data_2LPA

loop_
_pdbx_vrpt_database.id
_pdbx_vrpt_database.code
PDB   2LPA   
BMRB  18240  
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   nmr
#
_pdbx_vrpt_summary.entry_id                    2LPA
_pdbx_vrpt_summary.PDB_deposition_date         2012-02-06
_pdbx_vrpt_summary.PDB_revision_number         2
_pdbx_vrpt_summary.PDB_revision_date           2023-06-14
_pdbx_vrpt_summary.RNA_suiteness               0.58
_pdbx_vrpt_summary.report_creation_date        2023-06-05:09:36
_pdbx_vrpt_summary.attempted_validation_steps  molprobity,validation-pack,coreclust,chemicalshiftanalysis,restraintsanalysis,percentiles,writepdf,writexml,writecif
_pdbx_vrpt_summary.ligands_for_buster_report   N
#
_pdbx_vrpt_entity.id           1
_pdbx_vrpt_entity.type         polymer
_pdbx_vrpt_entity.description  "RNA (5'-R(*GP*AP*GP*GP*AP*CP*AP*UP*AP*GP*UP*CP*UP*UP*C)-3')"
#
_pdbx_vrpt_asym.label_asym_id  A
_pdbx_vrpt_asym.entity_id      1
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all  pdb    
2  nmr  x-ray  
#
loop_
_pdbx_vrpt_percentile_type.id
_pdbx_vrpt_percentile_type.type
1  all_atom_clashscore   
2  RNAsuiteness_percent  
#
loop_
_pdbx_vrpt_percentile_conditions.id
_pdbx_vrpt_percentile_conditions.percentile_list_id
_pdbx_vrpt_percentile_conditions.type_id
_pdbx_vrpt_percentile_conditions.rank
_pdbx_vrpt_percentile_conditions.number_entries_total
_pdbx_vrpt_percentile_conditions.res_high
_pdbx_vrpt_percentile_conditions.res_low
1  1  1   99.94  158937  ?     ?     
2  2  1  100.00   12864  ?     ?     
3  1  2   67.69    4643  ?     ?     
4  2  2   79.44     676  ?     ?     
#
loop_
_pdbx_vrpt_summary_entity_geometry.ordinal
_pdbx_vrpt_summary_entity_geometry.PDB_model_num
_pdbx_vrpt_summary_entity_geometry.entity_id
_pdbx_vrpt_summary_entity_geometry.label_asym_id
_pdbx_vrpt_summary_entity_geometry.auth_asym_id
_pdbx_vrpt_summary_entity_geometry.angles_RMSZ
_pdbx_vrpt_summary_entity_geometry.bonds_RMSZ
_pdbx_vrpt_summary_entity_geometry.num_bonds_RMSZ
_pdbx_vrpt_summary_entity_geometry.num_angles_RMSZ
 1   1  1  A  A  1.85  1.61  354  550  
 2   2  1  A  A  1.85  1.62  354  550  
 3   3  1  A  A  1.85  1.63  354  550  
 4   4  1  A  A  1.84  1.63  354  550  
 5   5  1  A  A  1.87  1.62  354  550  
 6   6  1  A  A  1.89  1.61  354  550  
 7   7  1  A  A  1.85  1.61  354  550  
 8   8  1  A  A  1.86  1.61  354  550  
 9   9  1  A  A  1.86  1.62  354  550  
10  10  1  A  A  1.85  1.63  354  550  
#
_pdbx_vrpt_summary_geometry.ordinal                 1
_pdbx_vrpt_summary_geometry.clashscore_full_length  0.00
_pdbx_vrpt_summary_geometry.num_H_reduce            1630
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ          3540
_pdbx_vrpt_summary_geometry.bonds_RMSZ              1.62
_pdbx_vrpt_summary_geometry.num_angles_RMSZ         5500
_pdbx_vrpt_summary_geometry.angles_RMSZ             1.86
#
_pdbx_vrpt_summary_nmr.exp_method                               nmr
_pdbx_vrpt_summary_nmr.ordinal                                  1
_pdbx_vrpt_summary_nmr.chemical_shift_completeness              34.16
_pdbx_vrpt_summary_nmr.chemical_shift_completeness_full_length  34.16
#
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_bond_outliers
_pdbx_vrpt_model_instance.count_angle_outliers
  1   1  1  A   1  G  A   1  .  ?        ?     1  
  2   1  1  A   2  A  A   2  .  ?        ?     ?  
  3   1  1  A   3  G  A   3  .  ?        ?     1  
  4   1  1  A   4  G  A   4  .  ?        ?     1  
  5   1  1  A   5  A  A   5  .  ?        1     ?  
  6   1  1  A   6  C  A   6  .  ?        ?     1  
  7   1  1  A   7  A  A   7  .  ?        ?     ?  
  8   1  1  A   8  U  A   8  .  ?        ?     ?  
  9   1  1  A   9  A  A   9  .  ?        1     ?  
 10   1  1  A  10  G  A  10  .  ?        ?     ?  
 11   1  1  A  11  U  A  11  .  ?        ?     1  
 12   1  1  A  12  C  A  12  .  ?        ?     2  
 13   1  1  A  13  U  A  13  .  ?        ?     1  
 14   1  1  A  14  U  A  14  .  ?        ?     1  
 15   1  1  A  15  C  A  15  .  ?        ?     1  
 16   2  1  A   1  G  A   1  .  ?        ?     1  
 17   2  1  A   2  A  A   2  .  ?        1     ?  
 18   2  1  A   3  G  A   3  .  ?        ?     ?  
 19   2  1  A   4  G  A   4  .  ?        ?     1  
 20   2  1  A   5  A  A   5  .  ?        ?     ?  
 21   2  1  A   6  C  A   6  .  ?        ?     1  
 22   2  1  A   7  A  A   7  .  ?        ?     ?  
 23   2  1  A   8  U  A   8  .  ?        ?     ?  
 24   2  1  A   9  A  A   9  .  ?        1     ?  
 25   2  1  A  10  G  A  10  .  ?        ?     ?  
 26   2  1  A  11  U  A  11  .  ?        ?     1  
 27   2  1  A  12  C  A  12  .  ?        ?     2  
 28   2  1  A  13  U  A  13  .  ?        ?     1  
 29   2  1  A  14  U  A  14  .  ?        ?     1  
 30   2  1  A  15  C  A  15  .  ?        ?     2  
 31   3  1  A   1  G  A   1  .  ?        ?     1  
 32   3  1  A   2  A  A   2  .  ?        1     ?  
 33   3  1  A   3  G  A   3  .  ?        ?     ?  
 34   3  1  A   4  G  A   4  .  ?        ?     1  
 35   3  1  A   5  A  A   5  .  ?        1     ?  
 36   3  1  A   6  C  A   6  .  ?        ?     1  
 37   3  1  A   7  A  A   7  .  ?        ?     ?  
 38   3  1  A   8  U  A   8  .  ?        ?     ?  
 39   3  1  A   9  A  A   9  .  ?        1     ?  
 40   3  1  A  10  G  A  10  .  ?        ?     1  
 41   3  1  A  11  U  A  11  .  ?        ?     1  
 42   3  1  A  12  C  A  12  .  ?        ?     2  
 43   3  1  A  13  U  A  13  .  ?        ?     1  
 44   3  1  A  14  U  A  14  .  ?        ?     1  
 45   3  1  A  15  C  A  15  .  ?        ?     1  
 46   4  1  A   1  G  A   1  .  ?        ?     1  
 47   4  1  A   2  A  A   2  .  ?        1     ?  
 48   4  1  A   3  G  A   3  .  ?        ?     ?  
 49   4  1  A   4  G  A   4  .  ?        ?     ?  
 50   4  1  A   5  A  A   5  .  ?        1     ?  
 51   4  1  A   6  C  A   6  .  ?        ?     1  
 52   4  1  A   7  A  A   7  .  ?        ?     ?  
 53   4  1  A   8  U  A   8  .  ?        ?     ?  
 54   4  1  A   9  A  A   9  .  ?        1     ?  
 55   4  1  A  10  G  A  10  .  ?        ?     1  
 56   4  1  A  11  U  A  11  .  ?        ?     1  
 57   4  1  A  12  C  A  12  .  ?        ?     2  
 58   4  1  A  13  U  A  13  .  ?        ?     1  
 59   4  1  A  14  U  A  14  .  ?        ?     1  
 60   4  1  A  15  C  A  15  .  ?        ?     1  
 61   5  1  A   1  G  A   1  .  ?        ?     ?  
 62   5  1  A   2  A  A   2  .  ?        1     ?  
 63   5  1  A   3  G  A   3  .  ?        ?     1  
 64   5  1  A   4  G  A   4  .  ?        ?     1  
 65   5  1  A   5  A  A   5  .  ?        ?     ?  
 66   5  1  A   6  C  A   6  .  ?        ?     1  
 67   5  1  A   7  A  A   7  .  ?        ?     ?  
 68   5  1  A   8  U  A   8  .  ?        ?     ?  
 69   5  1  A   9  A  A   9  .  ?        1     ?  
 70   5  1  A  10  G  A  10  .  ?        ?     1  
 71   5  1  A  11  U  A  11  .  ?        ?     1  
 72   5  1  A  12  C  A  12  .  ?        ?     2  
 73   5  1  A  13  U  A  13  .  ?        ?     1  
 74   5  1  A  14  U  A  14  .  ?        ?     ?  
 75   5  1  A  15  C  A  15  .  ?        ?     1  
 76   6  1  A   1  G  A   1  .  ?        ?     ?  
 77   6  1  A   2  A  A   2  .  ?        1     ?  
 78   6  1  A   3  G  A   3  .  ?        ?     1  
 79   6  1  A   4  G  A   4  .  ?        ?     1  
 80   6  1  A   5  A  A   5  .  ?        1     ?  
 81   6  1  A   6  C  A   6  .  ?        ?     1  
 82   6  1  A   7  A  A   7  .  ?        ?     ?  
 83   6  1  A   8  U  A   8  .  ?        ?     ?  
 84   6  1  A   9  A  A   9  .  ?        1     ?  
 85   6  1  A  10  G  A  10  .  ?        ?     1  
 86   6  1  A  11  U  A  11  .  ?        ?     1  
 87   6  1  A  12  C  A  12  .  ?        ?     2  
 88   6  1  A  13  U  A  13  .  ?        ?     1  
 89   6  1  A  14  U  A  14  .  ?        ?     1  
 90   6  1  A  15  C  A  15  .  ?        ?     1  
 91   7  1  A   1  G  A   1  .  ?        ?     1  
 92   7  1  A   2  A  A   2  .  ?        ?     ?  
 93   7  1  A   3  G  A   3  .  ?        ?     ?  
 94   7  1  A   4  G  A   4  .  ?        ?     1  
 95   7  1  A   5  A  A   5  .  ?        ?     ?  
 96   7  1  A   6  C  A   6  .  ?        ?     1  
 97   7  1  A   7  A  A   7  .  ?        ?     ?  
 98   7  1  A   8  U  A   8  .  ?        ?     ?  
 99   7  1  A   9  A  A   9  .  ?        1     ?  
100   7  1  A  10  G  A  10  .  ?        ?     ?  
101   7  1  A  11  U  A  11  .  ?        ?     1  
102   7  1  A  12  C  A  12  .  ?        ?     2  
103   7  1  A  13  U  A  13  .  ?        ?     1  
104   7  1  A  14  U  A  14  .  ?        ?     1  
105   7  1  A  15  C  A  15  .  ?        ?     1  
106   8  1  A   1  G  A   1  .  ?        ?     ?  
107   8  1  A   2  A  A   2  .  ?        ?     ?  
108   8  1  A   3  G  A   3  .  ?        ?     ?  
109   8  1  A   4  G  A   4  .  ?        ?     1  
110   8  1  A   5  A  A   5  .  ?        1     ?  
111   8  1  A   6  C  A   6  .  ?        ?     1  
112   8  1  A   7  A  A   7  .  ?        ?     ?  
113   8  1  A   8  U  A   8  .  ?        ?     1  
114   8  1  A   9  A  A   9  .  ?        ?     ?  
115   8  1  A  10  G  A  10  .  ?        ?     1  
116   8  1  A  11  U  A  11  .  ?        ?     1  
117   8  1  A  12  C  A  12  .  ?        ?     2  
118   8  1  A  13  U  A  13  .  ?        ?     1  
119   8  1  A  14  U  A  14  .  ?        ?     1  
120   8  1  A  15  C  A  15  .  ?        ?     1  
121   9  1  A   1  G  A   1  .  ?        ?     1  
122   9  1  A   2  A  A   2  .  ?        1     ?  
123   9  1  A   3  G  A   3  .  ?        ?     ?  
124   9  1  A   4  G  A   4  .  ?        ?     ?  
125   9  1  A   5  A  A   5  .  ?        ?     ?  
126   9  1  A   6  C  A   6  .  ?        ?     1  
127   9  1  A   7  A  A   7  .  ?        1     ?  
128   9  1  A   8  U  A   8  .  ?        ?     1  
129   9  1  A   9  A  A   9  .  ?        ?     ?  
130   9  1  A  10  G  A  10  .  ?        ?     2  
131   9  1  A  11  U  A  11  .  ?        ?     1  
132   9  1  A  12  C  A  12  .  ?        ?     1  
133   9  1  A  13  U  A  13  .  ?        ?     1  
134   9  1  A  14  U  A  14  .  ?        ?     1  
135   9  1  A  15  C  A  15  .  ?        ?     1  
136  10  1  A   1  G  A   1  .  ?        ?     1  
137  10  1  A   2  A  A   2  .  ?        1     ?  
138  10  1  A   3  G  A   3  .  ?        ?     ?  
139  10  1  A   4  G  A   4  .  ?        ?     ?  
140  10  1  A   5  A  A   5  .  ?        ?     ?  
141  10  1  A   6  C  A   6  .  ?        ?     1  
142  10  1  A   7  A  A   7  .  ?        ?     ?  
143  10  1  A   8  U  A   8  .  ?        ?     ?  
144  10  1  A   9  A  A   9  .  ?        1     ?  
145  10  1  A  10  G  A  10  .  ?        ?     1  
146  10  1  A  11  U  A  11  .  ?        ?     1  
147  10  1  A  12  C  A  12  .  ?        ?     2  
148  10  1  A  13  U  A  13  .  ?        ?     1  
149  10  1  A  14  U  A  14  .  ?        ?     1  
150  10  1  A  15  C  A  15  .  ?        ?     1  
#
loop_
_pdbx_vrpt_model_instance_geometry.ordinal
_pdbx_vrpt_model_instance_geometry.instance_id
_pdbx_vrpt_model_instance_geometry.RNA_score
_pdbx_vrpt_model_instance_geometry.RNA_suite
_pdbx_vrpt_model_instance_geometry.num_H_reduce
_pdbx_vrpt_model_instance_geometry.num_bonds_RMSZ
_pdbx_vrpt_model_instance_geometry.bonds_RMSZ
_pdbx_vrpt_model_instance_geometry.num_angles_RMSZ
_pdbx_vrpt_model_instance_geometry.angles_RMSZ
_pdbx_vrpt_model_instance_geometry.program_for_bond_angle_geometry
  1    1  0.00  NotAvailable       12  23  1.51  37  1.95  molprobity  
  2    2  0.80  Rotameric          11  25  1.47  39  1.63  molprobity  
  3    3  0.77  Rotameric          11  26  1.50  41  2.03  molprobity  
  4    4  0.74  Rotameric          11  26  1.47  41  2.04  molprobity  
  5    5  0.77  Rotameric          11  25  1.47  39  1.57  molprobity  
  6    6  0.83  Rotameric          11  22  1.71  34  1.90  molprobity  
  7    7  0.46  Rotameric          11  25  1.50  39  1.44  molprobity  
  8    8  0.27  Rotameric          10  22  1.78  34  1.71  molprobity  
  9    9  0.00  NonRotameric       11  25  1.54  39  1.73  molprobity  
 10   10  0.00  NonRotameric       11  26  1.57  41  2.24  molprobity  
 11   11  0.07  Rotameric          10  22  1.77  34  1.80  molprobity  
 12   12  0.84  Rotameric          11  22  1.66  34  2.01  molprobity  
 13   13  0.80  Rotameric          10  22  1.82  34  1.93  molprobity  
 14   14  0.75  Rotameric          10  22  1.75  34  1.79  molprobity  
 15   15  0.74  Rotameric          12  21  1.71  30  1.86  molprobity  
 16   16  0.00  NotAvailable       12  23  1.53  37  1.95  molprobity  
 17   17  0.79  Rotameric          11  25  1.52  39  1.69  molprobity  
 18   18  0.74  Rotameric          11  26  1.50  41  2.02  molprobity  
 19   19  0.73  Rotameric          11  26  1.51  41  2.02  molprobity  
 20   20  0.76  Rotameric          11  25  1.45  39  1.58  molprobity  
 21   21  0.82  Rotameric          11  22  1.65  34  1.90  molprobity  
 22   22  0.52  Rotameric          11  25  1.49  39  1.45  molprobity  
 23   23  0.28  Rotameric          10  22  1.76  34  1.70  molprobity  
 24   24  0.00  Triaged/NotBinned  11  25  1.65  39  1.69  molprobity  
 25   25  0.45  Rotameric          11  26  1.49  41  2.10  molprobity  
 26   26  0.00  NonRotameric       10  22  1.78  34  1.84  molprobity  
 27   27  0.53  Rotameric          11  22  1.70  34  2.09  molprobity  
 28   28  0.70  Rotameric          10  22  1.83  34  1.96  molprobity  
 29   29  0.77  Rotameric          10  22  1.73  34  1.80  molprobity  
 30   30  0.78  Rotameric          12  21  1.72  30  1.88  molprobity  
 31   31  0.00  NotAvailable       12  23  1.52  37  1.99  molprobity  
 32   32  0.79  Rotameric          11  25  1.52  39  1.68  molprobity  
 33   33  0.74  Rotameric          11  26  1.50  41  2.01  molprobity  
 34   34  0.68  Rotameric          11  26  1.50  41  2.09  molprobity  
 35   35  0.72  Rotameric          11  25  1.48  39  1.58  molprobity  
 36   36  0.83  Rotameric          11  22  1.70  34  1.85  molprobity  
 37   37  0.54  Rotameric          11  25  1.54  39  1.41  molprobity  
 38   38  0.32  Rotameric          10  22  1.80  34  1.64  molprobity  
 39   39  0.00  Triaged/NotBinned  11  25  1.58  39  1.57  molprobity  
 40   40  0.00  NonRotameric       11  26  1.64  41  2.22  molprobity  
 41   41  0.00  NonRotameric       10  22  1.77  34  1.86  molprobity  
 42   42  0.82  Rotameric          11  22  1.68  34  2.03  molprobity  
 43   43  0.77  Rotameric          10  22  1.80  34  1.95  molprobity  
 44   44  0.76  Rotameric          10  22  1.72  34  1.79  molprobity  
 45   45  0.77  Rotameric          12  21  1.68  30  1.85  molprobity  
 46   46  0.00  NotAvailable       12  23  1.52  37  1.97  molprobity  
 47   47  0.78  Rotameric          11  25  1.53  39  1.67  molprobity  
 48   48  0.74  Rotameric          11  26  1.50  41  2.03  molprobity  
 49   49  0.71  Rotameric          11  26  1.49  41  2.02  molprobity  
 50   50  0.75  Rotameric          11  25  1.47  39  1.56  molprobity  
 51   51  0.84  Rotameric          11  22  1.68  34  1.88  molprobity  
 52   52  0.52  Rotameric          11  25  1.53  39  1.39  molprobity  
 53   53  0.33  Rotameric          10  22  1.77  34  1.64  molprobity  
 54   54  0.00  Triaged/NotBinned  11  25  1.55  39  1.57  molprobity  
 55   55  0.00  NonRotameric       11  26  1.64  41  2.21  molprobity  
 56   56  0.00  NonRotameric       10  22  1.79  34  1.81  molprobity  
 57   57  0.82  Rotameric          11  22  1.68  34  2.02  molprobity  
 58   58  0.78  Rotameric          10  22  1.83  34  1.94  molprobity  
 59   59  0.74  Rotameric          10  22  1.75  34  1.82  molprobity  
 60   60  0.74  Rotameric          12  21  1.69  30  1.84  molprobity  
 61   61  0.00  NotAvailable       12  23  1.52  37  1.94  molprobity  
 62   62  0.96  Rotameric          11  25  1.51  39  1.77  molprobity  
 63   63  0.00  NonRotameric       11  26  1.65  41  2.07  molprobity  
 64   64  0.76  Rotameric          11  26  1.48  41  2.01  molprobity  
 65   65  0.79  Rotameric          11  25  1.41  39  1.60  molprobity  
 66   66  0.81  Rotameric          11  22  1.69  34  1.93  molprobity  
 67   67  0.50  Rotameric          11  25  1.51  39  1.46  molprobity  
 68   68  0.28  Rotameric          10  22  1.80  34  1.64  molprobity  
 69   69  0.00  NonRotameric       11  25  1.51  39  1.71  molprobity  
 70   70  0.00  NonRotameric       11  26  1.59  41  2.31  molprobity  
 71   71  0.00  NonRotameric       10  22  1.78  34  1.80  molprobity  
 72   72  0.55  Rotameric          11  22  1.71  34  2.12  molprobity  
 73   73  0.65  Rotameric          10  22  1.81  34  1.93  molprobity  
 74   74  0.71  Rotameric          10  22  1.74  34  1.72  molprobity  
 75   75  0.83  Rotameric          12  21  1.68  30  1.83  molprobity  
 76   76  0.00  NotAvailable       12  23  1.51  37  2.01  molprobity  
 77   77  0.77  Rotameric          11  25  1.52  39  1.69  molprobity  
 78   78  0.74  Rotameric          11  26  1.49  41  2.03  molprobity  
 79   79  0.69  Rotameric          11  26  1.50  41  2.08  molprobity  
 80   80  0.78  Rotameric          11  25  1.47  39  1.57  molprobity  
 81   81  0.78  Rotameric          11  22  1.73  34  1.89  molprobity  
 82   82  0.52  Rotameric          11  25  1.47  39  1.43  molprobity  
 83   83  0.44  Rotameric          10  22  1.82  34  1.68  molprobity  
 84   84  0.00  NonRotameric       11  25  1.48  39  1.64  molprobity  
 85   85  0.00  NonRotameric       11  26  1.51  41  2.50  molprobity  
 86   86  0.23  Rotameric          10  22  1.77  34  1.84  molprobity  
 87   87  0.84  Rotameric          11  22  1.70  34  2.05  molprobity  
 88   88  0.77  Rotameric          10  22  1.82  34  1.93  molprobity  
 89   89  0.75  Rotameric          10  22  1.75  34  1.81  molprobity  
 90   90  0.77  Rotameric          12  21  1.71  30  1.88  molprobity  
 91   91  0.00  NotAvailable       12  23  1.50  37  2.01  molprobity  
 92   92  0.78  Rotameric          11  25  1.49  39  1.67  molprobity  
 93   93  0.73  Rotameric          11  26  1.48  41  2.02  molprobity  
 94   94  0.70  Rotameric          11  26  1.48  41  2.04  molprobity  
 95   95  0.74  Rotameric          11  25  1.48  39  1.60  molprobity  
 96   96  0.82  Rotameric          11  22  1.68  34  1.88  molprobity  
 97   97  0.53  Rotameric          11  25  1.51  39  1.46  molprobity  
 98   98  0.25  Rotameric          10  22  1.74  34  1.72  molprobity  
 99   99  0.00  Triaged/NotBinned  11  25  1.62  39  1.68  molprobity  
100  100  0.55  Rotameric          11  26  1.45  41  2.07  molprobity  
101  101  0.00  NonRotameric       10  22  1.79  34  1.85  molprobity  
102  102  0.80  Rotameric          11  22  1.69  34  2.04  molprobity  
103  103  0.80  Rotameric          10  22  1.83  34  1.93  molprobity  
104  104  0.77  Rotameric          10  22  1.72  34  1.79  molprobity  
105  105  0.76  Rotameric          12  21  1.72  30  1.84  molprobity  
106  106  0.00  NotAvailable       12  23  1.50  37  1.98  molprobity  
107  107  0.78  Rotameric          11  25  1.49  39  1.67  molprobity  
108  108  0.70  Rotameric          11  26  1.48  41  2.05  molprobity  
109  109  0.67  Rotameric          11  26  1.49  41  2.05  molprobity  
110  110  0.71  Rotameric          11  25  1.49  39  1.58  molprobity  
111  111  0.81  Rotameric          11  22  1.68  34  1.83  molprobity  
112  112  0.55  Rotameric          11  25  1.51  39  1.40  molprobity  
113  113  0.35  Rotameric          10  22  1.80  34  1.92  molprobity  
114  114  0.68  Rotameric          11  25  1.37  39  1.55  molprobity  
115  115  0.00  NonRotameric       11  26  1.65  41  2.20  molprobity  
116  116  0.17  Rotameric          10  22  1.76  34  1.84  molprobity  
117  117  0.81  Rotameric          11  22  1.68  34  2.03  molprobity  
118  118  0.79  Rotameric          10  22  1.82  34  1.95  molprobity  
119  119  0.77  Rotameric          10  22  1.75  34  1.76  molprobity  
120  120  0.77  Rotameric          12  21  1.70  30  1.86  molprobity  
121  121  0.00  NotAvailable       12  23  1.49  37  1.96  molprobity  
122  122  0.80  Rotameric          11  25  1.52  39  1.63  molprobity  
123  123  0.72  Rotameric          11  26  1.51  41  1.99  molprobity  
124  124  0.66  Rotameric          11  26  1.48  41  2.05  molprobity  
125  125  0.69  Rotameric          11  25  1.44  39  1.60  molprobity  
126  126  0.83  Rotameric          11  22  1.64  34  1.85  molprobity  
127  127  0.55  Rotameric          11  25  1.54  39  1.38  molprobity  
128  128  0.36  Rotameric          10  22  1.80  34  1.90  molprobity  
129  129  0.63  Rotameric          11  25  1.43  39  1.56  molprobity  
130  130  0.00  NonRotameric       11  26  1.68  41  2.25  molprobity  
131  131  0.00  NonRotameric       10  22  1.77  34  1.82  molprobity  
132  132  0.54  Rotameric          11  22  1.73  34  2.08  molprobity  
133  133  0.66  Rotameric          10  22  1.83  34  1.95  molprobity  
134  134  0.75  Rotameric          10  22  1.74  34  1.78  molprobity  
135  135  0.78  Rotameric          12  21  1.71  30  1.89  molprobity  
136  136  0.00  NotAvailable       12  23  1.52  37  1.96  molprobity  
137  137  0.79  Rotameric          11  25  1.54  39  1.67  molprobity  
138  138  0.71  Rotameric          11  26  1.48  41  2.05  molprobity  
139  139  0.66  Rotameric          11  26  1.51  41  2.02  molprobity  
140  140  0.79  Rotameric          11  25  1.48  39  1.54  molprobity  
141  141  0.82  Rotameric          11  22  1.67  34  1.89  molprobity  
142  142  0.51  Rotameric          11  25  1.53  39  1.44  molprobity  
143  143  0.27  Rotameric          10  22  1.78  34  1.66  molprobity  
144  144  0.00  Triaged/NotBinned  11  25  1.60  39  1.59  molprobity  
145  145  0.00  NonRotameric       11  26  1.60  41  2.17  molprobity  
146  146  0.13  Rotameric          10  22  1.78  34  1.84  molprobity  
147  147  0.81  Rotameric          11  22  1.68  34  2.04  molprobity  
148  148  0.80  Rotameric          10  22  1.81  34  1.96  molprobity  
149  149  0.74  Rotameric          10  22  1.75  34  1.81  molprobity  
150  150  0.75  Rotameric          12  21  1.72  30  1.89  molprobity  
#
loop_
_pdbx_vrpt_instance_intra_bond_outliers.ordinal
_pdbx_vrpt_instance_intra_bond_outliers.instance_id
_pdbx_vrpt_instance_intra_bond_outliers.atom_1
_pdbx_vrpt_instance_intra_bond_outliers.atom_2
_pdbx_vrpt_instance_intra_bond_outliers.obs
_pdbx_vrpt_instance_intra_bond_outliers.mean
_pdbx_vrpt_instance_intra_bond_outliers.stdev
_pdbx_vrpt_instance_intra_bond_outliers.Z
 1    5  N3  C4  1.374  1.344  0.006  5.04  
 2    9  N3  C4  1.375  1.344  0.006  5.25  
 3   17  N3  C4  1.374  1.344  0.006  5.07  
 4   24  N3  C4  1.376  1.344  0.006  5.37  
 5   32  N3  C4  1.374  1.344  0.006  5.07  
 6   35  N3  C4  1.375  1.344  0.006  5.10  
 7   39  N3  C4  1.374  1.344  0.006  5.08  
 8   47  N3  C4  1.375  1.344  0.006  5.12  
 9   50  N3  C4  1.375  1.344  0.006  5.09  
10   54  N3  C4  1.374  1.344  0.006  5.02  
11   62  N3  C4  1.375  1.344  0.006  5.09  
12   69  N3  C4  1.375  1.344  0.006  5.17  
13   77  N3  C4  1.374  1.344  0.006  5.07  
14   80  N3  C4  1.374  1.344  0.006  5.00  
15   84  N3  C4  1.376  1.344  0.006  5.28  
16   99  N3  C4  1.374  1.344  0.006  5.05  
17  110  N3  C4  1.374  1.344  0.006  5.08  
18  122  N3  C4  1.374  1.344  0.006  5.07  
19  127  N3  C4  1.375  1.344  0.006  5.15  
20  137  N3  C4  1.375  1.344  0.006  5.18  
21  144  N3  C4  1.375  1.344  0.006  5.23  
#
loop_
_pdbx_vrpt_instance_intra_angle_outliers.ordinal
_pdbx_vrpt_instance_intra_angle_outliers.instance_id
_pdbx_vrpt_instance_intra_angle_outliers.atom_1
_pdbx_vrpt_instance_intra_angle_outliers.atom_2
_pdbx_vrpt_instance_intra_angle_outliers.atom_3
_pdbx_vrpt_instance_intra_angle_outliers.obs
_pdbx_vrpt_instance_intra_angle_outliers.mean
_pdbx_vrpt_instance_intra_angle_outliers.stdev
_pdbx_vrpt_instance_intra_angle_outliers.Z
 1    1  N3     C4     C5  126.085  128.600  0.500  -5.03  
 2    3  N3     C4     C5  126.036  128.600  0.500  -5.13  
 3    4  N3     C4     C5  126.058  128.600  0.500  -5.08  
 4    6  "O4'"  "C1'"  N1  113.333  108.200  0.800   6.42  
 5   11  "O4'"  "C1'"  N1  112.866  108.200  0.800   5.83  
 6   12  N1     C2     O2  121.967  118.900  0.600   5.11  
 7   12  "O4'"  "C1'"  N1  113.621  108.200  0.800   6.78  
 8   13  "O4'"  "C1'"  N1  113.471  108.200  0.800   6.59  
 9   14  "O4'"  "C1'"  N1  112.577  108.200  0.800   5.47  
10   15  "O4'"  "C1'"  N1  112.709  108.200  0.800   5.64  
11   16  N3     C4     C5  126.090  128.600  0.500  -5.02  
12   19  N3     C4     C5  126.012  128.600  0.500  -5.18  
13   21  "O4'"  "C1'"  N1  113.223  108.200  0.800   6.28  
14   26  "O4'"  "C1'"  N1  112.839  108.200  0.800   5.80  
15   27  N1     C2     O2  121.988  118.900  0.600   5.15  
16   27  "O4'"  "C1'"  N1  113.864  108.200  0.800   7.08  
17   28  "O4'"  "C1'"  N1  113.497  108.200  0.800   6.62  
18   29  "O4'"  "C1'"  N1  112.642  108.200  0.800   5.55  
19   30  N1     C2     O2  121.948  118.900  0.600   5.08  
20   30  "O4'"  "C1'"  N1  112.615  108.200  0.800   5.52  
21   31  N3     C4     C5  126.076  128.600  0.500  -5.05  
22   34  N3     C4     C5  126.083  128.600  0.500  -5.04  
23   36  "O4'"  "C1'"  N1  113.013  108.200  0.800   6.02  
24   40  N3     C4     C5  125.904  128.600  0.500  -5.39  
25   41  "O4'"  "C1'"  N1  113.046  108.200  0.800   6.06  
26   42  N1     C2     O2  121.962  118.900  0.600   5.10  
27   42  "O4'"  "C1'"  N1  113.475  108.200  0.800   6.59  
28   43  "O4'"  "C1'"  N1  113.411  108.200  0.800   6.51  
29   44  "O4'"  "C1'"  N1  112.627  108.200  0.800   5.53  
30   45  "O4'"  "C1'"  N1  112.785  108.200  0.800   5.73  
31   46  N3     C4     C5  126.037  128.600  0.500  -5.12  
32   51  "O4'"  "C1'"  N1  113.119  108.200  0.800   6.15  
33   55  N3     C4     C5  125.941  128.600  0.500  -5.32  
34   56  "O4'"  "C1'"  N1  112.891  108.200  0.800   5.86  
35   57  N1     C2     O2  121.962  118.900  0.600   5.10  
36   57  "O4'"  "C1'"  N1  113.660  108.200  0.800   6.83  
37   58  "O4'"  "C1'"  N1  113.540  108.200  0.800   6.67  
38   59  "O4'"  "C1'"  N1  112.696  108.200  0.800   5.62  
39   60  "O4'"  "C1'"  N1  112.699  108.200  0.800   5.62  
40   63  N3     C4     C5  125.902  128.600  0.500  -5.40  
41   64  N3     C4     C5  126.036  128.600  0.500  -5.13  
42   66  "O4'"  "C1'"  N1  113.319  108.200  0.800   6.40  
43   70  "O4'"  "C1'"  N9  113.114  108.200  0.800   6.14  
44   71  "O4'"  "C1'"  N1  113.162  108.200  0.800   6.20  
45   72  N1     C2     O2  122.051  118.900  0.600   5.25  
46   72  "O4'"  "C1'"  N1  114.018  108.200  0.800   7.27  
47   73  "O4'"  "C1'"  N1  113.109  108.200  0.800   6.14  
48   75  "O4'"  "C1'"  N1  112.326  108.200  0.800   5.16  
49   78  N3     C4     C5  126.093  128.600  0.500  -5.01  
50   79  N3     C4     C5  126.017  128.600  0.500  -5.17  
51   81  "O4'"  "C1'"  N1  113.054  108.200  0.800   6.07  
52   85  "O4'"  "C1'"  N9  114.250  108.200  0.800   7.56  
53   86  "O4'"  "C1'"  N1  113.047  108.200  0.800   6.06  
54   87  N1     C2     O2  122.080  118.900  0.600   5.30  
55   87  "O4'"  "C1'"  N1  113.500  108.200  0.800   6.62  
56   88  "O4'"  "C1'"  N1  113.438  108.200  0.800   6.55  
57   89  "O4'"  "C1'"  N1  112.660  108.200  0.800   5.58  
58   90  "O4'"  "C1'"  N1  112.622  108.200  0.800   5.53  
59   91  N3     C4     C5  126.027  128.600  0.500  -5.15  
60   94  N3     C4     C5  126.068  128.600  0.500  -5.06  
61   96  "O4'"  "C1'"  N1  113.110  108.200  0.800   6.14  
62  101  "O4'"  "C1'"  N1  113.245  108.200  0.800   6.31  
63  102  N1     C2     O2  121.979  118.900  0.600   5.13  
64  102  "O4'"  "C1'"  N1  113.622  108.200  0.800   6.78  
65  103  "O4'"  "C1'"  N1  113.378  108.200  0.800   6.47  
66  104  "O4'"  "C1'"  N1  112.592  108.200  0.800   5.49  
67  105  "O4'"  "C1'"  N1  112.849  108.200  0.800   5.81  
68  109  N3     C4     C5  126.099  128.600  0.500  -5.00  
69  111  "O4'"  "C1'"  N1  112.763  108.200  0.800   5.70  
70  113  "O4'"  "C1'"  N1  113.220  108.200  0.800   6.27  
71  115  N3     C4     C5  125.927  128.600  0.500  -5.35  
72  116  "O4'"  "C1'"  N1  113.148  108.200  0.800   6.18  
73  117  N1     C2     O2  121.996  118.900  0.600   5.16  
74  117  "O4'"  "C1'"  N1  113.496  108.200  0.800   6.62  
75  118  "O4'"  "C1'"  N1  113.391  108.200  0.800   6.49  
76  119  "O4'"  "C1'"  N1  112.395  108.200  0.800   5.24  
77  120  "O4'"  "C1'"  N1  112.565  108.200  0.800   5.46  
78  121  N3     C4     C5  126.085  128.600  0.500  -5.03  
79  126  "O4'"  "C1'"  N1  112.941  108.200  0.800   5.93  
80  128  "O4'"  "C1'"  N1  113.182  108.200  0.800   6.23  
81  130  N3     C4     C5  126.038  128.600  0.500  -5.12  
82  130  "O4'"  "C1'"  N9  112.326  108.200  0.800   5.16  
83  131  "O4'"  "C1'"  N1  112.758  108.200  0.800   5.70  
84  132  "O4'"  "C1'"  N1  114.154  108.200  0.800   7.44  
85  133  "O4'"  "C1'"  N1  113.326  108.200  0.800   6.41  
86  134  "O4'"  "C1'"  N1  112.535  108.200  0.800   5.42  
87  135  "O4'"  "C1'"  N1  112.827  108.200  0.800   5.78  
88  136  N3     C4     C5  126.094  128.600  0.500  -5.01  
89  141  "O4'"  "C1'"  N1  113.150  108.200  0.800   6.19  
90  145  N3     C4     C5  126.034  128.600  0.500  -5.13  
91  146  "O4'"  "C1'"  N1  113.087  108.200  0.800   6.11  
92  147  N1     C2     O2  122.074  118.900  0.600   5.29  
93  147  "O4'"  "C1'"  N1  113.443  108.200  0.800   6.55  
94  148  "O4'"  "C1'"  N1  113.594  108.200  0.800   6.74  
95  149  "O4'"  "C1'"  N1  112.730  108.200  0.800   5.66  
96  150  "O4'"  "C1'"  N1  112.957  108.200  0.800   5.95  
#
_pdbx_vrpt_chemical_shift_list.ordinal                           1
_pdbx_vrpt_chemical_shift_list.file_id                           4
_pdbx_vrpt_chemical_shift_list.file_name                         working_cs.cif
_pdbx_vrpt_chemical_shift_list.block_name                        assigned_chem_shift_list_1
_pdbx_vrpt_chemical_shift_list.list_id                           1
_pdbx_vrpt_chemical_shift_list.type                              full
_pdbx_vrpt_chemical_shift_list.number_of_errors_while_mapping    0
_pdbx_vrpt_chemical_shift_list.number_of_warnings_while_mapping  0
_pdbx_vrpt_chemical_shift_list.number_of_mapped_shifts           114
_pdbx_vrpt_chemical_shift_list.number_of_parsed_shifts           114
_pdbx_vrpt_chemical_shift_list.total_number_of_shifts            114
_pdbx_vrpt_chemical_shift_list.number_of_unparsed_shifts         0
#
loop_
_pdbx_vrpt_referencing_offset.ordinal
_pdbx_vrpt_referencing_offset.label_atom_id
_pdbx_vrpt_referencing_offset.uncertainty
_pdbx_vrpt_referencing_offset.precision
_pdbx_vrpt_referencing_offset.value
_pdbx_vrpt_referencing_offset.number_of_measurements
1  C   0.50  0.00  0.00  0  
2  CA  0.50  0.00  0.00  0  
3  CB  0.50  0.00  0.00  0  
4  N   0.50  0.00  0.00  0  
#
loop_
_pdbx_vrpt_assign_completeness_well_defined.ordinal
_pdbx_vrpt_assign_completeness_well_defined.number_of_assigned_shifts
_pdbx_vrpt_assign_completeness_well_defined.number_of_unassigned_shifts
_pdbx_vrpt_assign_completeness_well_defined.number_of_shifts
_pdbx_vrpt_assign_completeness_well_defined.type
_pdbx_vrpt_assign_completeness_well_defined.element
 1  96  185  281  overall  Total  
 2  59  106  165  sugar    Total  
 3  37   79  116  base     Total  
 4  96   65  161  overall  H      
 5  59   31   90  sugar    H      
 6  37   34   71  base     H      
 7   0  101  101  overall  C      
 8   0   75   75  sugar    C      
 9   0   26   26  base     C      
10   0   19   19  overall  N      
11   0   19   19  base     N      
#
loop_
_pdbx_vrpt_assign_completeness_full_length.ordinal
_pdbx_vrpt_assign_completeness_full_length.number_of_assigned_shifts
_pdbx_vrpt_assign_completeness_full_length.number_of_unassigned_shifts
_pdbx_vrpt_assign_completeness_full_length.number_of_shifts
_pdbx_vrpt_assign_completeness_full_length.type
_pdbx_vrpt_assign_completeness_full_length.element
 1  96  185  281  overall  Total  
 2  59  106  165  sugar    Total  
 3  37   79  116  base     Total  
 4  96   65  161  overall  H      
 5  59   31   90  sugar    H      
 6  37   34   71  base     H      
 7   0  101  101  overall  C      
 8   0   75   75  sugar    C      
 9   0   26   26  base     C      
10   0   19   19  overall  N      
11   0   19   19  base     N      
#
loop_
_pdbx_vrpt_restraint_summary.ordinal
_pdbx_vrpt_restraint_summary.description
_pdbx_vrpt_restraint_summary.value
 1  "Total distance restraints"                     262  
 2  "Intra-residue (|i-j|=0)"                       126  
 3  "Sequential (|i-j|=1)"                           99  
 4  "Medium range (|i-j|>1 and |i-j|<5)"             11  
 5  "Long range (|i-j|>=5)"                          26  
 6  Inter-chain                                       0  
 7  "Total hydrogen bond restraints"                  0  
 8  "Total disulfide bond restraints"                 0  
 9  "Total dihedral-angle restraints"               128  
10  "Number of unmapped restraints"                   0  
11  "Number of restraints per residue"             26.0  
12  "Number of long range restraints per residue"   1.7  
#
loop_
_pdbx_vrpt_distance_violation_summary.ordinal
_pdbx_vrpt_distance_violation_summary.restraint_type
_pdbx_vrpt_distance_violation_summary.restraint_sub_type
_pdbx_vrpt_distance_violation_summary.restraints_count
_pdbx_vrpt_distance_violation_summary.percent_total
_pdbx_vrpt_distance_violation_summary.consistently_violated_count
_pdbx_vrpt_distance_violation_summary.consistently_violated_percent_total
_pdbx_vrpt_distance_violation_summary.consistently_violated_percent_type
_pdbx_vrpt_distance_violation_summary.violated_count
_pdbx_vrpt_distance_violation_summary.violated_percent_total
_pdbx_vrpt_distance_violation_summary.violated_percent_type
 1  Intra-residue  all                 126   48.1  0  0.0  0.0  0  0.0  0.0  
 2  Intra-residue  BackboneBackbone      0    0.0  0  0.0  0.0  0  0.0  0.0  
 3  Intra-residue  BackboneSidechain     0    0.0  0  0.0  0.0  0  0.0  0.0  
 4  Intra-residue  SidechainSidechain  126   48.1  0  0.0  0.0  0  0.0  0.0  
 5  Sequential     all                  99   37.8  0  0.0  0.0  0  0.0  0.0  
 6  Sequential     BackboneBackbone      0    0.0  0  0.0  0.0  0  0.0  0.0  
 7  Sequential     BackboneSidechain     0    0.0  0  0.0  0.0  0  0.0  0.0  
 8  Sequential     SidechainSidechain   99   37.8  0  0.0  0.0  0  0.0  0.0  
 9  MediumRange    all                  11    4.2  0  0.0  0.0  1  0.4  9.1  
10  MediumRange    BackboneBackbone      0    0.0  0  0.0  0.0  0  0.0  0.0  
11  MediumRange    BackboneSidechain     0    0.0  0  0.0  0.0  0  0.0  0.0  
12  MediumRange    SidechainSidechain   11    4.2  0  0.0  0.0  1  0.4  9.1  
13  LongRange      all                  26    9.9  0  0.0  0.0  0  0.0  0.0  
14  LongRange      BackboneBackbone      0    0.0  0  0.0  0.0  0  0.0  0.0  
15  LongRange      BackboneSidechain     0    0.0  0  0.0  0.0  0  0.0  0.0  
16  LongRange      SidechainSidechain   26    9.9  0  0.0  0.0  0  0.0  0.0  
17  InterChain     all                   0    0.0  0  0.0  0.0  0  0.0  0.0  
18  InterChain     BackboneBackbone      0    0.0  0  0.0  0.0  0  0.0  0.0  
19  InterChain     BackboneSidechain     0    0.0  0  0.0  0.0  0  0.0  0.0  
20  InterChain     SidechainSidechain    0    0.0  0  0.0  0.0  0  0.0  0.0  
21  HydrogenBond   all                   0    0.0  0  0.0  0.0  0  0.0  0.0  
22  DisulfideBond  all                   0    0.0  0  0.0  0.0  0  0.0  0.0  
23  Total          all                 262  100.0  0  0.0  0.0  1  0.4  0.4  
24  Total          BackboneBackbone      0    0.0  0  0.0  0.0  0  0.0  0.0  
25  Total          BackboneSidechain     0    0.0  0  0.0  0.0  0  0.0  0.0  
26  Total          SidechainSidechain  262  100.0  0  0.0  0.0  1  0.4  0.4  
#
loop_
_pdbx_vrpt_distance_violation_model_summary.ordinal
_pdbx_vrpt_distance_violation_model_summary.PDB_model_num
_pdbx_vrpt_distance_violation_model_summary.max_violation
_pdbx_vrpt_distance_violation_model_summary.mean_violation
_pdbx_vrpt_distance_violation_model_summary.median_violation
_pdbx_vrpt_distance_violation_model_summary.standard_deviation
 1   1  1.30  1.30  1.30  0.00  
 2   2  1.19  1.19  1.19  0.00  
 3   3  0.00  0.00  0.00  0.00  
 4   4  0.00  0.00  0.00  0.00  
 5   5  1.26  1.26  1.26  0.00  
 6   6  1.57  1.57  1.57  0.00  
 7   7  1.10  1.10  1.10  0.00  
 8   8  0.00  0.00  0.00  0.00  
 9   9  0.00  0.00  0.00  0.00  
10  10  0.24  0.24  0.24  0.00  
#
loop_
_pdbx_vrpt_distance_violation_model_restraints.ordinal
_pdbx_vrpt_distance_violation_model_restraints.PDB_model_num
_pdbx_vrpt_distance_violation_model_restraints.dist_rest_type
_pdbx_vrpt_distance_violation_model_restraints.violations_count
 1   1  intraresidue  0  
 2   1  sequential    0  
 3   1  medium        1  
 4   1  long          0  
 5   1  interchain    0  
 6   1  total         1  
 7   2  intraresidue  0  
 8   2  sequential    0  
 9   2  medium        1  
10   2  long          0  
11   2  interchain    0  
12   2  total         1  
13   3  intraresidue  0  
14   3  sequential    0  
15   3  medium        0  
16   3  long          0  
17   3  interchain    0  
18   3  total         0  
19   4  intraresidue  0  
20   4  sequential    0  
21   4  medium        0  
22   4  long          0  
23   4  interchain    0  
24   4  total         0  
25   5  intraresidue  0  
26   5  sequential    0  
27   5  medium        1  
28   5  long          0  
29   5  interchain    0  
30   5  total         1  
31   6  intraresidue  0  
32   6  sequential    0  
33   6  medium        1  
34   6  long          0  
35   6  interchain    0  
36   6  total         1  
37   7  intraresidue  0  
38   7  sequential    0  
39   7  medium        1  
40   7  long          0  
41   7  interchain    0  
42   7  total         1  
43   8  intraresidue  0  
44   8  sequential    0  
45   8  medium        0  
46   8  long          0  
47   8  interchain    0  
48   8  total         0  
49   9  intraresidue  0  
50   9  sequential    0  
51   9  medium        0  
52   9  long          0  
53   9  interchain    0  
54   9  total         0  
55  10  intraresidue  0  
56  10  sequential    0  
57  10  medium        1  
58  10  long          0  
59  10  interchain    0  
60  10  total         1  
#
loop_
_pdbx_vrpt_distance_violations_ensemble_summary.id
_pdbx_vrpt_distance_violations_ensemble_summary.fraction_of_ensemble_count
_pdbx_vrpt_distance_violations_ensemble_summary.fraction_of_ensemble_percent
 1   1   10.0  
 2   2   20.0  
 3   3   30.0  
 4   4   40.0  
 5   5   50.0  
 6   6   60.0  
 7   7   70.0  
 8   8   80.0  
 9   9   90.0  
10  10  100.0  
#
loop_
_pdbx_vrpt_distance_violation_ensemble.ordinal
_pdbx_vrpt_distance_violation_ensemble.ensemble_distance_count
_pdbx_vrpt_distance_violation_ensemble.dist_rest_type
_pdbx_vrpt_distance_violation_ensemble.violations_count
 1   1  intraresidue  0  
 2   1  sequential    0  
 3   1  medium        0  
 4   1  long          0  
 5   1  interchain    0  
 6   1  total         0  
 7   2  intraresidue  0  
 8   2  sequential    0  
 9   2  medium        0  
10   2  long          0  
11   2  interchain    0  
12   2  total         0  
13   3  intraresidue  0  
14   3  sequential    0  
15   3  medium        0  
16   3  long          0  
17   3  interchain    0  
18   3  total         0  
19   4  intraresidue  0  
20   4  sequential    0  
21   4  medium        0  
22   4  long          0  
23   4  interchain    0  
24   4  total         0  
25   5  intraresidue  0  
26   5  sequential    0  
27   5  medium        0  
28   5  long          0  
29   5  interchain    0  
30   5  total         0  
31   6  intraresidue  0  
32   6  sequential    0  
33   6  medium        1  
34   6  long          0  
35   6  interchain    0  
36   6  total         1  
37   7  intraresidue  0  
38   7  sequential    0  
39   7  medium        0  
40   7  long          0  
41   7  interchain    0  
42   7  total         0  
43   8  intraresidue  0  
44   8  sequential    0  
45   8  medium        0  
46   8  long          0  
47   8  interchain    0  
48   8  total         0  
49   9  intraresidue  0  
50   9  sequential    0  
51   9  medium        0  
52   9  long          0  
53   9  interchain    0  
54   9  total         0  
55  10  intraresidue  0  
56  10  sequential    0  
57  10  medium        0  
58  10  long          0  
59  10  interchain    0  
60  10  total         0  
#
loop_
_pdbx_vrpt_residual_distance_violations.ordinal
_pdbx_vrpt_residual_distance_violations.bins
_pdbx_vrpt_residual_distance_violations.max_violation
_pdbx_vrpt_residual_distance_violations.violations_per_model
1  0.1-0.2  None  None  
2  0.2-0.5  0.2   0.1   
3  >0.5     1.6   0.5   
#
_pdbx_vrpt_most_violated_distance_restraints.ordinal                  1
_pdbx_vrpt_most_violated_distance_restraints.rest_id                  229
_pdbx_vrpt_most_violated_distance_restraints.rlist_id                 1
_pdbx_vrpt_most_violated_distance_restraints.altcode_1                .
_pdbx_vrpt_most_violated_distance_restraints.chain_1                  A
_pdbx_vrpt_most_violated_distance_restraints.resnum_1                 9
_pdbx_vrpt_most_violated_distance_restraints.resname_1                A
_pdbx_vrpt_most_violated_distance_restraints.icode_1                  ?
_pdbx_vrpt_most_violated_distance_restraints.ent_1                    1
_pdbx_vrpt_most_violated_distance_restraints.said_1                   A
_pdbx_vrpt_most_violated_distance_restraints.seq_1                    9
_pdbx_vrpt_most_violated_distance_restraints.atom_1                   H2
_pdbx_vrpt_most_violated_distance_restraints.chain_2                  A
_pdbx_vrpt_most_violated_distance_restraints.altcode_2                .
_pdbx_vrpt_most_violated_distance_restraints.resnum_2                 6
_pdbx_vrpt_most_violated_distance_restraints.resname_2                C
_pdbx_vrpt_most_violated_distance_restraints.seq_2                    6
_pdbx_vrpt_most_violated_distance_restraints.said_2                   A
_pdbx_vrpt_most_violated_distance_restraints.ent_2                    1
_pdbx_vrpt_most_violated_distance_restraints.icode_2                  ?
_pdbx_vrpt_most_violated_distance_restraints.atom_2                   H42
_pdbx_vrpt_most_violated_distance_restraints.violated_models          6
_pdbx_vrpt_most_violated_distance_restraints.mean_distance_violation  1.11
_pdbx_vrpt_most_violated_distance_restraints.median_violation         1.23
_pdbx_vrpt_most_violated_distance_restraints.standard_deviation       0.42
#
loop_
_pdbx_vrpt_violated_distance_restraints.ordinal
_pdbx_vrpt_violated_distance_restraints.rest_id
_pdbx_vrpt_violated_distance_restraints.rlist_id
_pdbx_vrpt_violated_distance_restraints.instance_id_1
_pdbx_vrpt_violated_distance_restraints.instance_id_2
_pdbx_vrpt_violated_distance_restraints.atom_1
_pdbx_vrpt_violated_distance_restraints.atom_2
_pdbx_vrpt_violated_distance_restraints.violation
1  229  1   84   81  H2  H42  1.57  
2  229  1    9    6  H2  H42  1.30  
3  229  1   69   66  H2  H42  1.26  
4  229  1   24   21  H2  H42  1.19  
5  229  1   99   96  H2  H42  1.10  
6  229  1  144  141  H2  H42  0.24  
#
loop_
_pdbx_vrpt_dihedralangle_violations_summary.ordinal
_pdbx_vrpt_dihedralangle_violations_summary.restraint_type
_pdbx_vrpt_dihedralangle_violations_summary.restraints_count
_pdbx_vrpt_dihedralangle_violations_summary.percent_total
_pdbx_vrpt_dihedralangle_violations_summary.consistently_violated_count
_pdbx_vrpt_dihedralangle_violations_summary.consistently_violated_percent_total
_pdbx_vrpt_dihedralangle_violations_summary.consistently_violated_percent_type
_pdbx_vrpt_dihedralangle_violations_summary.violated_count
_pdbx_vrpt_dihedralangle_violations_summary.violated_percent_total
_pdbx_vrpt_dihedralangle_violations_summary.violated_percent_type
1  BETA    10    7.8  0  0.0  0.0  0  0.0   0.0  
2  ZETA     7    5.5  0  0.0  0.0  1  0.8  14.3  
3  ALPHA    7    5.5  0  0.0  0.0  0  0.0   0.0  
4  .       70   54.7  0  0.0  0.0  0  0.0   0.0  
5  NU3     10    7.8  0  0.0  0.0  0  0.0   0.0  
6  CHI     14   10.9  0  0.0  0.0  1  0.8   7.1  
7  NU1     10    7.8  0  0.0  0.0  1  0.8  10.0  
8  Total  128  100.0  0  0.0  0.0  3  2.3   2.3  
#
loop_
_pdbx_vrpt_dihedralangle_violation_model_summary.ordinal
_pdbx_vrpt_dihedralangle_violation_model_summary.PDB_model_num
_pdbx_vrpt_dihedralangle_violation_model_summary.max_violation
_pdbx_vrpt_dihedralangle_violation_model_summary.mean_violation
_pdbx_vrpt_dihedralangle_violation_model_summary.median_violation
_pdbx_vrpt_dihedralangle_violation_model_summary.standard_deviation
 1   1  2.00  2.00  2.00  0.00  
 2   2  4.20  4.20  4.20  0.00  
 3   3  1.30  1.30  1.30  0.00  
 4   4  1.30  1.30  1.30  0.00  
 5   5  1.80  1.70  1.70  0.08  
 6   6  1.90  1.90  1.90  0.00  
 7   7  4.20  4.20  4.20  0.00  
 8   8  2.80  2.80  2.80  0.00  
 9   9  2.30  2.00  2.00  0.30  
10  10  1.90  1.90  1.90  0.00  
#
loop_
_pdbx_vrpt_dihedralangle_violation_model.ordinal
_pdbx_vrpt_dihedralangle_violation_model.PDB_model_num
_pdbx_vrpt_dihedralangle_violation_model.ang_rest_type
_pdbx_vrpt_dihedralangle_violation_model.violations_count
 1   1  BETA   0  
 2   1  ZETA   0  
 3   1  ALPHA  0  
 4   1  .      0  
 5   1  NU3    0  
 6   1  CHI    1  
 7   1  NU1    0  
 8   1  Total  1  
 9   2  BETA   0  
10   2  ZETA   0  
11   2  ALPHA  0  
12   2  .      0  
13   2  NU3    0  
14   2  CHI    1  
15   2  NU1    0  
16   2  Total  1  
17   3  BETA   0  
18   3  ZETA   0  
19   3  ALPHA  0  
20   3  .      0  
21   3  NU3    0  
22   3  CHI    1  
23   3  NU1    0  
24   3  Total  1  
25   4  BETA   0  
26   4  ZETA   0  
27   4  ALPHA  0  
28   4  .      0  
29   4  NU3    0  
30   4  CHI    1  
31   4  NU1    0  
32   4  Total  1  
33   5  BETA   0  
34   5  ZETA   1  
35   5  ALPHA  0  
36   5  .      0  
37   5  NU3    0  
38   5  CHI    1  
39   5  NU1    1  
40   5  Total  3  
41   6  BETA   0  
42   6  ZETA   0  
43   6  ALPHA  0  
44   6  .      0  
45   6  NU3    0  
46   6  CHI    0  
47   6  NU1    1  
48   6  Total  1  
49   7  BETA   0  
50   7  ZETA   0  
51   7  ALPHA  0  
52   7  .      0  
53   7  NU3    0  
54   7  CHI    1  
55   7  NU1    0  
56   7  Total  1  
57   8  BETA   0  
58   8  ZETA   0  
59   8  ALPHA  0  
60   8  .      0  
61   8  NU3    0  
62   8  CHI    1  
63   8  NU1    0  
64   8  Total  1  
65   9  BETA   0  
66   9  ZETA   0  
67   9  ALPHA  0  
68   9  .      0  
69   9  NU3    0  
70   9  CHI    1  
71   9  NU1    1  
72   9  Total  2  
73  10  BETA   0  
74  10  ZETA   0  
75  10  ALPHA  0  
76  10  .      0  
77  10  NU3    0  
78  10  CHI    1  
79  10  NU1    0  
80  10  Total  1  
#
loop_
_pdbx_vrpt_dihedralangle_violation_ensemble_summary.id
_pdbx_vrpt_dihedralangle_violation_ensemble_summary.fraction_of_ensemble_count
_pdbx_vrpt_dihedralangle_violation_ensemble_summary.fraction_of_ensemble_percent
 1   1   10.0  
 2   2   20.0  
 3   3   30.0  
 4   4   40.0  
 5   5   50.0  
 6   6   60.0  
 7   7   70.0  
 8   8   80.0  
 9   9   90.0  
10  10  100.0  
#
loop_
_pdbx_vrpt_dihedralangle_ensemble_violation.ordinal
_pdbx_vrpt_dihedralangle_ensemble_violation.ensemble_dihedral_count
_pdbx_vrpt_dihedralangle_ensemble_violation.ang_rest_type
_pdbx_vrpt_dihedralangle_ensemble_violation.violations_count
 1   1  BETA   0  
 2   1  ZETA   1  
 3   1  ALPHA  0  
 4   1  .      0  
 5   1  NU3    0  
 6   1  CHI    0  
 7   1  NU1    0  
 8   1  Total  1  
 9   2  BETA   0  
10   2  ZETA   0  
11   2  ALPHA  0  
12   2  .      0  
13   2  NU3    0  
14   2  CHI    0  
15   2  NU1    0  
16   2  Total  0  
17   3  BETA   0  
18   3  ZETA   0  
19   3  ALPHA  0  
20   3  .      0  
21   3  NU3    0  
22   3  CHI    0  
23   3  NU1    1  
24   3  Total  1  
25   4  BETA   0  
26   4  ZETA   0  
27   4  ALPHA  0  
28   4  .      0  
29   4  NU3    0  
30   4  CHI    0  
31   4  NU1    0  
32   4  Total  0  
33   5  BETA   0  
34   5  ZETA   0  
35   5  ALPHA  0  
36   5  .      0  
37   5  NU3    0  
38   5  CHI    0  
39   5  NU1    0  
40   5  Total  0  
41   6  BETA   0  
42   6  ZETA   0  
43   6  ALPHA  0  
44   6  .      0  
45   6  NU3    0  
46   6  CHI    0  
47   6  NU1    0  
48   6  Total  0  
49   7  BETA   0  
50   7  ZETA   0  
51   7  ALPHA  0  
52   7  .      0  
53   7  NU3    0  
54   7  CHI    0  
55   7  NU1    0  
56   7  Total  0  
57   8  BETA   0  
58   8  ZETA   0  
59   8  ALPHA  0  
60   8  .      0  
61   8  NU3    0  
62   8  CHI    0  
63   8  NU1    0  
64   8  Total  0  
65   9  BETA   0  
66   9  ZETA   0  
67   9  ALPHA  0  
68   9  .      0  
69   9  NU3    0  
70   9  CHI    1  
71   9  NU1    0  
72   9  Total  1  
73  10  BETA   0  
74  10  ZETA   0  
75  10  ALPHA  0  
76  10  .      0  
77  10  NU3    0  
78  10  CHI    0  
79  10  NU1    0  
80  10  Total  0  
#
loop_
_pdbx_vrpt_residual_angle_violations.ordinal
_pdbx_vrpt_residual_angle_violations.bins
_pdbx_vrpt_residual_angle_violations.max_violation
_pdbx_vrpt_residual_angle_violations.violations_per_model
1  1.0-10.0   4.2   1.3   
2  10.0-20.0  None  None  
3  >20.0      None  None  
#
loop_
_pdbx_vrpt_most_violated_dihedralangle_restraints.ordinal
_pdbx_vrpt_most_violated_dihedralangle_restraints.rest_id
_pdbx_vrpt_most_violated_dihedralangle_restraints.rlist_id
_pdbx_vrpt_most_violated_dihedralangle_restraints.altcode_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.chain_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.resnum_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.resname_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.icode_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.ent_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.said_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.seq_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.atom_1
_pdbx_vrpt_most_violated_dihedralangle_restraints.chain_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.altcode_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.resnum_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.resname_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.seq_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.said_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.ent_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.icode_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.atom_2
_pdbx_vrpt_most_violated_dihedralangle_restraints.altcode_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.chain_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.resnum_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.resname_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.icode_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.ent_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.said_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.seq_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.atom_3
_pdbx_vrpt_most_violated_dihedralangle_restraints.chain_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.altcode_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.resnum_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.resname_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.seq_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.said_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.ent_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.icode_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.atom_4
_pdbx_vrpt_most_violated_dihedralangle_restraints.violated_models
_pdbx_vrpt_most_violated_dihedralangle_restraints.mean_angle_violation
_pdbx_vrpt_most_violated_dihedralangle_restraints.median_violation
_pdbx_vrpt_most_violated_dihedralangle_restraints.standard_deviation
1  63  1  .  A  10  G  ?     1  A  10  "O4'"  A  .  10  G  10  A  1  ?     "C1'"  .  A  10  G  ?     1  A  10  N9     A  .  10  G  10  A  1  ?     C4     9  2.41  2.00  1.05  
2  46  1  .  A  10  G  ?     1  A  10  "O4'"  A  .  10  G  10  A  1  ?     "C1'"  .  A  10  G  ?     1  A  10  "C2'"  A  .  10  G  10  A  1  ?     "C3'"  3  1.80  1.80  0.08  
#
loop_
_pdbx_vrpt_violated_dihedralangle_restraints.ordinal
_pdbx_vrpt_violated_dihedralangle_restraints.rest_id
_pdbx_vrpt_violated_dihedralangle_restraints.rlist_id
_pdbx_vrpt_violated_dihedralangle_restraints.instance_id_1
_pdbx_vrpt_violated_dihedralangle_restraints.instance_id_2
_pdbx_vrpt_violated_dihedralangle_restraints.instance_id_3
_pdbx_vrpt_violated_dihedralangle_restraints.instance_id_4
_pdbx_vrpt_violated_dihedralangle_restraints.atom_1
_pdbx_vrpt_violated_dihedralangle_restraints.atom_2
_pdbx_vrpt_violated_dihedralangle_restraints.atom_3
_pdbx_vrpt_violated_dihedralangle_restraints.atom_4
_pdbx_vrpt_violated_dihedralangle_restraints.violation
 1  63  1   25   25   25   25  "O4'"  "C1'"  N9     C4     4.20  
 2  63  1  100  100  100  100  "O4'"  "C1'"  N9     C4     4.20  
 3  63  1  115  115  115  115  "O4'"  "C1'"  N9     C4     2.80  
 4  63  1  130  130  130  130  "O4'"  "C1'"  N9     C4     2.30  
 5  63  1   10   10   10   10  "O4'"  "C1'"  N9     C4     2.00  
 6  63  1  145  145  145  145  "O4'"  "C1'"  N9     C4     1.90  
 7  46  1   85   85   85   85  "O4'"  "C1'"  "C2'"  "C3'"  1.90  
 8  46  1   70   70   70   70  "O4'"  "C1'"  "C2'"  "C3'"  1.80  
 9  63  1   70   70   70   70  "O4'"  "C1'"  N9     C4     1.70  
10  46  1  130  130  130  130  "O4'"  "C1'"  "C2'"  "C3'"  1.70  
11   5  1   62   62   63   63  "C3'"  "O3'"  P      "O5'"  1.60  
12  63  1   40   40   40   40  "O4'"  "C1'"  N9     C4     1.30  
13  63  1   55   55   55   55  "O4'"  "C1'"  N9     C4     1.30  
#
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  chemicalshiftanalysis  2.33                                                                  Y  
3  panav                  "Wang et al. (2010)"                                                  Y  
4  rci                    "v_1n_11_5_13_A (Berjanski et al., 2005)"                             N  
5  restraintsanalysis     v1.2                                                                  Y  
6  percentiles            "20191225.v01 (using entries in the PDB archive December 25th 2019)"  N  
##
