data_1LJX

loop_
_pdbx_vrpt_database.id
_pdbx_vrpt_database.code
PDB  1LJX    
NDB  ZD0007  
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   x-ray
#
_pdbx_vrpt_summary.entry_id                    1LJX
_pdbx_vrpt_summary.PDB_deposition_date         2002-04-23
_pdbx_vrpt_summary.PDB_revision_number         5
_pdbx_vrpt_summary.PDB_revision_date           2023-08-16
_pdbx_vrpt_summary.report_creation_date        2023-08-06:12:31
_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      "5'-D(*TP*GP*CP*GP*CP*A)-3'"  
2  non-polymer  "MAGNESIUM ION"  
3  water        water  
#
loop_
_pdbx_vrpt_asym.label_asym_id
_pdbx_vrpt_asym.entity_id
A  1  
B  1  
C  2  
D  2  
E  3  
F  3  
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all   x-ray  
2  1.64  x-ray  
#
loop_
_pdbx_vrpt_percentile_type.id
_pdbx_vrpt_percentile_type.type
1  all_atom_clashscore    
2  RSRZ_outliers_percent  
3  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   13.72  141614     ?     ?  
2  2  1    2.63    3268  1.62  1.66  
3  1  2  100.00  127900     ?     ?  
4  2  2  100.00    3079  1.62  1.66  
5  1  3   19.18  130704     ?     ?  
6  2  3    2.81    3122  1.62  1.66  
#
loop_
_pdbx_vrpt_percentile_entity_view.ordinal
_pdbx_vrpt_percentile_entity_view.conditions_id
_pdbx_vrpt_percentile_entity_view.type_id
_pdbx_vrpt_percentile_entity_view.label_asym_id
_pdbx_vrpt_percentile_entity_view.PDB_model_num
_pdbx_vrpt_percentile_entity_view.entity_id
_pdbx_vrpt_percentile_entity_view.auth_asym_id
_pdbx_vrpt_percentile_entity_view.rank
1  3  2  A  1  1  A  100.00  
2  4  2  A  1  1  A  100.00  
3  3  2  B  1  1  B  100.00  
4  4  2  B  1  1  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  1.21  0.43  134  205  
2  1  1  B  B  1.49  0.46  134  205  
#
_pdbx_vrpt_summary_geometry.ordinal          1
_pdbx_vrpt_summary_geometry.clashscore       15.79
_pdbx_vrpt_summary_geometry.num_H_reduce     138
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ   268
_pdbx_vrpt_summary_geometry.bonds_RMSZ       0.45
_pdbx_vrpt_summary_geometry.num_angles_RMSZ  410
_pdbx_vrpt_summary_geometry.angles_RMSZ      1.36
#
_pdbx_vrpt_summary_diffraction.exp_method                x-ray
_pdbx_vrpt_summary_diffraction.ordinal                   1
_pdbx_vrpt_summary_diffraction.Babinet_b                 126.435
_pdbx_vrpt_summary_diffraction.bulk_solvent_b            49.939
_pdbx_vrpt_summary_diffraction.Wilson_B_estimate         14.486
_pdbx_vrpt_summary_diffraction.I_over_sigma              11.38(1.64A)
_pdbx_vrpt_summary_diffraction.num_miller_indices        3445
_pdbx_vrpt_summary_diffraction.Babinet_k                 0.310
_pdbx_vrpt_summary_diffraction.bulk_solvent_k            0.302
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L_mean     0.499
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L2_mean    0.341
_pdbx_vrpt_summary_diffraction.Fo_Fc_correlation         0.957
_pdbx_vrpt_summary_diffraction.DCC_R                     0.21
_pdbx_vrpt_summary_diffraction.DCC_Rfree                 0.27
_pdbx_vrpt_summary_diffraction.EDS_R                     0.22
_pdbx_vrpt_summary_diffraction.EDS_res_high              1.64
_pdbx_vrpt_summary_diffraction.EDS_res_low               19.12
_pdbx_vrpt_summary_diffraction.Wilson_B_aniso            "[16.552,15.115,12.208,0.000,0.000,0.000]"
_pdbx_vrpt_summary_diffraction.data_anisotropy           0.297
_pdbx_vrpt_summary_diffraction.trans_NCS_details         "The analyses of the Patterson function reveals a significant off-origin peak that is 32.25 % of the origin peak, indicating pseudo-translational symmetry.  The chance of finding a peak of this or larger height by random in a structure without pseudo-translational symmetry is equal to 9.6956e-04. The detected translational NCS is most likely also responsible for the elevated intensity ratio.  See the relevant section of the logfile for more details."
_pdbx_vrpt_summary_diffraction.B_factor_type             FULL
_pdbx_vrpt_summary_diffraction.acentric_outliers         4
_pdbx_vrpt_summary_diffraction.centric_outliers          2
_pdbx_vrpt_summary_diffraction.data_completeness         95.20
_pdbx_vrpt_summary_diffraction.number_reflns_R_free      341
_pdbx_vrpt_summary_diffraction.percent_free_reflections  9.90
_pdbx_vrpt_summary_diffraction.percent_RSRZ_outliers     0.00
_pdbx_vrpt_summary_diffraction.PDB_resolution_high       1.64
_pdbx_vrpt_summary_diffraction.PDB_resolution_low        19.00
_pdbx_vrpt_summary_diffraction.PDB_R                     0.21
_pdbx_vrpt_summary_diffraction.PDB_Rfree                 0.27
#
loop_
_pdbx_vrpt_model_instance.id
_pdbx_vrpt_model_instance.PDB_model_num
_pdbx_vrpt_model_instance.entity_id
_pdbx_vrpt_model_instance.label_asym_id
_pdbx_vrpt_model_instance.label_seq_id
_pdbx_vrpt_model_instance.label_comp_id
_pdbx_vrpt_model_instance.auth_asym_id
_pdbx_vrpt_model_instance.auth_seq_id
_pdbx_vrpt_model_instance.label_alt_id
_pdbx_vrpt_model_instance.PDB_ins_code
_pdbx_vrpt_model_instance.count_angle_outliers
_pdbx_vrpt_model_instance.count_clashes
_pdbx_vrpt_model_instance.count_chiral_outliers
 1  1  1  A  1  DT   A   1  .  ?        ?     1     ?  
 2  1  1  A  2  DG   A   2  .  ?        ?     5     ?  
 3  1  1  A  3  DC   A   3  .  ?        ?     ?     ?  
 4  1  1  A  4  DG   A   4  .  ?        3     ?     1  
 5  1  1  A  5  DC   A   5  .  ?        ?     ?     ?  
 6  1  1  A  6  DA   A   6  .  ?        ?     2     ?  
 7  1  1  B  1  DT   B   7  .  ?        ?     ?     ?  
 8  1  1  B  2  DG   B   8  .  ?        3     ?     1  
 9  1  1  B  3  DC   B   9  .  ?        ?     ?     ?  
10  1  1  B  4  DG   B  10  .  ?        3     ?     1  
11  1  1  B  5  DC   B  11  .  ?        ?     ?     ?  
12  1  1  B  6  DA   B  12  .  ?        ?     3     ?  
13  1  2  C  .  MG   A  19  .  ?        ?     ?     ?  
14  1  2  D  .  MG   B  18  .  ?        ?     ?     ?  
15  1  3  E  .  HOH  A  14  .  ?        ?     ?     ?  
16  1  3  E  .  HOH  A  17  .  ?        ?     ?     ?  
17  1  3  E  .  HOH  A  20  .  ?        ?     ?     ?  
18  1  3  E  .  HOH  A  22  .  ?        ?     ?     ?  
19  1  3  E  .  HOH  A  23  .  ?        ?     ?     ?  
20  1  3  E  .  HOH  A  24  .  ?        ?     ?     ?  
21  1  3  E  .  HOH  A  25  .  ?        ?     ?     ?  
22  1  3  E  .  HOH  A  26  .  ?        ?     ?     ?  
23  1  3  E  .  HOH  A  30  .  ?        ?     ?     ?  
24  1  3  E  .  HOH  A  36  .  ?        ?     ?     ?  
25  1  3  E  .  HOH  A  38  .  ?        ?     ?     ?  
26  1  3  E  .  HOH  A  39  .  ?        ?     ?     ?  
27  1  3  E  .  HOH  A  40  .  ?        ?     ?     ?  
28  1  3  E  .  HOH  A  44  .  ?        ?     ?     ?  
29  1  3  E  .  HOH  A  51  .  ?        ?     ?     ?  
30  1  3  E  .  HOH  A  55  .  ?        ?     ?     ?  
31  1  3  E  .  HOH  A  56  .  ?        ?     ?     ?  
32  1  3  E  .  HOH  A  59  .  ?        ?     ?     ?  
33  1  3  E  .  HOH  A  63  .  ?        ?     ?     ?  
34  1  3  E  .  HOH  A  67  .  ?        ?     ?     ?  
35  1  3  F  .  HOH  B  13  .  ?        ?     ?     ?  
36  1  3  F  .  HOH  B  15  .  ?        ?     ?     ?  
37  1  3  F  .  HOH  B  16  .  ?        ?     ?     ?  
38  1  3  F  .  HOH  B  21  .  ?        ?     ?     ?  
39  1  3  F  .  HOH  B  27  .  ?        ?     ?     ?  
40  1  3  F  .  HOH  B  28  .  ?        ?     ?     ?  
41  1  3  F  .  HOH  B  29  .  ?        ?     ?     ?  
42  1  3  F  .  HOH  B  31  .  ?        ?     ?     ?  
43  1  3  F  .  HOH  B  32  .  ?        ?     ?     ?  
44  1  3  F  .  HOH  B  33  .  ?        ?     ?     ?  
45  1  3  F  .  HOH  B  34  .  ?        ?     ?     ?  
46  1  3  F  .  HOH  B  35  .  ?        ?     ?     ?  
47  1  3  F  .  HOH  B  37  .  ?        ?     ?     ?  
48  1  3  F  .  HOH  B  41  .  ?        ?     ?     ?  
49  1  3  F  .  HOH  B  42  .  ?        ?     ?     ?  
50  1  3  F  .  HOH  B  43  .  ?        ?     ?     ?  
51  1  3  F  .  HOH  B  45  .  ?        ?     ?     ?  
52  1  3  F  .  HOH  B  46  .  ?        ?     ?     ?  
53  1  3  F  .  HOH  B  47  .  ?        ?     ?     ?  
54  1  3  F  .  HOH  B  48  .  ?        ?     ?     ?  
55  1  3  F  .  HOH  B  49  .  ?        ?     ?     ?  
56  1  3  F  .  HOH  B  50  .  ?        ?     ?     ?  
57  1  3  F  .  HOH  B  52  .  ?        ?     1     ?  
58  1  3  F  .  HOH  B  53  .  ?        ?     ?     ?  
59  1  3  F  .  HOH  B  54  .  ?        ?     ?     ?  
60  1  3  F  .  HOH  B  57  .  ?        ?     ?     ?  
61  1  3  F  .  HOH  B  58  .  ?        ?     ?     ?  
62  1  3  F  .  HOH  B  60  .  ?        ?     ?     ?  
63  1  3  F  .  HOH  B  61  .  ?        ?     ?     ?  
64  1  3  F  .  HOH  B  62  .  ?        ?     ?     ?  
65  1  3  F  .  HOH  B  64  .  ?        ?     ?     ?  
66  1  3  F  .  HOH  B  65  .  ?        ?     ?     ?  
67  1  3  F  .  HOH  B  66  .  ?        ?     ?     ?  
68  1  3  F  .  HOH  B  68  .  ?        ?     ?     ?  
69  1  3  F  .  HOH  B  69  .  ?        ?     ?     ?  
70  1  3  F  .  HOH  B  70  .  ?        ?     ?     ?  
71  1  3  F  .  HOH  B  71  .  ?        ?     ?     ?  
72  1  3  F  .  HOH  B  72  .  ?        ?     ?     ?  
#
loop_
_pdbx_vrpt_model_instance_geometry.ordinal
_pdbx_vrpt_model_instance_geometry.instance_id
_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    13  18.920    19  0.43    30  0.54  molprobity  1.000  
 2   2    11  17.010    25  0.35    39  1.07  molprobity  1.000  
 3   3    11  13.930    21  0.17    32  0.77  molprobity  1.000  
 4   4    11  15.980    25  0.75    39  2.25  molprobity  1.000  
 5   5    11  14.470    21  0.26    32  0.70  molprobity  1.000  
 6   6    12  14.790    23  0.31    33  0.66  molprobity  1.000  
 7   7    13  12.600    19  0.28    30  0.52  molprobity  1.000  
 8   8    11  13.810    25  0.65    39  2.29  molprobity  1.000  
 9   9    11  12.950    21  0.28    32  0.64  molprobity  1.000  
10  10    11  17.080    25  0.66    39  2.30  molprobity  1.000  
11  11    11  18.580    21  0.23    32  0.58  molprobity  1.000  
12  12    12  20.410    23  0.34    33  0.66  molprobity  1.000  
13  13     ?  13.460     ?     ?     ?     ?  ?           1.000  
14  14     ?  20.220     ?     ?     ?     ?  ?           1.000  
15  15     ?  25.440     ?     ?     ?     ?  ?           1.000  
16  16     ?  57.170     ?     ?     ?     ?  ?           1.000  
17  17     ?  22.290     ?     ?     ?     ?  ?           1.000  
18  18     ?  26.580     ?     ?     ?     ?  ?           1.000  
19  19     ?  24.400     ?     ?     ?     ?  ?           1.000  
20  20     ?  57.610     ?     ?     ?     ?  ?           1.000  
21  21     ?  37.400     ?     ?     ?     ?  ?           1.000  
22  22     ?  30.940     ?     ?     ?     ?  ?           1.000  
23  23     ?  26.940     ?     ?     ?     ?  ?           1.000  
24  24     ?  40.840     ?     ?     ?     ?  ?           1.000  
25  25     ?  30.300     ?     ?     ?     ?  ?           1.000  
26  26     ?  32.940     ?     ?     ?     ?  ?           1.000  
27  27     ?  25.470     ?     ?     ?     ?  ?           1.000  
28  28     ?  42.360     ?     ?     ?     ?  ?           1.000  
29  29     ?  33.540     ?     ?     ?     ?  ?           1.000  
30  30     ?  30.300     ?     ?     ?     ?  ?           1.000  
31  31     ?  18.980     ?     ?     ?     ?  ?           1.000  
32  32     ?  23.200     ?     ?     ?     ?  ?           1.000  
33  33     ?  31.830     ?     ?     ?     ?  ?           1.000  
34  34     ?  41.210     ?     ?     ?     ?  ?           1.000  
35  35     ?  20.540     ?     ?     ?     ?  ?           1.000  
36  36     ?  30.900     ?     ?     ?     ?  ?           1.000  
37  37     ?  18.720     ?     ?     ?     ?  ?           1.000  
38  38     ?  18.370     ?     ?     ?     ?  ?           1.000  
39  39     ?  31.620     ?     ?     ?     ?  ?           1.000  
40  40     ?  30.540     ?     ?     ?     ?  ?           1.000  
41  41     ?  23.780     ?     ?     ?     ?  ?           1.000  
42  42     ?  31.140     ?     ?     ?     ?  ?           1.000  
43  43     ?  41.720     ?     ?     ?     ?  ?           1.000  
44  44     ?  34.790     ?     ?     ?     ?  ?           1.000  
45  45     ?  27.940     ?     ?     ?     ?  ?           1.000  
46  46     ?  27.140     ?     ?     ?     ?  ?           1.000  
47  47     ?  56.650     ?     ?     ?     ?  ?           1.000  
48  48     ?  34.620     ?     ?     ?     ?  ?           1.000  
49  49     ?  17.700     ?     ?     ?     ?  ?           1.000  
50  50     ?  37.560     ?     ?     ?     ?  ?           1.000  
51  51     ?  46.620     ?     ?     ?     ?  ?           1.000  
52  52     ?  36.300     ?     ?     ?     ?  ?           1.000  
53  53     ?  32.790     ?     ?     ?     ?  ?           1.000  
54  54     ?  23.080     ?     ?     ?     ?  ?           1.000  
55  55     ?  25.660     ?     ?     ?     ?  ?           1.000  
56  56     ?  23.450     ?     ?     ?     ?  ?           1.000  
57  57     ?  27.550     ?     ?     ?     ?  ?           1.000  
58  58     ?  20.450     ?     ?     ?     ?  ?           1.000  
59  59     ?  28.130     ?     ?     ?     ?  ?           1.000  
60  60     ?  45.280     ?     ?     ?     ?  ?           1.000  
61  61     ?  26.340     ?     ?     ?     ?  ?           1.000  
62  62     ?  37.020     ?     ?     ?     ?  ?           1.000  
63  63     ?  35.620     ?     ?     ?     ?  ?           1.000  
64  64     ?  42.020     ?     ?     ?     ?  ?           1.000  
65  65     ?  32.670     ?     ?     ?     ?  ?           1.000  
66  66     ?  56.220     ?     ?     ?     ?  ?           1.000  
67  67     ?  26.860     ?     ?     ?     ?  ?           1.000  
68  68     ?  55.650     ?     ?     ?     ?  ?           1.000  
69  69     ?  46.010     ?     ?     ?     ?  ?           1.000  
70  70     ?  32.460     ?     ?     ?     ?  ?           1.000  
71  71     ?  46.640     ?     ?     ?     ?  ?           1.000  
72  72     ?  55.790     ?     ?     ?     ?  ?           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   1  "H4'"   1  0.49  1.94  
 2   2  N3      2  0.59  2.18  
 3   2  N3      3  0.40  2.83  
 4   2  "H2'"   2  0.59  2.18  
 5   2  "H5''"  1  0.49  1.94  
 6   2  "C2'"   3  0.40  2.83  
 7   6  "H2'"   4  0.45  2.31  
 8   6  N3      4  0.45  2.31  
 9  12  "H5''"  5  0.60  2.01  
10  12  N3      6  0.54  2.23  
11  12  "H2'"   6  0.54  2.23  
12  57  O       5  0.60  2.01  
#
loop_
_pdbx_vrpt_instance_stereo_outliers.ordinal
_pdbx_vrpt_instance_stereo_outliers.instance_id
_pdbx_vrpt_instance_stereo_outliers.label_atom_id
_pdbx_vrpt_instance_stereo_outliers.problem
1   4  "C4'"  PLANAR  
2   8  "C4'"  PLANAR  
3  10  "C4'"  PLANAR  
#
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   4  "C5'"  "C4'"  "C3'"  129.229  114.100  1.800  8.40  
2   4  "C5'"  "C4'"  "O4'"  121.501  109.300  1.900  6.42  
3   4  "O4'"  "C4'"  "C3'"  109.269  106.000  0.600  5.45  
4   8  "C5'"  "C4'"  "C3'"  129.711  114.100  1.800  8.67  
5   8  "C5'"  "C4'"  "O4'"  120.887  109.300  1.900  6.10  
6   8  "O4'"  "C4'"  "C3'"  109.358  106.000  0.600  5.60  
7  10  "C5'"  "C4'"  "C3'"  129.202  114.100  1.800  8.39  
8  10  "C5'"  "C4'"  "O4'"  121.371  109.300  1.900  6.35  
9  10  "O4'"  "C4'"  "C3'"  109.401  106.000  0.600  5.67  
#
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  17   0.908  0.104  -0.141  
 2   2  22   0.930  0.094  -0.221  
 3   3  19   0.953  0.079  -0.507  
 4   4  22   0.933  0.092  -0.260  
 5   5  19   0.916  0.090  -0.346  
 6   6  21   0.969  0.070  -0.676  
 7   7  17   0.934  0.084  -0.476  
 8   8  22   0.929  0.095  -0.202  
 9   9  19   0.949  0.086  -0.405  
10  10  22   0.916  0.107   0.027  
11  11  19   0.900  0.091  -0.331  
12  12  21   0.943  0.089  -0.397  
13  13   1   0.989  0.057       ?  
14  14   1   0.986  0.044       ?  
15  15   1   0.939  0.071       ?  
16  16   1   0.574  0.324       ?  
17  17   1   0.885  0.115       ?  
18  18   1   0.718  0.147       ?  
19  19   1   0.923  0.163       ?  
20  20   1   0.867  0.308       ?  
21  21   1   0.801  0.253       ?  
22  22   1   0.758  0.154       ?  
23  23   1   0.942  0.068       ?  
24  24   1   0.537  0.261       ?  
25  25   1   0.812  0.187       ?  
26  26   1   0.548  0.181       ?  
27  27   1   0.788  0.184       ?  
28  28   1   0.793  0.203       ?  
29  29   1   0.646  0.162       ?  
30  30   1   0.859  0.117       ?  
31  31   1   0.855  0.120       ?  
32  32   1   0.852  0.121       ?  
33  33   1   0.886  0.200       ?  
34  34   1   0.143  0.256       ?  
35  35   1   0.899  0.135       ?  
36  36   1   0.881  0.125       ?  
37  37   1   0.898  0.115       ?  
38  38   1   0.976  0.058       ?  
39  39   1   0.859  0.196       ?  
40  40   1   0.835  0.109       ?  
41  41   1   0.942  0.094       ?  
42  42   1   0.774  0.134       ?  
43  43   1   0.655  0.162       ?  
44  44   1   0.447  0.277       ?  
45  45   1   0.836  0.199       ?  
46  46   1   0.963  0.078       ?  
47  47   1  -0.279  1.263       ?  
48  48   1   0.920  0.099       ?  
49  49   1   0.934  0.132       ?  
50  50   1   0.607  0.188       ?  
51  51   1   0.325  0.233       ?  
52  52   1   0.824  0.130       ?  
53  53   1   0.830  0.313       ?  
54  54   1   0.955  0.180       ?  
55  55   1   0.971  0.053       ?  
56  56   1   0.869  0.177       ?  
57  57   1   0.770  0.214       ?  
58  58   1   0.961  0.078       ?  
59  59   1   0.423  0.228       ?  
60  60   1   0.765  0.195       ?  
61  61   1   0.858  0.102       ?  
62  62   1   0.737  0.142       ?  
63  63   1   0.830  0.219       ?  
64  64   1   0.574  0.321       ?  
65  65   1   0.740  0.145       ?  
66  66   1   0.449  0.211       ?  
67  67   1   0.624  0.219       ?  
68  68   1   0.412  0.319       ?  
69  69   1   0.491  0.342       ?  
70  70   1   0.759  0.171       ?  
71  71   1   0.632  0.333       ?  
72  72   1   0.630  0.377       ?  
#
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        unknown                                                               Y  
3  eds          2.35                                                                  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  
##
