?     ?     ?     ?  
 56  1  1  A   56  ASN  A  417  .  ?        ?     ?     ?     ?  
 57  1  1  A   57  ASP  A  418  .  ?        ?     ?     ?     ?  
 58  1  1  A   58  VAL  A  419  .  ?        ?     ?     ?     ?  
 59  1  1  A   59  LEU  A  420  .  ?        ?     ?     ?     ?  
 60  1  1  A   60  ASP  A  421  .  ?        ?     ?     ?     ?  
 61  1  1  A   61  ASN  A  422  .  ?        ?     ?     ?     ?  
 62  1  1  A   62  SER  A  423  .  ?        ?     ?     ?     ?  
 63  1  1  A   63  ASP  A  424  .  ?        ?     ?     ?     ?  
 64  1  1  A   64  VAL  A  425  .  ?        ?     ?     ?     ?  
 65  1  1  A   65  LEU  A  426  .  ?        ?     ?     ?     ?  
 66  1  1  A   66  ILE  A  427  .  ?        ?     ?     ?     ?  
 67  1  1  A   67  TYR  A  428  .  ?        ?     ?     ?     ?  
 68  1  1  A   68  THR  A  429  .  ?        ?     ?     ?     ?  
 69  1  1  A   69  GLY  A  430  .  ?        ?     ?     ?     ?  
 70  1  1  A   70  GLN  A  431  .  ?        ?     ?     ?     ?  
 71  1  1  A   71  GLY  A  432  .  ?        ?     ?     ?     ?  
 72  1  1  A   72  GLY  A  433  .  ?        ?     ?     ?     ?  
 73  1  1  A   73  ASN  A  434  .  ?        ?     ?     ?     ?  
 74  1  1  A   74  VAL  A  435  .  ?        ?     ?     ?     ?  
 75  1  1  A   75  GLY  A  436  .  ?        ?     ?     ?     ?  
 76  1  1  A   76  LYS  A  437  .  ?        ?     ?     ?     ?  
 77  1  1  A   77  LYS  A  438  .  ?        ?     ?     ?     ?  
 78  1  1  A   81  GLU  A  442  .  ?        ?     ?     ?     ?  
 79  1  1  A   82  PRO  A  443  .  ?        1     ?     ?     ?  
 80  1  1  A   83  PRO  A  444  .  ?        1     ?     ?     ?  
 81  1  1  A   84  LYS  A  445  .  ?        ?     ?     ?     ?  
 82  1  1  A   85  ASP  A  446  .  ?        ?     ?     ?     ?  
 83  1  1  A   86  GLN  A  447  .  ?        ?     ?     ?     ?  
 84  1  1  A   87  GLN  A  448  .  ?        ?     ?     ?     ?  
 85  1  1  A   88  LEU  A  449  .  ?        ?     ?     ?     ?  
 86  1  1  A   89  VAL  A  450  .  ?        ?     ?     ?     ?  
 87  1  1  A   90  THR  A  451  .  ?        1     ?     ?     ?  
 88  1  1  A   91  GLY  A  452  .  ?        1     ?     ?     ?  
 89  1  1  A   92  ASN  A  453  .  ?        ?     ?     ?     ?  
 90  1  1  A   93  LEU  A  454  .  ?        1     ?     ?     ?  
 91  1  1  A   94  ALA  A  455  .  ?        ?     ?     ?     ?  
 92  1  1  A   95  LEU  A  456  .  ?        ?     ?     ?     ?  
 93  1  1  A   96  LYS  A  457  .  ?        ?     ?     ?     ?  
 94  1  1  A   97  ASN  A  458  .  ?        ?     ?     ?     ?  
 95  1  1  A   98  SER  A  459  .  ?        ?     ?     ?     ?  
 96  1  1  A   99  ILE  A  460  .  ?        ?     ?     ?     ?  
 97  1  1  A  100  ASN  A  461  .  ?        ?     ?     ?     ?  
 98  1  1  A  101  LYS  A  462  .  ?        ?     ?     ?     ?  
 99  1  1  A  102  LYS  A  463  .  ?        ?     ?     ?     ?  
100  1  1  A  103  ASN  A  464  .  ?        ?     ?     ?     ?  
101  1  1  A  104  PRO  A  465  .  ?        ?     ?     ?     ?  
102  1  1  A  105  VAL  A  466  .  ?        ?     ?     ?     ?  
103  1  1  A  106  ARG  A  467  .  ?        ?     ?     ?     ?  
104  1  1  A  107  VAL  A  468  .  ?        ?     ?     ?     ?  
105  1  1  A  108  ILE  A  469  .  ?        1     ?     ?     ?  
106  1  1  A  109  ARG  A  470  .  ?        ?     ?     ?     ?  
107  1  1  A  110  GLY  A  471  .  ?        ?     ?     ?     ?  
108  1  1  A  111  ILE  A  472  .  ?        ?     ?     ?     ?  
109  1  1  A  112  LYS  A  473  .  ?        ?     ?     ?     ?  
110  1  1  A  123  LYS  A  484  .  ?        ?     ?     ?     ?  
111  1  1  A  124  ASN  A  485  .  ?        ?     ?     ?     ?  
112  1  1  A  125  TYR  A  486  .  ?        ?     ?     ?     ?  
113  1  1  A  126  VAL  A  487  .  ?        ?     ?     ?     ?  
114  1  1  A  127  TYR  A  488  .  ?        ?     ?     ?     ?  
115  1  1  A  128  ASP  A  489  .  ?        ?     ?     ?     ?  
116  1  1  A  129  GLY  A  490  .  ?        ?     ?     ?     ?  
117  1  1  A  130  LEU  A  491  .  ?        ?     ?     ?     ?  
118  1  1  A  131  TYR  A  492  .  ?        ?     ?     ?     ?  
119  1  1  A  132  LEU  A  493  .  ?        ?     ?     ?     ?  
120  1  1  A  133  VAL  A  494  .  ?        ?     ?     ?     ?  
121  1  1  A  134  GLU  A  495  .  ?        ?     ?     ?     ?  
122  1  1  A  135  GLU  A  496  .  ?        ?     ?     ?     ?  
123  1  1  A  136  TYR  A  497  .  ?        ?     ?     ?     ?  
124  1  1  A  137  TRP  A  498  .  ?        ?     ?     ?     ?  
125  1  1  A  138  GLU  A  499  .  ?        ?     ?     ?     ?  
126  1  1  A  139  GLU  A  500  .  ?        ?     ?     ?     ?  
127  1  1  A  140  THR  A  501  .  ?        1     ?     ?     ?  
128  1  1  A  141  GLY  A  502  .  ?        ?     ?     ?     ?  
129  1  1  A  142  SER  A  503  .  ?        ?     ?     ?     ?  
130  1  1  A  143  HIS  A  504  .  ?        ?     ?     ?     ?  
131  1  1  A  144  GLY  A  505  .  ?        ?     ?     ?     ?  
132  1  1  A  145  LYS  A  506  .  ?        ?     ?     ?     ?  
133  1  1  A  146  LEU  A  507  .  ?        1     ?     ?     ?  
134  1  1  A  147  VAL  A  508  .  ?        ?     ?     ?     ?  
135  1  1  A  148  PHE  A  509  .  ?        ?     ?     ?     ?  
136  1  1  A  149  LYS  A  510  .  ?        ?     ?     ?     ?  
137  1  1  A  150  PHE  A  511  .  ?        ?     ?     ?     ?  
138  1  1  A  151  LYS  A  512  .  ?        ?     ?     ?     ?  
139  1  1  A  152  LEU  A  513  .  ?        ?     ?     ?     ?  
140  1  1  A  153  ARG  A  514  .  ?        ?     ?     ?     ?  
141  1  1  A  154  ARG  A  515  .  ?        1     ?     ?     ?  
142  1  1  A  155  ILE  A  516  .  ?        ?     ?     ?     ?  
143  1  1  A  156  PRO  A  517  .  ?        ?     ?     ?     ?  
144  1  1  A  157  GLY  A  518  .  ?        ?     ?     ?     ?  
145  1  1  A  158  GLN  A  519  .  ?        ?     ?     ?     ?  
146  1  1  A  159  PRO  A  520  .  ?        1     ?     ?     ?  
147  1  1  A  160  GLU  A  521  .  ?        ?     ?     ?     ?  
148  1  1  A  161  LEU  A  522  .  ?        ?     ?     ?     ?  
149  1  1  A  162  PRO  A  523  .  ?        ?     ?     ?     ?  
150  1  1  A  163  TRP  A  524  .  ?        ?     ?     ?     ?  
151  1  2  B    1  DA   B    1  .  ?        ?     ?     ?     ?  
152  1  2  B    2  DC   B    2  .  ?        ?     ?     ?     ?  
153  1  2  B    3  DT   B    3  .  ?        ?     ?     ?     ?  
154  1  2  B    4  DA   B    4  .  ?        ?     ?     ?     ?  
155  1  2  B    5  5HC  B    5  .  ?        ?     7     3     2  
156  1  2  B    6  DG   B    6  .  ?        1     ?     ?     ?  
157  1  2  B    7  DT   B    7  .  ?        ?     ?     ?     ?  
158  1  2  B    8  DA   B    8  .  ?        ?     ?     ?     ?  
159  1  2  B    9  DG   B    9  .  ?        ?     ?     ?     ?  
160  1  2  B   10  DT   B   10  .  ?        ?     ?     ?     ?  
161  1  3  C    .  MG   A  601  .  ?        ?     ?     ?     ?  
162  1  3  D    .  MG   B  101  .  ?        ?     ?     ?     ?  
163  1  3  E    .  MG   B  102  .  ?        ?     ?     ?     ?  
164  1  4  F    .  HOH  A  701  .  ?        ?     ?     ?     ?  
165  1  4  F    .  HOH  A  702  .  ?        ?     ?     ?     ?  
166  1  4  F    .  HOH  A  703  .  ?        ?     ?     ?     ?  
167  1  4  F    .  HOH  A  704  .  ?        ?     ?     ?     ?  
168  1  4  F    .  HOH  A  705  .  ?        ?     ?     ?     ?  
169  1  4  F    .  HOH  A  706  .  ?        ?     ?     ?     ?  
170  1  4  F    .  HOH  A  707  .  ?        ?     ?     ?     ?  
171  1  4  F    .  HOH  A  708  .  ?        ?     ?     ?     ?  
172  1  4  F    .  HOH  A  709  .  ?        ?     ?     ?     ?  
173  1  4  F    .  HOH  A  710  .  ?        ?     ?     ?     ?  
174  1  4  F    .  HOH  A  711  .  ?        ?     ?     ?     ?  
175  1  4  G    .  HOH  B  201  .  ?        ?     ?     ?     ?  
176  1  4  G    .  HOH  B  202  .  ?        ?     ?     ?     ?  
177  1  4  G    .  HOH  B  203  .  ?        ?     ?     ?     ?  
178  1  4  G    .  HOH  B  204  .  ?        ?     ?     ?     ?  
179  1  4  G    .  HOH  B  205  .  ?        ?     ?     ?     ?  
#
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.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  tt0           ?       ?  ?           1     7   82.990     9  0.22    12  0.28  molprobity  1.000  
  2    2  tt       -125.4   158.5  Favored     ?    11   83.900     8  0.16    11  0.37  molprobity  1.000  
  3    3  mt       -110.2   117.7  Favored     ?    11   75.370     8  0.13    11  0.48  molprobity  1.000  
  4    4  ?         108.6  -145.2  Favored     ?     3   69.550     4  0.25     5  0.29  molprobity  1.000  
  5    5  m         -65.7   138.0  Favored     ?     7   75.800     7  0.26    10  0.55  molprobity  1.000  
  6    6  t        -105.2   123.8  Favored     ?     9   74.440     7  0.16    11  0.70  molprobity  1.000  
  7    7  Cg_exo    -54.0   123.3  Favored     ?     7   75.910     8  0.12    11  0.23  molprobity  1.000  
  8    8  ?          91.3     3.0  Favored     ?     3   80.380     4  0.25     5  0.18  molprobity  1.000  
  9    9  t        -115.5   107.1  Favored     ?     9   73.780     7  0.19    10  0.45  molprobity  1.000  
 10   10  tp10      -95.0   152.2  Favored     ?     6   82.650     9  0.20    12  0.33  molprobity  1.000  
 11   11  t         -67.2   112.9  Favored     ?     9   68.710     7  0.24    10  0.46  molprobity  1.000  
 12   12  ?         119.6   -12.6  Favored     ?     3   62.970     4  0.25     5  0.36  molprobity  1.000  
 13   13  m-20      -62.5   140.8  Favored     ?     4   77.000     8  0.16    11  0.25  molprobity  1.000  
 14   14  mt-10    -115.3   145.9  Favored     ?     6   78.520     9  0.22    12  0.29  molprobity  1.000  
 15   15  m-85     -135.1   151.8  Favored     ?     9   68.780    12  0.33    16  0.22  molprobity  1.000  
 16   16  tt0       -90.1   -45.9  Favored     ?     8   76.710     9  0.21    12  0.29  molprobity  1.000  
 17   17  m-85     -123.4   157.6  Favored     ?     9   67.410    13  0.25    18  0.36  molprobity  1.000  
 18   18  mmm-85    -64.3   -28.6  Favored     ?    13   58.600    11  0.15    14  0.31  molprobity  1.000  
 19   19  mmt       -71.9   -18.1  Favored     ?     9   65.420     8  0.30    10  0.56  molprobity  1.000  
 20   20  mt-10     -69.3   -38.0  Favored     ?     6   69.030     9  0.20    12  0.42  molprobity  1.000  
 21   21  mt        -65.8   -27.6  Favored     ?    11   60.280     8  0.19    11  0.28  molprobity  1.000  
 22   22  t-20      -73.0   -48.4  Favored     ?     6   65.980     8  0.22    11  0.31  molprobity  1.000  
 23   23  tp        -62.8   -44.9  Favored     ?    11   73.300     8  0.20    11  0.26  molprobity  1.000  
 24   24  mt        -81.8    -0.1  Favored     ?    11   66.740     8  0.17    11  0.17  molprobity  1.000  
 25   25  ?          75.1    18.7  Favored     ?     3   58.600     4  0.23     5  0.23  molprobity  1.000  
 26   26  mt        -79.1   -49.3  Favored     ?    11   57.570     8  0.18    11  0.49  molprobity  1.000  
 27   27  t60      -150.4   104.1  Favored     ?     7   56.900    11  0.13    15  0.25  molprobity  1.000  
 28   28  mtm180    -66.7   -43.8  Favored     ?    13   70.610    11  0.29    15  0.79  molprobity  1.000  
 29   29  Cg_exo    -60.4   156.7  Favored     ?     7   59.030     8  0.18    11  0.36  molprobity  1.000  
 30   30  p         -89.4   -33.2  Favored     ?     5   58.570     6  0.16     8  0.19  molprobity  1.000  
 31   31  mt-30    -126.8   -39.9  Allowed     ?     8   56.560     9  0.22    12  0.39  molprobity  1.000  
 32   32  t         -55.6   132.1  Favored     ?     5   55.460     6  0.16     8  0.25  molprobity  1.000  
 33   33  ?         -71.4   -26.4  Favored     ?     3   53.860     4  0.29     5  0.15  molprobity  1.000  
 34   34  mt       -114.5   132.8  Favored     ?    11   53.050     8  0.15    11  0.51  molprobity  1.000  
 35   35  t0       -115.3   145.5  Favored     ?     4   63.580     8  0.18    11  0.32  molprobity  1.000  
 36   36  p90      -151.4   175.1  Favored     ?     9   69.500    13  0.23    18  0.44  molprobity  1.000  
 37   37  ptp      -154.1   170.3  Favored     ?     9   74.170     8  0.24    10  0.33  molprobity  1.000  
 38   38  ?        -103.7   132.2  Favored     ?     2   83.810     5  0.16     7  0.29  molprobity  1.000  
 39   39  p-10      -95.1  -163.4  Allowed     ?     4   94.830     8  0.19    11  0.29  molprobity  1.000  
 40   40  ?         -61.5   100.4  Allowed     ?     1   97.560     4  0.29     5  0.35  molprobity  1.000  
 41   41  ?          96.1   102.0  Allowed     ?     3   97.350     4  0.27     5  0.90  molprobity  1.000  
 42   42  ?         -47.3    72.5  OUTLIER     ?     3   92.420     4  0.18     5  0.79  molprobity  1.000  
 43   43  ?        -121.0   126.1  Favored     ?     2   85.300     5  0.16     7  0.27  molprobity  1.000  
 44   44  mt        -64.5   129.5  Favored     ?    11   73.530     8  0.18    11  0.32  molprobity  1.000  
 45   45  m        -134.0   132.5  Favored     ?     9   69.530     7  0.19    10  0.42  molprobity  1.000  
 46   46  ?         -69.5   146.9  Favored     ?     5   61.680     5  0.16     7  0.23  molprobity  1.000  
 47   47  p        -119.9   -31.6  Favored     ?     7   63.380     7  0.24    10  0.60  molprobity  1.000  
 48   48  p        -159.7   146.0  Favored     ?     5   62.960     6  0.23     8  0.23  molprobity  1.000  
 49   49  pt       -129.5   155.9  Favored     ?    11   53.930     8  0.17    11  0.48  molprobity  1.000  
 50   50  t        -127.2   122.6  Favored     ?     9   53.840     7  0.14    10  0.45  molprobity  1.000  
 51   51  t        -113.4   101.4  Favored     ?     5   54.400     6  0.19     8  0.21  molprobity  1.000  
 52   52  p        -127.3    41.0  Favored     ?     5   60.020     6  0.16     8  0.19  molprobity  1.000  
 53   53  ?          68.0    14.2  Favored     ?     3   61.540     4  0.20     5  0.30  molprobity  1.000  
 54   54  ?         -71.6   -22.4  Favored     ?     3   63.850     4  0.24     5  0.27  molprobity  1.000  
 55   55  m-85     -124.1  -146.7  Allowed     ?     9   60.910    13  0.20    18  0.20  molprobity  1.000  
 56   56  ?         -85.1   -17.8  Favored     ?     2   73.070     5  0.15     7  0.51  molprobity  1.000  
 57   57  m-20      -53.4   130.6  Favored     ?     4   67.070     8  0.15    11  0.50  molprobity  1.000  
 58   58  t        -118.5   123.2  Favored     ?     9   78.600     7  0.17    10  0.43  molprobity  1.000  
 59   59  mt        -98.5   124.9  Favored     ?    11   79.410     8  0.16    11  0.42  molprobity  1.000  
 60   60  p30      -107.8   176.6  Favored     ?     4   82.240     8  0.17    11  0.38  molprobity  1.000  
 61   61  m-20      -86.5    61.7  Favored     ?     6   92.660     8  0.18    11  0.37  molprobity  1.000  
 62   62  t        -113.4   179.9  Favored     ?     5   69.940     6  0.27     8  0.25  molprobity  1.000  
 63   63  p-10      -97.4   -10.3  Favored     ?     4   63.230     8  0.13    11  0.26  molprobity  1.000  
 64   64  t        -109.4   127.6  Favored     ?     9   57.320     7  0.14    10  0.45  molprobity  1.000  
 65   65  tp       -119.1   135.5  Favored     ?    11   58.290     8  0.21    11  0.47  molprobity  1.000  
 66   66  mm       -100.9   118.2  Favored     ?    11   52.290     8  0.19    11  0.42  molprobity  1.000  
 67   67  t80      -115.5   125.3  Favored     ?     9   49.150    13  0.21    18  0.31  molprobity  1.000  
 68   68  m         -80.6   140.6  Favored     ?     7   50.050     7  0.26    10  0.52  molprobity  1.000  
 69   69  ?         -68.8   163.9  Favored     ?     3   54.490     4  0.23     5  0.33  molprobity  1.000  
 70   70  pt20      -94.0   155.0  Favored     ?     8   55.400     9  0.19    12  0.25  molprobity  1.000  
 71   71  ?         101.5  -177.5  Favored     ?     3   62.480     4  0.18     5  0.14  molprobity  1.000  
 72   72  ?          73.3     8.3  Favored     ?     3   75.400     4  0.21     5  0.41  molprobity  1.000  
 73   73  m120       55.9    74.9  Allowed     ?     6   81.660     8  0.21    11  0.34  molprobity  1.000  
 74   74  t        -133.2   106.1  Favored     ?     9   79.870     7  0.14    10  0.49  molprobity  1.000  
 75   75  ?         133.0   -76.9  Allowed     ?     3   80.870     4  0.20     5  0.23  molprobity  1.000  
 76   76  ?         -96.5    30.9  Favored     ?     2   85.680     5  0.17     7  0.26  molprobity  1.000  
 77   77  ?             ?       ?  ?           ?     2   85.790     4  0.14     4  0.19  molprobity  1.000  
 78   78  ?             ?       ?  ?           ?     1   90.800     5  0.30     8  0.67  molprobity  1.000  
 79   79  Cg_endo   -73.3   142.6  Favored     ?     7   91.400     8  0.14    12  0.61  molprobity  1.000  
 80   80  Cg_exo    -71.2   143.2  Favored     ?     7   85.780     8  0.20    11  0.36  molprobity  1.000  
 81   81  pttm     -146.5   171.6  Favored     ?    13   78.680     9  0.21    11  0.21  molprobity  1.000  
 82   82  m-20      -64.2   144.5  Favored     ?     4   77.420     8  0.13    11  0.29  molprobity  1.000  
 83   83  mt-30     -79.3   155.9  Favored     ?     8   64.940     9  0.23    12  0.32  molprobity  1.000  
 84   84  mm-40    -114.9   143.5  Favored     ?     8   74.030     9  0.22    12  0.31  molprobity  1.000  
 85   85  tp        -86.8    59.8  Favored     ?    11   72.010     8  0.20    11  0.44  molprobity  1.000  
 86   86  m        -131.2   165.4  Favored     ?     9   67.680     7  0.14    10  0.53  molprobity  1.000  
 87   87  p          53.2  -123.5  Favored     ?     7   66.790     7  0.30    10  0.63  molprobity  1.000  
 88   88  ?         -58.7   -43.1  Favored     ?     3   59.750     4  0.20     5  0.24  molprobity  1.000  
 89   89  m-20      -61.2   -42.8  Favored     ?     6   59.430     8  0.23    11  0.31  molprobity  1.000  
 90   90  tp        -66.6   -41.2  Favored     ?    11   69.450     8  0.19    11  0.34  molprobity  1.000  
 91   91  ?         -63.3   -44.5  Favored     ?     5   64.610     5  0.20     7  0.26  molprobity  1.000  
 92   92  mt        -60.6   -37.8  Favored     ?    11   59.570     8  0.18    11  0.39  molprobity  1.000  
 93   93  tttm      -66.3   -43.3  Favored     ?    13   75.660     9  0.22    11  0.23  molprobity  1.000  
 94   94  m-20      -68.2   -25.9  Favored     ?     6   72.610     8  0.20    11  0.29  molprobity  1.000  
 95   95  m         -67.2   -17.5  Favored     ?     5   70.830     6  0.17     8  0.22  molprobity  1.000  
 96   96  mt        -64.3   -50.4  Favored     ?    11   70.510     8  0.19    11  0.46  molprobity  1.000  
 97   97  m-80      -71.3   -45.7  Favored     ?     6   80.200     8  0.25    11  0.31  molprobity  1.000  
 98   98  mttp      -69.8   -18.2  Favored     ?    13   82.770     9  0.28    11  0.25  molprobity  1.000  
 99   99  mttm       57.1    36.2  Favored     ?    13   78.060     9  0.24    11  0.27  molprobity  1.000  
100  100  p-10      -89.6   147.8  Favored     ?     6   64.850     8  0.23    12  0.51  molprobity  1.000  
101  101  Cg_exo    -63.7   136.9  Favored     ?     7   64.680     8  0.16    11  0.22  molprobity  1.000  
102  102  t        -124.3   123.3  Favored     ?     9   60.370     7  0.14    10  0.42  molprobity  1.000  
103  103  mtm-85    -69.2   144.0  Favored     ?    13   60.830    11  0.15    14  0.26  molprobity  1.000  
104  104  t        -127.2   123.3  Favored     ?     9   56.860     7  0.17    10  0.44  molprobity  1.000  
105  105  mp       -115.3   116.6  Favored     ?    11   58.740     8  0.19    11  0.46  molprobity  1.000  
106  106  ttp85     -99.0   136.9  Favored     ?    13   76.670    11  0.13    14  0.30  molprobity  1.000  
107  107  ?         -85.7   133.9  Favored     ?     3   62.760     4  0.26     5  0.31  molprobity  1.000  
108  108  pt       -110.8   146.8  Favored     ?    11   77.410     8  0.16    11  0.45  molprobity  1.000  
109  109  ?             ?       ?  ?           ?     2   88.740     4  0.13     4  0.22  molprobity  1.000  
110  110  mmtm          ?       ?  ?           ?    12   81.550     9  0.21    11  0.30  molprobity  1.000  
111  111  m-80     -127.8   -16.1  Favored     ?     6   75.210     8  0.20    11  0.52  molprobity  1.000  
112  112  m-85     -135.3   143.5  Favored     ?     9   63.900    13  0.24    18  0.29  molprobity  1.000  
113  113  t        -134.2   135.7  Favored     ?     9   65.880     7  0.18    10  0.53  molprobity  1.000  
114  114  t80       -83.0   119.1  Favored     ?     9   62.050    13  0.24    18  0.27  molprobity  1.000  
115  115  m-20     -103.5     0.7  Favored     ?     4   71.630     8  0.23    11  0.65  molprobity  1.000  
116  116  ?         109.6  -162.7  Favored     ?     3   59.050     4  0.18     5  0.55  molprobity  1.000  
117  117  mt        -96.4   142.2  Favored     ?    11   61.220     8  0.19    11  0.43  molprobity  1.000  
118  118  m-85     -129.6   162.5  Favored     ?     9   55.580    13  0.25    18  0.32  molprobity  1.000  
119  119  mt       -119.4   133.0  Favored     ?    11   59.630     8  0.19    11  0.42  molprobity  1.000  
120  120  t         -78.6   101.8  Favored     ?     9   57.050     7  0.21    10  0.44  molprobity  1.000  
121  121  mt-10     -75.9   -40.2  Favored     ?     6   66.450     9  0.21    12  0.25  molprobity  1.000  
122  122  pt-20    -166.3  -176.3  Favored     ?     6   68.550     9  0.24    12  0.50  molprobity  1.000  
123  123  p90      -155.0   161.5  Favored     ?     9   67.830    13  0.26    18  0.18  molprobity  1.000  
124  124  p90      -159.6   172.6  Favored     ?    10   60.150    16  0.14    23  0.20  molprobity  1.000  
125  125  mt-10    -102.6   127.6  Favored     ?     6   76.310     9  0.17    12  0.40  molprobity  1.000  
126  126  mt-10    -110.7   150.7  Favored     ?     6   64.320     9  0.21    12  0.35  molprobity  1.000  
127  127  p        -118.5    95.7  Favored     ?     7   72.880     7  0.23    10  0.57  molprobity  1.000  
128  128  ?         -68.3  -173.3  Favored     ?     3   87.460     4  0.21     5  0.28  molprobity  1.000  
129  129  ?         -66.0   -16.3  Favored     ?     1   99.510     4  0.30     5  0.44  molprobity  1.000  
130  130  m80       -60.0   -40.7  Favored     ?     7  101.320    11  0.13    15  0.26  molprobity  1.000  
131  131  ?         100.8    11.0  Favored     ?     3   86.050     4  0.29     5  0.91  molprobity  1.000  
132  132  mmtt     -120.7   157.0  Favored     ?    13   76.690     9  0.20    11  0.27  molprobity  1.000  
133  133  mt        -78.4   135.3  Favored     ?    11   71.980     8  0.17    11  0.51  molprobity  1.000  
134  134  m        -126.0   148.8  Favored     ?     9   63.110     7  0.18    10  0.42  molprobity  1.000  
135  135  m-85      -96.8   142.8  Favored     ?     9   63.630    12  0.34    16  0.26  molprobity  1.000  
136  136  mmtt     -124.0   123.9  Favored     ?    13   53.450     9  0.23    11  0.23  molprobity  1.000  
137  137  m-85     -110.6   119.7  Favored     ?     9   54.350    12  0.34    16  0.25  molprobity  1.000  
138  138  tttt      -90.9   109.7  Favored     ?    13   60.910     9  0.22    11  0.23  molprobity  1.000  
139  139  mp       -112.5   140.2  Favored     ?    11   53.400     8  0.21    11  0.50  molprobity  1.000  
140  140  ttm-85   -117.0   135.8  Favored     ?    13   56.260    11  0.15    14  0.33  molprobity  1.000  
141  141  ttt-85    -70.2   127.2  Favored     ?    13   58.050    11  0.15    14  0.36  molprobity  1.000  
142  142  mt        -64.9   124.3  Favored     ?    11   60.220     8  0.14    12  0.66  molprobity  1.000  
143  143  Cg_exo    -59.0   143.8  Favored     ?     7   59.400     8  0.13    11  0.24  molprobity  1.000  
144  144  ?         115.9   -25.7  Favored     ?     3   67.120     4  0.25     5  0.29  molprobity  1.000  
145  145  mt-30     -74.3   152.2  Favored     ?     8   68.270     9  0.21    13  0.48  molprobity  1.000  
146  146  Cg_exo    -56.2   140.9  Favored     ?     7   68.000     8  0.14    11  0.20  molprobity  1.000  
147  147  ?         -81.6   154.7  Favored     ?     2   78.190     5  0.23     7  0.30  molprobity  1.000  
148  148  mt       -133.0   134.1  Favored     ?    11   87.250     8  0.29    12  0.70  molprobity  1.000  
149  149  Cg_endo   -92.0   150.1  Favored     ?     7  102.070     8  0.14    11  0.44  molprobity  1.000  
150  150  ?             ?       ?  ?           ?     2  103.910     4  0.29     4  0.24  molprobity  1.000  
151  151  ?             ?       ?  ?           ?    12   70.700    21  0.55    33  0.57  molprobity  1.000  
152  152  ?             ?       ?  ?           ?    11   77.310    21  0.60    32  0.83  molprobity  1.000  
153  153  ?             ?       ?  ?           ?    12   69.580    22  0.43    34  1.24  molprobity  1.000  
154  154  ?             ?       ?  ?           ?    11   61.020    23  0.59    33  0.77  molprobity  1.000  
155  155  ?             ?       ?  ?           ?    13   56.310    18  2.40    23  1.27  mogul       1.000  
156  156  ?             ?       ?  ?           ?    11   57.210    25  0.39    39  0.56  molprobity  1.000  
157  157  ?             ?       ?  ?           ?    12   59.120    22  0.72    34  1.31  molprobity  1.000  
158  158  ?             ?       ?  ?           ?    11   60.310    24  0.45    37  0.70  molprobity  1.000  
159  159  ?             ?       ?  ?           ?    11   61.010    25  0.64    39  0.83  molprobity  1.000  
160  160  ?             ?       ?  ?           ?    13   68.820    21  0.49    30  1.31  molprobity  1.000  
161  161  ?             ?       ?  ?           ?     ?   69.250     ?     ?     ?     ?  ?           1.000  
162  162  ?             ?       ?  ?           ?     ?   80.240     ?     ?     ?     ?  ?           1.000  
163  163  ?             ?       ?  ?           ?     ?   72.250     ?     ?     ?     ?  ?           1.000  
164  164  ?             ?       ?  ?           ?     ?   69.730     ?     ?     ?     ?  ?           1.000  
165  165  ?             ?       ?  ?           ?     ?   68.020     ?     ?     ?     ?  ?           1.000  
166  166  ?             ?       ?  ?           ?     ?   65.360     ?     ?     ?     ?  ?           1.000  
167  167  ?             ?       ?  ?           ?     ?   57.850     ?     ?     ?     ?  ?           1.000  
168  168  ?             ?       ?  ?           ?     ?   53.400     ?     ?     ?     ?  ?           1.000  
169  169  ?             ?       ?  ?           ?     ?   70.390     ?     ?     ?     ?  ?           1.000  
170  170  ?             ?       ?  ?           ?     ?   71.990     ?     ?     ?     ?  ?           1.000  
171  171  ?             ?       ?  ?           ?     ?   73.420     ?     ?     ?     ?  ?           1.000  
172  172  ?             ?       ?  ?           ?     ?   57.270     ?     ?     ?     ?  ?           1.000  
173  173  ?             ?       ?  ?           ?     ?   86.020     ?     ?     ?     ?  ?           1.000  
174  174  ?             ?       ?  ?           ?     ?   82.220     ?     ?     ?     ?  ?           1.000  
175  175  ?             ?       ?  ?           ?     ?   68.350     ?     ?     ?     ?  ?           1.000  
176  176  ?             ?       ?  ?           ?     ?   60.570     ?     ?     ?     ?  ?           1.000  
177  177  ?             ?       ?  ?           ?     ?   64.750     ?     ?     ?     ?  ?           1.000  
178  178  ?             ?       ?  ?           ?     ?   60.370     ?     ?     ?     ?  ?           1.000  
179  179  ?             ?       ?  ?           ?     ?   79.900     ?     ?     ?     ?  ?           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   18  HG3     1  0.40  2.03  
 2   41  O       2  0.52  2.42  
 3   43  N       2  0.52  2.42  
 4   44  HD12    3  0.52  1.91  
 5   50  HG22    4  0.55  1.88  
 6   79  HA      5  0.41  1.77  
 7   80  HD3     5  0.41  1.77  
 8   87  OG1     6  0.41  2.54  
 9   88  N       6  0.41  2.54  
10   90  HD23    3  0.52  1.91  
11  105  HB      4  0.55  1.88  
12  127  HG22    7  0.47  1.96  
13  133  HD23    7  0.47  1.96  
14  141  NH2     8  0.51  2.35  
15  146  O       8  0.51  2.35  
16  156  "H4'"   1  0.40  2.03  
#
loop_
_pdbx_vrpt_instance_mogul_bond_outliers.ordinal
_pdbx_vrpt_instance_mogul_bond_outliers.instance_id
_pdbx_vrpt_instance_mogul_bond_outliers.atom_1
_pdbx_vrpt_instance_mogul_bond_outliers.atom_2
_pdbx_vrpt_instance_mogul_bond_outliers.obsval
_pdbx_vrpt_instance_mogul_bond_outliers.mean
_pdbx_vrpt_instance_mogul_bond_outliers.numobs
_pdbx_vrpt_instance_mogul_bond_outliers.stdev
_pdbx_vrpt_instance_mogul_bond_outliers.Zscore
_pdbx_vrpt_instance_mogul_bond_outliers.mindiff
1  155  "O4'"  "C4'"  1.38  1.45  4334  0.02  -2.99  0.00  
2  155  "C3'"  "C4'"  1.46  1.53   561  0.03  -2.51  0.00  
3  155  "C2'"  "C3'"  1.40  1.52   898  0.03  -4.70  0.01  
4  155  "C1'"  N1     1.54  1.48   903  0.03   2.44  0.00  
5  155  C2     N1     1.34  1.40   396  0.02  -2.60  0.00  
6  155  O2     C2     1.17  1.23   821  0.02  -3.37  0.00  
7  155  C4     N4     1.49  1.34   961  0.03   6.05  0.01  
#
loop_
_pdbx_vrpt_instance_mogul_angle_outliers.ordinal
_pdbx_vrpt_instance_mogul_angle_outliers.instance_id
_pdbx_vrpt_instance_mogul_angle_outliers.atom_1
_pdbx_vrpt_instance_mogul_angle_outliers.atom_2
_pdbx_vrpt_instance_mogul_angle_outliers.atom_3
_pdbx_vrpt_instance_mogul_angle_outliers.obsval
_pdbx_vrpt_instance_mogul_angle_outliers.mean
_pdbx_vrpt_instance_mogul_angle_outliers.numobs
_pdbx_vrpt_instance_mogul_angle_outliers.stdev
_pdbx_vrpt_instance_mogul_angle_outliers.Zscore
_pdbx_vrpt_instance_mogul_angle_outliers.mindiff
1  155  "O5'"  "C5'"  "C4'"  118.71  108.99  486  3.40  2.86  0.07  
2  155  "O4'"  "C1'"  N1     111.97  107.86  804  1.79  2.30  0.16  
3  155  O5     C5M    C5     117.72  111.03  101  2.61  2.56  2.45  
#
loop_
_pdbx_vrpt_instance_mogul_torsion_outliers.ordinal
_pdbx_vrpt_instance_mogul_torsion_outliers.instance_id
_pdbx_vrpt_instance_mogul_torsion_outliers.atom_1
_pdbx_vrpt_instance_mogul_torsion_outliers.atom_2
_pdbx_vrpt_instance_mogul_torsion_outliers.atom_3
_pdbx_vrpt_instance_mogul_torsion_outliers.atom_4
_pdbx_vrpt_instance_mogul_torsion_outliers.obsval
_pdbx_vrpt_instance_mogul_torsion_outliers.mean
_pdbx_vrpt_instance_mogul_torsion_outliers.numobs
_pdbx_vrpt_instance_mogul_torsion_outliers.stdev
_pdbx_vrpt_instance_mogul_torsion_outliers.mindiff
_pdbx_vrpt_instance_mogul_torsion_outliers.local_density
1  155  C4  C5  C5M  O5  -114.23  50.63  44   9.71  14.48  0.00  
2  155  C6  C5  C5M  O5    65.75  50.19  42  11.50  12.69  0.00  
#
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   9  0.664  0.295   1.256  
  2    2   8  0.936  0.258   1.022  
  3    3   8  0.957  0.254   0.963  
  4    4   4  0.929  0.113  -0.632  
  5    5   7  0.943  0.166  -0.047  
  6    6   7  0.929  0.127  -0.799  
  7    7   7  0.961  0.089  -1.121  
  8    8   4  0.901  0.113  -0.632  
  9    9   7  0.899  0.205   0.345  
 10   10   9  0.876  0.236   0.355  
 11   11   7  0.952  0.160  -0.315  
 12   12   4  0.954  0.096  -0.858  
 13   13   8  0.922  0.164  -0.192  
 14   14   9  0.883  0.232   0.307  
 15   15  11  0.926  0.199   0.235  
 16   16   9  0.933  0.177  -0.225  
 17   17  12  0.953  0.189   0.198  
 18   18  11  0.961  0.163  -0.515  
 19   19   8  0.917  0.184   0.170  
 20   20   9  0.947  0.164  -0.511  
 21   21   8  0.962  0.163  -0.407  
 22   22   8  0.952  0.092  -1.161  
 23   23   8  0.921  0.190  -0.024  
 24   24   8  0.967  0.209   0.245  
 25   25   4  0.959  0.142  -0.247  
 26   26   8  0.965  0.213   0.356  
 27   27  10  0.966  0.186   0.172  
 28   28  11  0.921  0.283   0.981  
 29   29   7  0.970  0.178   0.160  
 30   30   6  0.957  0.178   0.171  
 31   31   9  0.929  0.216   0.265  
 32   32   6  0.925  0.197   0.436  
 33   33   4  0.945  0.145  -0.207  
 34   34   8  0.979  0.200   0.163  
 35   35   8  0.947  0.158  -0.272  
 36   36  12  0.957  0.137  -0.595  
 37   37   8  0.864  0.180   0.111  
 38   38   5  0.926  0.099  -1.385  
 39   39   8  0.868  0.196   0.235  
 40   40   4  0.820  0.194   0.208  
 41   41   4  0.882  0.242   1.081  
 42   42   4  0.828  0.317   2.077  
 43   43   5  0.879  0.154  -0.632  
 44   44   8  0.951  0.178  -0.194  
 45   45   7  0.924  0.218   0.535  
 46   46   5  0.976  0.185   0.260  
 47   47   7  0.925  0.222   0.770  
 48   48   6  0.933  0.204   0.533  
 49   49   8  0.938  0.182  -0.104  
 50   50   7  0.981  0.138  -0.638  
 51   51   6  0.953  0.151  -0.205  
 52   52   6  0.888  0.135  -0.428  
 53   53   4  0.935  0.123  -0.499  
 54   54   4  0.969  0.136  -0.327  
 55   55  12  0.923  0.163  -0.198  
 56   56   5  0.955  0.086  -1.243  
 57   57   8  0.935  0.136  -0.566  
 58   58   7  0.905  0.122  -0.872  
 59   59   8  0.917  0.251   0.841  
 60   60   8  0.888  0.127  -0.686  
 61   61   8  0.880  0.244   0.927  
 62   62   6  0.929  0.139  -0.372  
 63   63   8  0.895  0.136  -0.566  
 64   64   7  0.945  0.151  -0.447  
 65   65   8  0.956  0.188  -0.052  
 66   66   8  0.965  0.196   0.104  
 67   67  12  0.963  0.166  -0.152  
 68   68   7  0.971  0.166  -0.047  
 69   69   4  0.973  0.128  -0.433  
 70   70   9  0.957  0.142  -0.664  
 71   71   4  0.943  0.156  -0.061  
 72   72   4  0.961  0.135  -0.340  
 73   73   8  0.882  0.282   1.449  
 74   74   7  0.795  0.406   3.292  
 75   75   4  0.718  0.238   1.028  
 76   76   5  0.713  0.176  -0.507  
 77   77   5  0.753  0.135  -0.975  
 78   78   5  0.871  0.178  -0.343  
 79   79   7  0.901  0.219   0.750  
 80   80   7  0.959  0.224   0.822  
 81   81   9  0.942  0.223   0.029  
 82   82   8  0.920  0.157  -0.286  
 83   83   9  0.959  0.190  -0.061  
 84   84   9  0.906  0.233   0.478  
 85   85   8  0.953  0.189  -0.038  
 86   86   7  0.964  0.173  -0.125  
 87   87   7  0.917  0.156  -0.192  
 88   88   4  0.952  0.161   0.005  
 89   89   8  0.952  0.168  -0.117  
 90   90   8  0.956  0.203   0.160  
 91   91   5  0.984  0.144  -0.333  
 92   92   8  0.978  0.190  -0.024  
 93   93   9  0.913  0.253   0.371  
 94   94   8  0.932  0.127  -0.680  
 95   95   6  0.944  0.146  -0.274  
 96   96   8  0.970  0.153  -0.533  
 97   97   8  0.921  0.124  -0.721  
 98   98   9  0.863  0.269   0.553  
 99   99   9  0.956  0.169  -0.587  
100  100   8  0.927  0.149  -0.378  
101  101   7  0.911  0.195   0.404  
102  102   7  0.954  0.252   1.034  
103  103  11  0.965  0.199  -0.066  
104  104   7  0.961  0.174  -0.110  
105  105   8  0.966  0.222   0.489  
106  106  11  0.887  0.274   0.869  
107  107   4  0.943  0.098  -0.831  
108  108   8  0.946  0.261   1.067  
109  109   5  0.854  0.223   0.029  
110  110   9  0.691  0.229   0.097  
111  111   8  0.938  0.147  -0.405  
112  112  12  0.951  0.145  -0.473  
113  113   7  0.956  0.210   0.418  
114  114  12  0.958  0.218   0.640  
115  115   8  0.789  0.313   1.797  
116  116   4  0.933  0.169   0.112  
117  117   8  0.963  0.236   0.628  
118  118  12  0.957  0.172  -0.061  
119  119   8  0.963  0.181  -0.152  
120  120   7  0.972  0.156  -0.374  
121  121   9  0.930  0.134  -0.872  
122  122   9  0.864  0.192  -0.174  
123  123  12  0.928  0.163  -0.198  
124  124  14  0.968  0.172  -0.009  
125  125   9  0.904  0.233   0.319  
126  126   9  0.932  0.195  -0.138  
127  127   7  0.917  0.157  -0.178  
128  128   4  0.800  0.262   1.347  
129  129   4  0.517  0.426   3.625  
130  130  10  0.728  0.359   2.647  
131  131   4  0.813  0.242   1.081  
132  132   9  0.877  0.215  -0.063  
133  133   8  0.912  0.223   0.444  
134  134   7  0.956  0.215   0.491  
135  135  11  0.939  0.255   1.042  
136  136   9  0.964  0.182  -0.439  
137  137  11  0.960  0.139  -0.630  
138  138   9  0.974  0.180  -0.462  
139  139   8  0.960  0.172  -0.279  
140  140  11  0.952  0.124  -1.001  
141  141  11  0.928  0.150  -0.677  
142  142   8  0.929  0.155  -0.504  
143  143   7  0.926  0.190   0.332  
144  144   4  0.896  0.226   0.869  
145  145   9  0.929  0.139  -0.701  
146  146   7  0.955  0.120  -0.675  
147  147   5  0.902  0.162  -0.535  
148  148   8  0.811  0.291   1.409  
149  149   7  0.848  0.274   1.541  
150  150   5  0.859  0.259   1.299  
151  151  18  0.889  0.144  -0.493  
152  152  19  0.880  0.155  -0.402  
153  153  20  0.875  0.175  -0.088  
154  154  21  0.944  0.159  -0.262  
155  155  21  0.961  0.143       ?  
156  156  22  0.952  0.156  -0.289  
157  157  20  0.974  0.172  -0.131  
158  158  21  0.960  0.166  -0.154  
159  159  22  0.948  0.162  -0.188  
160  160  20  0.912  0.170  -0.159  
161  161   1  0.750  0.325       ?  
162  162   1  0.681  0.266       ?  
163  163   1  0.822  0.327       ?  
164  164   1  0.541  0.214       ?  
165  165   1  0.864  0.100       ?  
166  166   1  0.885  0.267       ?  
167  167   1  0.741  0.244       ?  
168  168   1  0.865  0.249       ?  
169  169   1  0.276  0.300       ?  
170  170   1  0.381  0.268       ?  
171  171   1  0.856  0.809       ?  
172  172   1  0.887  0.418       ?  
173  173   1  0.587  0.321       ?  
174  174   1  0.813  0.221       ?  
175  175   1  0.743  0.403       ?  
176  176   1  0.925  0.116       ?  
177  177   1  0.522  0.556       ?  
178  178   1  0.815  0.425       ?  
179  179   1  0.054  0.960       ?  
#
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        "1.8.5 (274361), 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  
##
