data_8ILW

_pdbx_vrpt_database.id    PDB
_pdbx_vrpt_database.code  8ILW
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   x-ray
#
_pdbx_vrpt_summary.entry_id                    8ILW
_pdbx_vrpt_summary.PDB_deposition_date         2023-03-04
_pdbx_vrpt_summary.PDB_revision_number         1
_pdbx_vrpt_summary.PDB_revision_date           2024-03-06
_pdbx_vrpt_summary.report_creation_date        2024-02-26:07:06
_pdbx_vrpt_summary.attempted_validation_steps  molprobity,validation-pack,xtriage,eds,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  "DNA (5'-D(*CP*AP*AP*CP*AP*CP*TP*TP*AP*AP*TP*CP*CP*AP*AP*A)-3')"  
2  polymer  "DNA (5'-D(*GP*TP*TP*TP*GP*GP*AP*TP*TP*AP*AP*GP*TP*GP*TP*T)-3')"  
3  polymer  "LMX1A factor"  
4  water    water  
#
loop_
_pdbx_vrpt_asym.label_asym_id
_pdbx_vrpt_asym.entity_id
A  1  
B  2  
C  3  
D  4  
E  4  
F  4  
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all    x-ray  
2  2.712  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   23.48  141614     ?     ?  
 2  2  1   43.95    3686  2.70  2.74  
 3  1  2  100.00  138981     ?     ?  
 4  2  2  100.00    3622  2.70  2.74  
 5  1  3  100.00  138945     ?     ?  
 6  2  3  100.00    3623  2.70  2.74  
 7  1  4   61.66  127900     ?     ?  
 8  2  4   63.37    3276  2.70  2.74  
 9  1  5    8.24  130704     ?     ?  
10  2  5   17.14    3359  2.70  2.74  
#
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  7  4  A  1  1  A  100.00  
 2  8  4  A  1  1  A  100.00  
 3  7  4  B  1  2  B  100.00  
 4  8  4  B  1  2  B  100.00  
 5  3  2  C  1  3  C  100.00  
 6  4  2  C  1  3  C  100.00  
 7  5  3  C  1  3  C  100.00  
 8  6  3  C  1  3  C  100.00  
 9  7  4  C  1  3  C   46.01  
10  8  4  C  1  3  C   46.58  
#
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  1.14  0.98  359  550  
2  1  2  B  B  1.33  1.02  369  570  
3  1  3  C  C  0.66  0.61  472  634  
#
_pdbx_vrpt_summary_geometry.ordinal                        1
_pdbx_vrpt_summary_geometry.percent_ramachandran_outliers  0.00
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers       0.00
_pdbx_vrpt_summary_geometry.clashscore                     11.19
_pdbx_vrpt_summary_geometry.num_H_reduce                   850
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ                 1200
_pdbx_vrpt_summary_geometry.bonds_RMSZ                     0.87
_pdbx_vrpt_summary_geometry.num_angles_RMSZ                1754
_pdbx_vrpt_summary_geometry.angles_RMSZ                    1.07
#
_pdbx_vrpt_summary_diffraction.exp_method                x-ray
_pdbx_vrpt_summary_diffraction.ordinal                   1
_pdbx_vrpt_summary_diffraction.bulk_solvent_b            22.620
_pdbx_vrpt_summary_diffraction.Wilson_B_estimate         71.828
_pdbx_vrpt_summary_diffraction.I_over_sigma              3.42(2.72A)
_pdbx_vrpt_summary_diffraction.num_miller_indices        7103
_pdbx_vrpt_summary_diffraction.bulk_solvent_k            0.230
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L_mean     0.474
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L2_mean    0.309
_pdbx_vrpt_summary_diffraction.Fo_Fc_correlation         0.933
_pdbx_vrpt_summary_diffraction.DCC_R                     0.25
_pdbx_vrpt_summary_diffraction.DCC_Rfree                 0.29
_pdbx_vrpt_summary_diffraction.EDS_R                     0.26
_pdbx_vrpt_summary_diffraction.EDS_res_high              2.71
_pdbx_vrpt_summary_diffraction.EDS_res_low               34.59
_pdbx_vrpt_summary_diffraction.Wilson_B_aniso            "[65.247,109.288,52.247,0.000,0.000,0.000]"
_pdbx_vrpt_summary_diffraction.data_anisotropy           0.755
_pdbx_vrpt_summary_diffraction.trans_NCS_details         "The largest off-origin peak in the Patterson function is 19.64% 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         5
_pdbx_vrpt_summary_diffraction.centric_outliers          5
_pdbx_vrpt_summary_diffraction.data_completeness         99.54
_pdbx_vrpt_summary_diffraction.number_reflns_R_free      539
_pdbx_vrpt_summary_diffraction.percent_free_reflections  7.59
_pdbx_vrpt_summary_diffraction.percent_RSRZ_outliers     2.17
_pdbx_vrpt_summary_diffraction.PDB_resolution_high       2.71
_pdbx_vrpt_summary_diffraction.PDB_resolution_low        34.59
_pdbx_vrpt_summary_diffraction.PDB_R                     0.25
_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_bond_outliers
_pdbx_vrpt_model_instance.count_angle_outliers
_pdbx_vrpt_model_instance.count_clashes
 1  1  1  A   1  DC   A    1  .  ?        ?     ?     ?  
 2  1  1  A   2  DA   A    2  .  ?        ?     ?     2  
 3  1  1  A   3  DA   A    3  .  ?        ?     ?     2  
 4  1  1  A   4  DC   A    4  .  ?        ?     ?     2  
 5  1  1  A   5  DA   A    5  .  ?        ?     ?     ?  
 6  1  1  A   6  DC   A    6  .  ?        ?     ?     3  
 7  1  1  A   7  DT   A    7  .  ?        ?     1     3  
 8  1  1  A   8  DT   A    8  .  ?        ?     ?     1  
 9  1  1  A   9  DA   A    9  .  ?        ?     ?     ?  
10  1  1  A  10  DA   A   10  .  ?        ?     ?     ?  
11  1  1  A  11  DT   A   11  .  ?        ?     ?     ?  
12  1  1  A  12  DC   A   12  .  ?        ?     ?     1  
13  1  1  A  13  DC   A   13  .  ?        ?     ?     1  
14  1  1  A  14  DA   A   14  .  ?        1     ?     ?  
15  1  1  A  15  DA   A   15  .  ?        ?     ?     1  
16  1  1  A  16  DA   A   16  .  ?        ?     ?     1  
17  1  2  B   1  DG   B    1  .  ?        ?     3     ?  
18  1  2  B   2  DT   B    2  .  ?        ?     ?     ?  
19  1  2  B   3  DT   B    3  .  ?        ?     ?     ?  
20  1  2  B   4  DT   B    4  .  ?        ?     ?     ?  
21  1  2  B   5  DG   B    5  .  ?        ?     ?     ?  
22  1  2  B   6  DG   B    6  .  ?        ?     ?     ?  
23  1  2  B   7  DA   B    7  .  ?        ?     ?     1  
24  1  2  B   8  DT   B    8  .  ?        ?     ?     ?  
25  1  2  B   9  DT   B    9  .  ?        ?     ?     ?  
26  1  2  B  10  DA   B   10  .  ?        ?     ?     ?  
27  1  2  B  11  DA   B   11  .  ?        ?     ?     ?  
28  1  2  B  12  DG   B   12  .  ?        ?     ?     ?  
29  1  2  B  13  DT   B   13  .  ?        1     ?     2  
30  1  2  B  14  DG   B   14  .  ?        ?     ?     3  
31  1  2  B  15  DT   B   15  .  ?        ?     ?     1  
32  1  2  B  16  DT   B   16  .  ?        ?     ?     ?  
33  1  3  C   1  LYS  C  196  .  ?        ?     ?     ?  
34  1  3  C   2  ARG  C  197  .  ?        ?     ?     ?  
35  1  3  C   3  PRO  C  198  .  ?        ?     ?     ?  
36  1  3  C   4  ARG  C  199  .  ?        ?     ?     ?  
37  1  3  C   5  THR  C  200  .  ?        ?     ?     1  
38  1  3  C   6  ILE  C  201  .  ?        ?     ?     ?  
39  1  3  C   7  LEU  C  202  .  ?        ?     ?     ?  
40  1  3  C   8  THR  C  203  .  ?        ?     ?     ?  
41  1  3  C   9  THR  C  204  .  ?        ?     ?     ?  
42  1  3  C  10  GLN  C  205  .  ?        ?     ?     ?  
43  1  3  C  11  GLN  C  206  .  ?        ?     ?     1  
44  1  3  C  12  ARG  C  207  .  ?        ?     ?     ?  
45  1  3  C  13  ARG  C  208  .  ?        ?     ?     ?  
46  1  3  C  14  ALA  C  209  .  ?        ?     ?     ?  
47  1  3  C  15  PHE  C  210  .  ?        ?     ?     ?  
48  1  3  C  16  LYS  C  211  .  ?        ?     ?     ?  
49  1  3  C  17  ALA  C  212  .  ?        ?     ?     ?  
50  1  3  C  18  SER  C  213  .  ?        ?     ?     ?  
51  1  3  C  19  PHE  C  214  .  ?        ?     ?     ?  
52  1  3  C  20  GLU  C  215  .  ?        ?     ?     ?  
53  1  3  C  21  VAL  C  216  .  ?        ?     ?     ?  
54  1  3  C  22  SER  C  217  .  ?        ?     ?     ?  
55  1  3  C  23  SER  C  218  .  ?        ?     ?     1  
56  1  3  C  24  LYS  C  219  .  ?        ?     ?     ?  
57  1  3  C  25  PRO  C  220  .  ?        ?     ?     ?  
58  1  3  C  26  CYS  C  221  .  ?        ?     ?     ?  
59  1  3  C  27  ARG  C  222  .  ?        ?     ?     2  
60  1  3  C  28  LYS  C  223  .  ?        ?     ?     ?  
61  1  3  C  29  VAL  C  224  .  ?        ?     ?     1  
62  1  3  C  30  ARG  C  225  .  ?        ?     ?     ?  
63  1  3  C  31  GLU  C  226  .  ?        ?     ?     1  
64  1  3  C  32  THR  C  227  .  ?        ?     ?     1  
65  1  3  C  33  LEU  C  228  .  ?        ?     ?     ?  
66  1  3  C  34  ALA  C  229  .  ?        ?     ?     ?  
67  1  3  C  35  ALA  C  230  .  ?        ?     ?     ?  
68  1  3  C  36  GLU  C  231  .  ?        ?     ?     ?  
69  1  3  C  37  THR  C  232  .  ?        ?     ?     1  
70  1  3  C  38  GLY  C  233  .  ?        ?     ?     ?  
71  1  3  C  39  LEU  C  234  .  ?        ?     ?     ?  
72  1  3  C  40  SER  C  235  .  ?        ?     ?     1  
73  1  3  C  41  VAL  C  236  .  ?        ?     ?     ?  
74  1  3  C  42  ARG  C  237  .  ?        ?     ?     ?  
75  1  3  C  43  VAL  C  238  .  ?        ?     ?     ?  
76  1  3  C  44  VAL  C  239  .  ?        ?     ?     1  
77  1  3  C  45  GLN  C  240  .  ?        ?     ?     ?  
78  1  3  C  46  VAL  C  241  .  ?        ?     ?     ?  
79  1  3  C  47  TRP  C  242  .  ?        ?     ?     ?  
80  1  3  C  48  PHE  C  243  .  ?        ?     ?     ?  
81  1  3  C  49  GLN  C  244  .  ?        ?     ?     ?  
82  1  3  C  50  ASN  C  245  .  ?        ?     ?     ?  
83  1  3  C  51  GLN  C  246  .  ?        ?     ?     1  
84  1  3  C  52  ARG  C  247  .  ?        ?     ?     1  
85  1  3  C  53  ALA  C  248  .  ?        ?     ?     1  
86  1  3  C  54  LYS  C  249  .  ?        ?     ?     ?  
87  1  3  C  55  MET  C  250  .  ?        ?     ?     1  
88  1  3  C  56  LYS  C  251  .  ?        ?     ?     ?  
89  1  3  C  57  LYS  C  252  .  ?        ?     ?     3  
90  1  3  C  58  LEU  C  253  .  ?        ?     ?     ?  
91  1  3  C  59  ALA  C  254  .  ?        ?     ?     ?  
92  1  3  C  60  ARG  C  255  .  ?        ?     ?     ?  
93  1  4  D   .  HOH  A  101  .  ?        ?     ?     ?  
94  1  4  E   .  HOH  B  101  .  ?        ?     ?     ?  
95  1  4  F   .  HOH  C  301  .  ?        ?     ?     ?  
#
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  ?             ?      ?  ?           ?    12   96.590    18  1.03    28  0.84  molprobity  1.000  
 2   2  ?             ?      ?  ?           ?    11   90.520    24  0.95    37  0.69  molprobity  1.000  
 3   3  ?             ?      ?  ?           ?    11   81.270    24  0.78    37  1.12  molprobity  1.000  
 4   4  ?             ?      ?  ?           ?    11   81.070    21  1.12    32  1.02  molprobity  1.000  
 5   5  ?             ?      ?  ?           ?    11   72.320    24  1.02    37  1.20  molprobity  1.000  
 6   6  ?             ?      ?  ?           ?    11   65.990    21  0.75    32  0.82  molprobity  1.000  
 7   7  ?             ?      ?  ?           ?    12   69.720    22  0.83    34  2.26  molprobity  1.000  
 8   8  ?             ?      ?  ?           ?    12   70.150    22  1.55    34  1.44  molprobity  1.000  
 9   9  ?             ?      ?  ?           ?    11   88.690    24  0.67    37  0.85  molprobity  1.000  
10  10  ?             ?      ?  ?           ?    11   83.200    24  0.88    37  0.64  molprobity  1.000  
11  11  ?             ?      ?  ?           ?    12   89.270    22  0.76    34  1.46  molprobity  1.000  
12  12  ?             ?      ?  ?           ?    11   97.430    21  0.85    32  0.89  molprobity  1.000  
13  13  ?             ?      ?  ?           ?    11  102.910    21  0.95    32  1.16  molprobity  1.000  
14  14  ?             ?      ?  ?           ?    11  109.280    24  1.31    37  1.19  molprobity  1.000  
15  15  ?             ?      ?  ?           ?    11  132.390    24  0.81    37  1.02  molprobity  1.000  
16  16  ?             ?      ?  ?           ?    12  138.700    23  1.02    33  0.56  molprobity  1.000  
17  17  ?             ?      ?  ?           ?    12   97.210    22  1.60    35  2.73  molprobity  1.000  
18  18  ?             ?      ?  ?           ?    12   96.610    22  1.17    34  1.40  molprobity  1.000  
19  19  ?             ?      ?  ?           ?    12   90.960    22  0.89    34  1.59  molprobity  1.000  
20  20  ?             ?      ?  ?           ?    12   90.170    22  0.59    34  1.40  molprobity  1.000  
21  21  ?             ?      ?  ?           ?    11   79.340    25  1.18    39  1.16  molprobity  1.000  
22  22  ?             ?      ?  ?           ?    11   67.370    25  0.88    39  0.69  molprobity  1.000  
23  23  ?             ?      ?  ?           ?    11   66.630    24  1.11    37  0.87  molprobity  1.000  
24  24  ?             ?      ?  ?           ?    12   71.450    22  0.94    34  1.30  molprobity  1.000  
25  25  ?             ?      ?  ?           ?    12   84.050    22  0.95    34  1.61  molprobity  1.000  
26  26  ?             ?      ?  ?           ?    11  102.460    24  0.73    37  0.64  molprobity  1.000  
27  27  ?             ?      ?  ?           ?    11  117.280    24  0.76    37  0.55  molprobity  1.000  
28  28  ?             ?      ?  ?           ?    11  101.420    25  0.71    39  0.87  molprobity  1.000  
29  29  ?             ?      ?  ?           ?    12  103.290    22  1.40    34  1.59  molprobity  1.000  
30  30  ?             ?      ?  ?           ?    11   81.960    25  0.93    39  0.87  molprobity  1.000  
31  31  ?             ?      ?  ?           ?    12   74.820    22  0.94    34  1.33  molprobity  1.000  
32  32  ?             ?      ?  ?           ?    13   82.020    21  1.06    30  1.30  molprobity  1.000  
33  33  mttm          ?      ?  ?           ?    12  121.250     9  0.36    11  0.75  molprobity  1.000  
34  34  ?        -102.0  152.5  Favored     ?     2  112.830     5  0.27     8  0.45  molprobity  1.000  
35  35  Cg_exo    -65.6  149.1  Favored     ?     7  111.570     8  0.17    11  0.41  molprobity  1.000  
36  36  ptp85     -90.2  166.7  Favored     ?    13   90.260    11  0.55    14  0.70  molprobity  1.000  
37  37  m        -101.2  152.6  Favored     ?     7   72.730     7  0.29    10  0.99  molprobity  1.000  
38  38  pp       -131.4  147.2  Favored     ?    11   88.280     8  0.30    11  0.58  molprobity  1.000  
39  39  mp       -119.4  137.3  Favored     ?    11   70.610     8  0.43    11  0.91  molprobity  1.000  
40  40  p         -65.7  148.7  Favored     ?     7   68.890     7  0.25    10  0.78  molprobity  1.000  
41  41  p         -56.4  -45.1  Favored     ?     7   77.850     7  0.22    10  0.62  molprobity  1.000  
42  42  ?         -56.3  -35.2  Favored     ?     2   69.610     5  0.20     7  0.19  molprobity  1.000  
43  43  mt-30     -73.1  -45.8  Favored     ?     8   57.040     9  0.51    12  0.82  molprobity  1.000  
44  44  ttm105    -66.6  -41.7  Favored     ?    13   65.840    11  0.44    14  0.66  molprobity  1.000  
45  45  ?         -46.7  -43.5  Favored     ?     2   67.930     5  0.22     7  0.39  molprobity  1.000  
46  46  ?         -65.5  -50.5  Favored     ?     5   54.810     5  0.23     7  0.40  molprobity  1.000  
47  47  m-30      -63.0  -51.8  Favored     ?     9   46.970    12  1.10    16  0.66  molprobity  1.000  
48  48  mttt      -55.0  -40.7  Favored     ?    13   71.410     9  0.66    11  0.50  molprobity  1.000  
49  49  ?         -60.3  -48.8  Favored     ?     5   45.510     5  0.25     7  0.80  molprobity  1.000  
50  50  t         -67.0  -32.6  Favored     ?     5   52.180     6  0.31     8  0.67  molprobity  1.000  
51  51  t80       -63.8  -26.4  Favored     ?     9   54.140    12  0.45    16  0.46  molprobity  1.000  
52  52  tp10      -61.5  -15.0  Favored     ?     6   48.090     9  0.88    12  0.78  molprobity  1.000  
53  53  t        -119.5  -42.8  Favored     ?     9   41.120     7  0.63    10  0.71  molprobity  1.000  
54  54  t        -137.2  129.2  Favored     ?     5   52.840     6  0.39     8  0.66  molprobity  1.000  
55  55  p         -62.9  -15.6  Favored     ?     5   61.090     6  0.65     8  0.54  molprobity  1.000  
56  56  mttt     -136.1   72.2  Favored     ?    13   50.120     9  1.28    12  0.75  molprobity  1.000  
57  57  Cg_endo   -72.4  145.1  Favored     ?     7   63.200     8  0.46    11  0.54  molprobity  1.000  
58  58  p         -74.4  178.3  Favored     ?     5   49.720     6  0.33     8  0.78  molprobity  1.000  
59  59  ttm-85    -70.0  -44.9  Favored     ?    13   53.240    11  0.33    14  0.62  molprobity  1.000  
60  60  ?         -58.2  -21.6  Favored     ?     2   55.550     5  0.24     7  0.32  molprobity  1.000  
61  61  t         -79.8  -57.4  Favored     ?     9   43.350     7  0.34    10  0.44  molprobity  1.000  
62  62  mtm-85    -40.7  -43.6  Favored     ?    13   45.580    11  0.86    14  0.86  molprobity  1.000  
63  63  mt-10     -58.6  -41.5  Favored     ?     6   56.940     9  0.22    12  0.61  molprobity  1.000  
64  64  m         -71.0  -39.9  Favored     ?     7   57.100     7  0.47    10  0.86  molprobity  1.000  
65  65  mt        -58.8  -38.4  Favored     ?    11   47.390     8  0.35    11  0.48  molprobity  1.000  
66  66  ?         -61.5  -55.5  Favored     ?     5   44.490     5  0.24     7  0.35  molprobity  1.000  
67  67  ?         -52.2  -47.2  Favored     ?     5   51.340     5  0.30     7  0.40  molprobity  1.000  
68  68  tt0       -58.6  -52.7  Favored     ?     6   77.660     9  0.64    12  0.34  molprobity  1.000  
69  69  p         -86.4   -5.9  Favored     ?     7   60.790     7  0.32    10  0.78  molprobity  1.000  
70  70  ?          69.4   18.0  Favored     ?     3   74.850     4  0.45     5  0.57  molprobity  1.000  
71  71  mt       -102.5  173.7  Favored     ?    11   64.620     8  0.22    11  0.56  molprobity  1.000  
72  72  p         -77.7  161.3  Favored     ?     5   56.500     6  0.46     8  0.65  molprobity  1.000  
73  73  t         -71.9  -38.5  Favored     ?     9   50.460     7  0.52    10  0.67  molprobity  1.000  
74  74  tpt180    -56.6  -42.2  Favored     ?    13   62.730    11  0.80    14  1.04  molprobity  1.000  
75  75  t         -58.9  -46.9  Favored     ?     9   52.800     7  0.75    10  0.65  molprobity  1.000  
76  76  t         -52.6  -56.4  Favored     ?     9   41.210     7  0.62    10  0.71  molprobity  1.000  
77  77  tt0       -49.8  -44.8  Favored     1     8   55.580     9  0.90    12  0.83  molprobity  1.000  
78  78  m         -77.8  -29.9  Favored     ?     9   58.380     7  1.04    10  0.74  molprobity  1.000  
79  79  t90       -61.2  -42.8  Favored     ?    10   51.340    16  0.50    23  0.26  molprobity  1.000  
80  80  m-85      -62.8  -45.9  Favored     ?     9   46.720    12  1.49    16  0.54  molprobity  1.000  
81  81  mt-30     -53.2  -45.8  Favored     ?     8   49.230     9  0.67    12  0.75  molprobity  1.000  
82  82  m-20      -72.0  -42.7  Favored     ?     6   56.380     8  0.36    11  0.61  molprobity  1.000  
83  83  tp60      -68.4  -26.4  Favored     ?     8   74.110     9  0.50    12  0.52  molprobity  1.000  
84  84  mtm-85    -61.0  -56.2  Favored     ?    13   54.030    11  0.55    14  0.76  molprobity  1.000  
85  85  ?         -59.4  -38.1  Favored     ?     5   70.330     5  0.23     7  0.21  molprobity  1.000  
86  86  tttt      -49.1  -45.3  Favored     ?    13   66.040     9  0.57    11  1.00  molprobity  1.000  
87  87  mmm       -77.6  -39.5  Favored     ?     9   64.910     8  0.33    10  0.58  molprobity  1.000  
88  88  mmtt      -58.1  -29.1  Favored     ?    13   91.680     9  0.68    11  0.63  molprobity  1.000  
89  89  mmmt      -83.8  -28.5  Favored     ?    13  104.800     9  0.68    11  0.77  molprobity  1.000  
90  90  mt        -64.0  -41.3  Favored     ?    11   75.440     8  0.37    11  0.70  molprobity  1.000  
91  91  ?         -74.9    6.9  Favored     ?     5   95.530     5  0.38     7  0.69  molprobity  1.000  
92  92  ?             ?      ?  ?           ?     2  105.930     4  0.36     4  0.40  molprobity  1.000  
93  93  ?             ?      ?  ?           ?     ?   65.130     ?     ?     ?     ?  ?           1.000  
94  94  ?             ?      ?  ?           ?     ?   39.030     ?     ?     ?     ?  ?           1.000  
95  95  ?             ?      ?  ?           ?     ?   50.400     ?     ?     ?     ?  ?           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   2  OP2      1  0.46  1.98  
 2   2  H8       1  0.46  1.98  
 3   3  "H2''"   2  0.59  1.82  
 4   3  "C2'"    3  0.52  2.40  
 5   4  "H5''"   2  0.59  1.82  
 6   4  "H5''"   3  0.52  2.40  
 7   6  "H2''"   4  0.42  2.49  
 8   6  "H2''"   5  0.42  2.01  
 9   6  P        6  0.41  2.44  
10   7  "C5'"    4  0.42  2.49  
11   7  "H5''"   5  0.42  2.01  
12   7  "H2'"    7  0.41  2.01  
13   8  H71      7  0.41  2.01  
14  12  "H1'"    8  0.45  1.99  
15  13  "H5'"    8  0.45  1.99  
16  15  "H2''"   9  0.43  2.18  
17  16  OP2      9  0.43  2.18  
18  23  OP1     10  0.56  2.23  
19  29  "H2''"  11  0.43  2.00  
20  29  "H2''"  12  0.41  2.51  
21  30  "H2''"  13  0.53  1.91  
22  30  "H5'"   11  0.43  2.00  
23  30  "C5'"   12  0.41  2.51  
24  31  "H5'"   13  0.53  1.91  
25  37  OG1     10  0.56  2.23  
26  43  HG2     14  0.41  2.02  
27  55  O       15  0.52  2.40  
28  59  O       16  0.50  2.10  
29  59  HH21     6  0.41  2.44  
30  61  O       17  0.45  2.50  
31  63  HG3     16  0.50  2.10  
32  64  N       17  0.45  2.50  
33  69  HB      14  0.41  2.02  
34  72  O       18  0.40  2.21  
35  76  HG23    18  0.40  2.21  
36  83  O       19  0.43  2.17  
37  84  NH1     15  0.52  2.40  
38  85  O       20  0.46  2.16  
39  87  HG2     19  0.43  2.17  
40  89  HG2     20  0.46  2.16  
41  89  N       21  0.44  2.33  
42  89  HD2     21  0.44  2.33  
#
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  14  "C3'"  "O3'"  1.368  1.435  0.013  -5.18  
2  29  "C3'"  "O3'"  1.368  1.435  0.013  -5.18  
#
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   7  "O5'"  P      OP2     96.797  105.700  0.900  -9.89  
2  17  "C1'"  "O4'"  "C4'"  103.812  110.100  1.000  -6.29  
3  17  "C3'"  "C2'"  "C1'"   92.639  102.500  1.200  -8.22  
4  17  "O4'"  "C1'"  N9     114.234  108.000  0.700   8.91  
#
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  16  0.894  0.194   0.187  
 2   2  21  0.911  0.098  -1.202  
 3   3  21  0.931  0.098  -1.202  
 4   4  19  0.917  0.118  -0.961  
 5   5  21  0.895  0.140  -0.555  
 6   6  19  0.954  0.143  -0.583  
 7   7  20  0.971  0.119  -0.892  
 8   8  20  0.955  0.117  -0.921  
 9   9  21  0.943  0.086  -1.387  
10  10  21  0.938  0.097  -1.217  
11  11  20  0.955  0.130  -0.734  
12  12  19  0.946  0.092  -1.353  
13  13  19  0.927  0.119  -0.946  
14  14  21  0.942  0.097  -1.217  
15  15  21  0.905  0.122  -0.832  
16  16  21  0.907  0.178   0.031  
17  17  19  0.895  0.151  -0.373  
18  18  20  0.907  0.182   0.013  
19  19  20  0.912  0.145  -0.519  
20  20  20  0.923  0.119  -0.892  
21  21  22  0.932  0.144  -0.491  
22  22  22  0.972  0.122  -0.861  
23  23  21  0.964  0.116  -0.924  
24  24  20  0.962  0.114  -0.964  
25  25  20  0.939  0.104  -1.108  
26  26  21  0.926  0.115  -0.940  
27  27  21  0.913  0.129  -0.724  
28  28  22  0.946  0.149  -0.407  
29  29  20  0.921  0.167  -0.203  
30  30  22  0.967  0.095  -1.314  
31  31  20  0.968  0.088  -1.338  
32  32  20  0.962  0.123  -0.835  
33  33   9  0.715  0.331   1.260  
34  34   5  0.933  0.123  -1.014  
35  35   7  0.928  0.174   0.102  
36  36  11  0.909  0.169  -0.440  
37  37   7  0.960  0.133  -0.528  
38  38   8  0.913  0.496   4.548  
39  39   8  0.966  0.270   1.111  
40  40   7  0.953  0.122  -0.688  
41  41   7  0.936  0.154  -0.222  
42  42   5  0.969  0.119  -0.952  
43  43   9  0.932  0.198   0.039  
44  44  11  0.924  0.271   0.832  
45  45   5  0.963  0.172  -0.403  
46  46   5  0.959  0.157  -0.145  
47  47  11  0.957  0.261   1.128  
48  48   9  0.935  0.248   0.314  
49  49   5  0.958  0.139  -0.405  
50  50   6  0.947  0.138  -0.386  
51  51  11  0.946  0.230   0.682  
52  52   9  0.956  0.137  -0.836  
53  53   7  0.973  0.166  -0.227  
54  54   6  0.957  0.134  -0.442  
55  55   6  0.882  0.139  -0.372  
56  56   9  0.950  0.200  -0.234  
57  57   7  0.960  0.175   0.117  
58  58   6  0.968  0.130  -0.282  
59  59  11  0.958  0.172  -0.403  
60  60   5  0.968  0.173  -0.542  
61  61   7  0.968  0.155  -0.389  
62  62  11  0.951  0.198  -0.079  
63  63   9  0.960  0.157  -0.596  
64  64   7  0.960  0.154  -0.222  
65  65   8  0.963  0.201   0.132  
66  66   5  0.984  0.124  -0.622  
67  67   5  0.988  0.121  -0.666  
68  68   9  0.929  0.209   0.030  
69  69   7  0.973  0.156  -0.192  
70  70   4  0.964  0.179   0.244  
71  71   8  0.931  0.262   0.997  
72  72   6  0.964  0.124  -0.581  
73  73   7  0.970  0.170  -0.169  
74  74  11  0.912  0.281   0.956  
75  75   7  0.953  0.185   0.051  
76  76   7  0.966  0.255   1.078  
77  77   9  0.929  0.238   0.541  
78  78   7  0.966  0.207   0.374  
79  79  14  0.936  0.183   0.156  
80  80  11  0.914  0.241   0.840  
81  81   9  0.912  0.231   0.453  
82  82   8  0.967  0.144  -0.446  
83  83   9  0.931  0.220   0.315  
84  84  11  0.944  0.135  -0.864  
85  85   5  0.965  0.161  -0.087  
86  86   9  0.933  0.183  -0.428  
87  87   8  0.949  0.138  -0.511  
88  88   9  0.874  0.289   0.781  
89  89   9  0.821  0.397   2.013  
90  90   8  0.930  0.176  -0.223  
91  91   5  0.879  0.174   0.101  
92  92   5  0.743  0.213   0.108  
93  93   1  0.965  0.163       ?  
94  94   1  0.834  0.238       ?  
95  95   1  0.965  0.358       ?  
#
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  eds          2.36                                                                  Y  
3  dcc          '"2.27  (2023-04-10)"'                                                Y  
4  xtriage      1.13                                                                  Y  
5  percentiles  "20191225.v01 (using entries in the PDB archive December 25th 2019)"  Y  
##
