data_1B8K

_pdbx_vrpt_database.id    PDB
_pdbx_vrpt_database.code  1B8K
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   x-ray
#
_pdbx_vrpt_summary.entry_id                    1B8K
_pdbx_vrpt_summary.PDB_deposition_date         1999-02-01
_pdbx_vrpt_summary.PDB_revision_number         4
_pdbx_vrpt_summary.PDB_revision_date           2023-08-09
_pdbx_vrpt_summary.report_creation_date        2023-08-02:09:43
_pdbx_vrpt_summary.attempted_validation_steps  molprobity,validation-pack,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  "PROTEIN (NEUROTROPHIN-3)"  
2  water    water  
#
loop_
_pdbx_vrpt_asym.label_asym_id
_pdbx_vrpt_asym.entity_id
A  1  
B  2  
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all   x-ray  
2  2.15  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      
#
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  14.22  141614     ?     ?  
2  2  1   8.39    1585  2.16  2.16  
3  1  2  12.81  138981     ?     ?  
4  2  2   6.73    1560  2.16  2.16  
5  1  3   4.58  138945     ?     ?  
6  2  3   1.60    1559  2.16  2.16  
#
loop_
_pdbx_vrpt_percentile_entity_view.ordinal
_pdbx_vrpt_percentile_entity_view.conditions_id
_pdbx_vrpt_percentile_entity_view.type_id
_pdbx_vrpt_percentile_entity_view.label_asym_id
_pdbx_vrpt_percentile_entity_view.PDB_model_num
_pdbx_vrpt_percentile_entity_view.entity_id
_pdbx_vrpt_percentile_entity_view.auth_asym_id
_pdbx_vrpt_percentile_entity_view.rank
1  3  2  A  1  1  A  12.81  
2  4  2  A  1  1  A   6.73  
3  5  3  A  1  1  A   4.58  
4  6  3  A  1  1  A   1.60  
#
_pdbx_vrpt_summary_entity_geometry.ordinal          1
_pdbx_vrpt_summary_entity_geometry.PDB_model_num    1
_pdbx_vrpt_summary_entity_geometry.entity_id        1
_pdbx_vrpt_summary_entity_geometry.label_asym_id    A
_pdbx_vrpt_summary_entity_geometry.auth_asym_id     A
_pdbx_vrpt_summary_entity_geometry.angles_RMSZ      0.86
_pdbx_vrpt_summary_entity_geometry.bonds_RMSZ       0.74
_pdbx_vrpt_summary_entity_geometry.num_bonds_RMSZ   738
_pdbx_vrpt_summary_entity_geometry.num_angles_RMSZ  995
#
_pdbx_vrpt_summary_geometry.ordinal                        1
_pdbx_vrpt_summary_geometry.percent_ramachandran_outliers  1.19
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers       12.20
_pdbx_vrpt_summary_geometry.clashscore                     15.46
_pdbx_vrpt_summary_geometry.num_H_reduce                   697
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ                 738
_pdbx_vrpt_summary_geometry.bonds_RMSZ                     0.74
_pdbx_vrpt_summary_geometry.num_angles_RMSZ                995
_pdbx_vrpt_summary_geometry.angles_RMSZ                    0.86
#
_pdbx_vrpt_summary_diffraction.exp_method           x-ray
_pdbx_vrpt_summary_diffraction.ordinal              1
_pdbx_vrpt_summary_diffraction.PDB_resolution_high  2.15
_pdbx_vrpt_summary_diffraction.PDB_resolution_low   20.00
_pdbx_vrpt_summary_diffraction.PDB_R                0.24
_pdbx_vrpt_summary_diffraction.PDB_Rfree            0.30
#
loop_
_pdbx_vrpt_model_instance.id
_pdbx_vrpt_model_instance.PDB_model_num
_pdbx_vrpt_model_instance.entity_id
_pdbx_vrpt_model_instance.label_asym_id
_pdbx_vrpt_model_instance.label_seq_id
_pdbx_vrpt_model_instance.label_comp_id
_pdbx_vrpt_model_instance.auth_asym_id
_pdbx_vrpt_model_instance.auth_seq_id
_pdbx_vrpt_model_instance.label_alt_id
_pdbx_vrpt_model_instance.PDB_ins_code
_pdbx_vrpt_model_instance.count_clashes
  1  1  1  A   11  TYR  A   11  .  ?        1  
  2  1  1  A   12  SER  A   12  .  ?        ?  
  3  1  1  A   13  VAL  A   13  .  ?        ?  
  4  1  1  A   14  CYS  A   14  .  ?        ?  
  5  1  1  A   15  ASP  A   15  .  ?        ?  
  6  1  1  A   16  SER  A   16  .  ?        ?  
  7  1  1  A   17  GLU  A   17  .  ?        1  
  8  1  1  A   18  SER  A   18  .  ?        ?  
  9  1  1  A   19  LEU  A   19  .  ?        ?  
 10  1  1  A   20  TRP  A   20  .  ?        ?  
 11  1  1  A   21  VAL  A   21  .  ?        ?  
 12  1  1  A   22  THR  A   22  .  ?        ?  
 13  1  1  A   23  ASP  A   23  .  ?        ?  
 14  1  1  A   24  LYS  A   24  .  ?        ?  
 15  1  1  A   25  SER  A   25  .  ?        ?  
 16  1  1  A   26  SER  A   26  .  ?        1  
 17  1  1  A   27  ALA  A   27  .  ?        ?  
 18  1  1  A   28  ILE  A   28  .  ?        ?  
 19  1  1  A   29  ASP  A   29  .  ?        ?  
 20  1  1  A   30  ILE  A   30  .  ?        ?  
 21  1  1  A   31  ARG  A   31  .  ?        ?  
 22  1  1  A   32  GLY  A   32  .  ?        ?  
 23  1  1  A   33  HIS  A   33  .  ?        ?  
 24  1  1  A   34  GLN  A   34  .  ?        ?  
 25  1  1  A   35  VAL  A   35  .  ?        ?  
 26  1  1  A   36  THR  A   36  .  ?        ?  
 27  1  1  A   37  VAL  A   37  .  ?        ?  
 28  1  1  A   38  LEU  A   38  .  ?        ?  
 29  1  1  A   39  GLY  A   39  .  ?        ?  
 30  1  1  A   40  GLU  A   40  .  ?        ?  
 31  1  1  A   41  ILE  A   41  .  ?        ?  
 32  1  1  A   48  VAL  A   48  .  ?        ?  
 33  1  1  A   49  LYS  A   49  .  ?        ?  
 34  1  1  A   50  GLN  A   50  .  ?        ?  
 35  1  1  A   51  TYR  A   51  .  ?        ?  
 36  1  1  A   52  PHE  A   52  .  ?        ?  
 37  1  1  A   53  TYR  A   53  .  ?        ?  
 38  1  1  A   54  GLU  A   54  .  ?        ?  
 39  1  1  A   55  THR  A   55  .  ?        ?  
 40  1  1  A   56  ARG  A   56  .  ?        2  
 41  1  1  A   57  CYS  A   57  .  ?        1  
 42  1  1  A   58  LYS  A   58  .  ?        ?  
 43  1  1  A   59  GLU  A   59  .  ?        ?  
 44  1  1  A   66  GLY  A   66  .  ?        1  
 45  1  1  A   67  CYS  A   67  .  ?        4  
 46  1  1  A   68  ARG  A   68  .  ?        ?  
 47  1  1  A   69  GLY  A   69  .  ?        ?  
 48  1  1  A   70  ILE  A   70  .  ?        6  
 49  1  1  A   71  ASP  A   71  .  ?        4  
 50  1  1  A   72  ASP  A   72  .  ?        2  
 51  1  1  A   73  LYS  A   73  .  ?        2  
 52  1  1  A   74  HIS  A   74  .  ?        1  
 53  1  1  A   75  TRP  A   75  .  ?        6  
 54  1  1  A   76  ASN  A   76  .  ?        1  
 55  1  1  A   77  SER  A   77  .  ?        3  
 56  1  1  A   78  GLN  A   78  .  ?        ?  
 57  1  1  A   79  CYS  A   79  .  ?        ?  
 58  1  1  A   80  LYS  A   80  .  ?        ?  
 59  1  1  A   81  THR  A   81  .  ?        ?  
 60  1  1  A   82  SER  A   82  .  ?        ?  
 61  1  1  A   83  GLN  A   83  .  ?        ?  
 62  1  1  A   84  THR  A   84  .  ?        1  
 63  1  1  A   85  TYR  A   85  .  ?        ?  
 64  1  1  A   86  VAL  A   86  .  ?        ?  
 65  1  1  A   87  ARG  A   87  .  ?        ?  
 66  1  1  A   88  ALA  A   88  .  ?        ?  
 67  1  1  A   89  LEU  A   89  .  ?        ?  
 68  1  1  A   90  THR  A   90  .  ?        ?  
 69  1  1  A   91  SER  A   91  .  ?        ?  
 70  1  1  A   92  GLU  A   92  .  ?        ?  
 71  1  1  A   93  ASN  A   93  .  ?        ?  
 72  1  1  A   94  ASN  A   94  .  ?        ?  
 73  1  1  A   95  LYS  A   95  .  ?        ?  
 74  1  1  A   96  LEU  A   96  .  ?        ?  
 75  1  1  A   97  VAL  A   97  .  ?        ?  
 76  1  1  A   98  GLY  A   98  .  ?        ?  
 77  1  1  A   99  TRP  A   99  .  ?        ?  
 78  1  1  A  100  ARG  A  100  .  ?        ?  
 79  1  1  A  101  TRP  A  101  .  ?        ?  
 80  1  1  A  102  ILE  A  102  .  ?        ?  
 81  1  1  A  103  ARG  A  103  .  ?        1  
 82  1  1  A  104  ILE  A  104  .  ?        ?  
 83  1  1  A  105  ASP  A  105  .  ?        ?  
 84  1  1  A  106  THR  A  106  .  ?        ?  
 85  1  1  A  107  SER  A  107  .  ?        ?  
 86  1  1  A  108  CYS  A  108  .  ?        ?  
 87  1  1  A  109  VAL  A  109  .  ?        ?  
 88  1  1  A  110  CYS  A  110  .  ?        ?  
 89  1  1  A  111  ALA  A  111  .  ?        1  
 90  1  1  A  112  LEU  A  112  .  ?        1  
 91  1  2  B    .  HOH  A  120  .  ?        ?  
 92  1  2  B    .  HOH  A  121  .  ?        ?  
 93  1  2  B    .  HOH  A  122  .  ?        ?  
 94  1  2  B    .  HOH  A  123  .  ?        ?  
 95  1  2  B    .  HOH  A  124  .  ?        ?  
 96  1  2  B    .  HOH  A  125  .  ?        ?  
 97  1  2  B    .  HOH  A  126  .  ?        ?  
 98  1  2  B    .  HOH  A  127  .  ?        ?  
 99  1  2  B    .  HOH  A  128  .  ?        ?  
100  1  2  B    .  HOH  A  129  .  ?        ?  
101  1  2  B    .  HOH  A  130  .  ?        ?  
102  1  2  B    .  HOH  A  131  .  ?        ?  
103  1  2  B    .  HOH  A  132  .  ?        ?  
104  1  2  B    .  HOH  A  133  .  ?        ?  
105  1  2  B    .  HOH  A  134  .  ?        ?  
106  1  2  B    .  HOH  A  135  .  ?        ?  
107  1  2  B    .  HOH  A  136  .  ?        ?  
108  1  2  B    .  HOH  A  137  .  ?        2  
109  1  2  B    .  HOH  A  138  .  ?        ?  
110  1  2  B    .  HOH  A  139  .  ?        1  
111  1  2  B    .  HOH  A  140  .  ?        ?  
112  1  2  B    .  HOH  A  141  .  ?        ?  
113  1  2  B    .  HOH  A  142  .  ?        1  
114  1  2  B    .  HOH  A  143  .  ?        ?  
#
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.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  m-85          ?       ?  ?           ?   8  13  0.64  18  0.96  molprobity  
 2   2  m         -99.0   159.6  Favored     ?   5   6  0.47   8  0.22  molprobity  
 3   3  m         -79.2   -26.7  Favored     ?   9   7  0.57  10  0.48  molprobity  
 4   4  m        -129.2   146.0  Favored     ?   4   6  0.28   8  0.38  molprobity  
 5   5  m-20      -98.9   142.6  Favored     ?   4   8  0.55  11  1.15  molprobity  
 6   6  p        -137.5   174.1  Favored     ?   5   6  0.41   8  0.98  molprobity  
 7   7  pt-20    -145.5   132.2  Favored     ?   6   9  0.64  12  0.68  molprobity  
 8   8  m        -109.1   151.3  Favored     ?   5   6  0.65   8  0.62  molprobity  
 9   9  OUTLIER  -161.8   165.6  Favored     ?  11   8  0.98  11  0.92  molprobity  
10  10  m95      -100.0   126.0  Favored     ?  10  16  0.57  23  0.66  molprobity  
11  11  t        -107.0   117.4  Favored     ?   9   7  1.30  10  0.90  molprobity  
12  12  OUTLIER  -108.3   -11.2  Favored     ?   7   7  0.52  10  0.79  molprobity  
13  13  p-10     -103.8    12.2  Favored     ?   4   8  0.62  11  1.01  molprobity  
14  14  ttmm      -69.1   127.2  Favored     ?  13   9  0.60  11  0.63  molprobity  
15  15  p        -133.9     2.0  Favored     ?   5   6  0.58   8  0.49  molprobity  
16  16  t        -149.7   148.7  Favored     ?   5   6  0.60   8  0.79  molprobity  
17  17  ?        -165.6   160.9  Favored     ?   5   5  0.98   7  0.46  molprobity  
18  18  mt        -92.2   123.8  Favored     ?  11   8  0.72  11  0.83  molprobity  
19  19  p30       -82.9  -174.2  Favored     ?   4   8  0.55  11  0.55  molprobity  
20  20  tt        -64.7   -27.1  Favored     ?  11   8  0.82  11  0.94  molprobity  
21  21  mtm180    -82.5     1.7  Favored     ?  13  11  0.95  14  1.31  molprobity  
22  22  ?          82.4     2.2  Favored     ?   3   4  0.49   5  0.54  molprobity  
23  23  m170      -79.3   161.7  Favored     ?   7  11  0.41  15  0.77  molprobity  
24  24  mm100    -101.7   111.0  Favored     ?   8   9  1.05  12  1.11  molprobity  
25  25  m        -115.7   160.7  Favored     ?   9   7  0.48  10  1.03  molprobity  
26  26  m         -87.7   133.1  Favored     ?   7   7  0.67  10  0.91  molprobity  
27  27  t        -100.3   121.3  Favored     ?   9   7  0.83  10  1.01  molprobity  
28  28  mt        -67.6   161.5  Favored     ?  11   8  0.52  11  1.62  molprobity  
29  29  ?         -87.7   -33.6  Favored     ?   3   4  0.46   5  0.55  molprobity  
30  30  mt-10    -123.1   165.7  Favored     ?   6   9  0.43  12  1.07  molprobity  
31  31  mt            ?       ?  ?           ?  11   7  0.94   8  0.63  molprobity  
32  32  p             ?       ?  ?           ?   8   7  1.05  10  0.39  molprobity  
33  33  pttp      -93.7   148.7  Favored     ?  13   9  1.11  11  0.95  molprobity  
34  34  tt0       -98.7   108.4  Favored     ?   8   9  0.80  12  0.41  molprobity  
35  35  p90      -130.1   175.8  Favored     ?   9  13  0.83  18  0.87  molprobity  
36  36  m-85     -138.8   157.3  Favored     ?   9  12  0.90  16  0.58  molprobity  
37  37  t80      -112.6   120.4  Favored     ?   9  13  0.97  18  0.90  molprobity  
38  38  mt-10    -130.9   159.1  Favored     ?   6   9  1.15  12  0.80  molprobity  
39  39  OUTLIER  -142.9   121.5  Favored     ?   7   7  1.50  10  1.11  molprobity  
40  40  OUTLIER  -124.2   172.8  Favored     ?  13  11  0.86  14  0.46  molprobity  
41  41  m         -67.3   158.6  Favored     ?   4   6  0.49   8  0.80  molprobity  
42  42  ttmm      -99.5   -69.7  Allowed     ?  13   9  0.52  11  0.67  molprobity  
43  43  mm-40         ?       ?  ?           ?   6   8  0.73   9  0.95  molprobity  
44  44  ?             ?       ?  ?           ?   2   4  1.94   5  0.26  molprobity  
45  45  m        -101.2   155.5  Favored     ?   4   6  0.31   8  0.55  molprobity  
46  46  ttm-85    -72.1   134.3  Favored     ?  13  11  0.41  14  1.03  molprobity  
47  47  ?          81.1     3.3  Favored     ?   3   4  0.23   5  0.57  molprobity  
48  48  mm        -74.1   164.5  Favored     ?  11   8  0.48  11  0.65  molprobity  
49  49  OUTLIER   -78.8   -35.0  Favored     ?   4   8  0.24  11  0.76  molprobity  
50  50  OUTLIER    59.7   -30.6  OUTLIER     ?   4   8  0.58  11  1.39  molprobity  
51  51  mttm      -85.8   117.9  Favored     ?  13   9  0.59  11  1.40  molprobity  
52  52  p80        57.0    28.9  Favored     ?   7  11  0.40  15  0.64  molprobity  
53  53  m95      -155.2   120.5  Favored     ?  10  16  0.95  23  0.51  molprobity  
54  54  m-20     -114.8   145.2  Favored     ?   6   8  0.53  11  1.00  molprobity  
55  55  p        -148.8   150.2  Favored     ?   5   6  0.62   8  0.72  molprobity  
56  56  tt0      -143.9   155.5  Favored     ?   8   9  0.54  12  1.02  molprobity  
57  57  m         -97.7   136.2  Favored     ?   4   6  0.76   8  1.05  molprobity  
58  58  mttt     -132.9   143.4  Favored     ?  13   9  0.65  11  0.88  molprobity  
59  59  OUTLIER   -87.4   124.0  Favored     ?   7   7  0.74  10  0.46  molprobity  
60  60  p         -94.4   165.8  Favored     ?   5   6  0.31   8  0.25  molprobity  
61  61  mt-30    -130.1   174.9  Favored     ?   8   9  0.59  12  0.64  molprobity  
62  62  t        -156.2   172.5  Favored     ?   7   7  0.57  10  0.66  molprobity  
63  63  m-85     -103.0   140.2  Favored     ?   9  13  1.05  18  0.61  molprobity  
64  64  m        -141.5   148.9  Favored     ?   9   7  0.94  10  1.17  molprobity  
65  65  mmt85     -79.7   144.2  Favored     ?  13  11  0.76  14  1.05  molprobity  
66  66  ?        -144.7   148.3  Favored     ?   5   5  0.93   7  0.77  molprobity  
67  67  tp        -84.3   107.6  Favored     ?  11   8  0.44  11  1.21  molprobity  
68  68  p        -125.2   174.3  Favored     ?   7   7  0.62  10  1.04  molprobity  
69  69  p        -147.1   171.4  Favored     ?   5   6  0.72   8  1.12  molprobity  
70  70  mt-10    -105.5   -97.6  Allowed     ?   6   9  0.63  12  0.82  molprobity  
71  71  OUTLIER   -87.3    51.8  Favored     ?   6   8  0.81  11  1.54  molprobity  
72  72  m120       57.1  -170.8  Allowed     1   6   8  0.69  11  1.22  molprobity  
73  73  mttm       53.0  -166.7  Allowed     ?  13   9  1.28  11  1.42  molprobity  
74  74  OUTLIER    36.7    48.2  Allowed     ?  11   8  0.59  11  0.71  molprobity  
75  75  t         -77.3   138.3  Favored     ?   9   7  0.46  10  0.67  molprobity  
76  76  ?         174.5   176.2  Favored     ?   3   4  0.56   5  0.83  molprobity  
77  77  m95       -83.3   129.6  Favored     ?  10  16  0.57  23  0.38  molprobity  
78  78  mtt85    -140.2   160.4  Favored     ?  13  11  0.57  14  0.92  molprobity  
79  79  m95       -90.3   115.2  Favored     ?  10  16  0.39  23  0.35  molprobity  
80  80  pt       -114.6   158.8  Favored     ?  11   8  0.86  11  0.81  molprobity  
81  81  ptp180   -105.3   144.2  Favored     ?  13  11  0.72  14  0.79  molprobity  
82  82  pt       -141.4   158.2  Favored     ?  11   8  0.70  11  0.85  molprobity  
83  83  m-20      -67.6   138.2  Favored     ?   4   8  0.65  11  1.11  molprobity  
84  84  OUTLIER  -137.0   -12.8  Allowed     ?   7   7  0.74  10  0.66  molprobity  
85  85  t        -175.5   173.8  Favored     ?   5   6  0.50   8  0.58  molprobity  
86  86  t        -131.2   116.4  Favored     ?   4   6  0.50   8  0.90  molprobity  
87  87  m        -123.3   157.0  Favored     ?   9   7  0.87  10  0.77  molprobity  
88  88  t         -88.8   142.9  Favored     ?   4   6  0.54   8  0.57  molprobity  
89  89  ?        -122.2   128.2  Favored     ?   5   5  0.28   7  0.61  molprobity  
90  90  mt            ?       ?  ?           ?  11   7  1.23   8  1.24  molprobity  
#
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  CE1    1  0.56  2.52  
 2    7  OE2    2  0.42  2.20  
 3   16  O      3  0.69  2.10  
 4   40  HG2    4  0.48  2.13  
 5   40  HD3    2  0.42  2.20  
 6   41  O      4  0.48  2.13  
 7   44  HA2    5  0.63  1.98  
 8   45  HB2    6  0.60  2.30  
 9   45  HB2    7  0.51  1.92  
10   45  HB2    8  0.44  1.98  
11   45  SG     9  0.52  2.49  
12   48  CG1    6  0.60  2.30  
13   48  HG22  10  0.56  2.20  
14   48  HG22  11  0.46  1.79  
15   48  HG13   7  0.51  1.92  
16   48  CG2   12  0.46  2.77  
17   48  HG12   8  0.44  1.98  
18   49  N     10  0.56  2.20  
19   49  N     12  0.46  2.77  
20   49  CB    13  0.47  2.28  
21   49  C     14  0.41  2.23  
22   50  HA    15  0.60  2.02  
23   50  H     11  0.46  1.79  
24   51  O     16  0.51  2.64  
25   51  H     14  0.41  2.23  
26   52  CG    16  0.51  2.64  
27   53  HE3   17  0.82  1.62  
28   53  CE3   18  0.76  2.37  
29   53  CE3   19  0.48  2.48  
30   53  O     15  0.60  2.02  
31   53  HA    19  0.48  2.48  
32   53  HD1   13  0.47  2.28  
33   54  O     20  0.53  2.08  
34   55  O      5  0.63  1.98  
35   55  HA    21  0.56  2.05  
36   55  HB2    9  0.52  2.49  
37   62  O     22  0.40  2.20  
38   81  HA    22  0.40  2.20  
39   89  O     21  0.56  2.05  
40   90  HA    20  0.53  2.08  
41  108  O     17  0.82  1.62  
42  108  O     18  0.76  2.37  
43  110  O      1  0.56  2.52  
44  113  O      3  0.69  2.10  
#
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  percentiles  "20191225.v01 (using entries in the PDB archive December 25th 2019)"  Y  
##
