data_2VUI

loop_
_pdbx_vrpt_database.id
_pdbx_vrpt_database.code
PDB   2VUI       
PDBE  EBI-36396  
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   x-ray
#
_pdbx_vrpt_summary.entry_id                    2VUI
_pdbx_vrpt_summary.PDB_deposition_date         2008-05-26
_pdbx_vrpt_summary.PDB_revision_number         4
_pdbx_vrpt_summary.PDB_revision_date           2023-12-13
_pdbx_vrpt_summary.report_creation_date        2023-12-10:21:36
_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      "HYDROGENASE TRANSCRIPTIONAL REGULATORY PROTEIN HUPR1"  
2  non-polymer  "BERYLLIUM TRIFLUORIDE ION"  
3  non-polymer  "MAGNESIUM ION"  
#
loop_
_pdbx_vrpt_asym.label_asym_id
_pdbx_vrpt_asym.entity_id
A  1  
B  2  
C  3  
D  3  
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all  x-ray  
2  2.9  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   7.54  141614     ?     ?  
 2  2  1  28.31    2172  2.90  2.90  
 3  1  2   3.08  138981     ?     ?  
 4  2  2  13.33    2115  2.90  2.90  
 5  1  3   6.41  138945     ?     ?  
 6  2  3  20.41    2117  2.90  2.90  
 7  1  4  27.67  127900     ?     ?  
 8  2  4  23.92    1906  2.90  2.90  
 9  1  5   1.01  130704     ?     ?  
10  2  5   1.57    1957  2.90  2.90  
#
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  B   3.08  
2  4  2  A  1  1  B  13.33  
3  5  3  A  1  1  B   6.41  
4  6  3  A  1  1  B  20.41  
5  7  4  A  1  1  B  27.67  
6  8  4  A  1  1  B  23.92  
#
_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     B
_pdbx_vrpt_summary_entity_geometry.angles_RMSZ      0.62
_pdbx_vrpt_summary_entity_geometry.bonds_RMSZ       0.44
_pdbx_vrpt_summary_entity_geometry.num_bonds_RMSZ   1093
_pdbx_vrpt_summary_entity_geometry.num_angles_RMSZ  1485
#
_pdbx_vrpt_summary_geometry.ordinal                        1
_pdbx_vrpt_summary_geometry.percent_ramachandran_outliers  3.70
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers       10.62
_pdbx_vrpt_summary_geometry.clashscore                     21.90
_pdbx_vrpt_summary_geometry.num_H_reduce                   1066
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ                 1093
_pdbx_vrpt_summary_geometry.bonds_RMSZ                     0.44
_pdbx_vrpt_summary_geometry.num_angles_RMSZ                1485
_pdbx_vrpt_summary_geometry.angles_RMSZ                    0.62
#
_pdbx_vrpt_summary_diffraction.exp_method                x-ray
_pdbx_vrpt_summary_diffraction.ordinal                   1
_pdbx_vrpt_summary_diffraction.bulk_solvent_b            111.398
_pdbx_vrpt_summary_diffraction.Wilson_B_estimate         99.540
_pdbx_vrpt_summary_diffraction.I_over_sigma              3.67(2.89A)
_pdbx_vrpt_summary_diffraction.num_miller_indices        5316
_pdbx_vrpt_summary_diffraction.bulk_solvent_k            0.360
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L_mean     0.492
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L2_mean    0.328
_pdbx_vrpt_summary_diffraction.Fo_Fc_correlation         0.926
_pdbx_vrpt_summary_diffraction.twin_fraction             -h,-k,l:0.067
_pdbx_vrpt_summary_diffraction.DCC_R                     0.26
_pdbx_vrpt_summary_diffraction.DCC_Rfree                 0.34
_pdbx_vrpt_summary_diffraction.EDS_R                     0.27
_pdbx_vrpt_summary_diffraction.EDS_res_high              2.90
_pdbx_vrpt_summary_diffraction.EDS_res_low               23.30
_pdbx_vrpt_summary_diffraction.Wilson_B_aniso            "[109.493,109.493,84.522,-0.000,0.000,0.000]"
_pdbx_vrpt_summary_diffraction.data_anisotropy           0.247
_pdbx_vrpt_summary_diffraction.trans_NCS_details         "The largest off-origin peak in the Patterson function is 4.96% of the height of the origin peak. No significant pseudotranslation is detected."
_pdbx_vrpt_summary_diffraction.B_factor_type             FULL
_pdbx_vrpt_summary_diffraction.acentric_outliers         2
_pdbx_vrpt_summary_diffraction.centric_outliers          0
_pdbx_vrpt_summary_diffraction.data_completeness         99.01
_pdbx_vrpt_summary_diffraction.number_reflns_R_free      258
_pdbx_vrpt_summary_diffraction.percent_free_reflections  4.85
_pdbx_vrpt_summary_diffraction.percent_RSRZ_outliers     5.11
_pdbx_vrpt_summary_diffraction.PDB_resolution_high       2.90
_pdbx_vrpt_summary_diffraction.PDB_resolution_low        23.30
_pdbx_vrpt_summary_diffraction.PDB_R                     0.26
_pdbx_vrpt_summary_diffraction.PDB_Rfree                 0.32
#
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    1  ALA  B     5  .  ?        ?  
  2  1  1  A    2  PRO  B     6  .  ?        3  
  3  1  1  A    3  ALA  B     7  .  ?        3  
  4  1  1  A    4  ILE  B     8  .  ?        1  
  5  1  1  A    5  LEU  B     9  .  ?        2  
  6  1  1  A    6  LEU  B    10  .  ?        ?  
  7  1  1  A    7  VAL  B    11  .  ?        ?  
  8  1  1  A    8  ASP  B    12  .  ?        ?  
  9  1  1  A    9  ASP  B    13  .  ?        4  
 10  1  1  A   10  GLU  B    14  .  ?        1  
 11  1  1  A   11  PRO  B    15  .  ?        2  
 12  1  1  A   12  HIS  B    16  .  ?        ?  
 13  1  1  A   13  SER  B    17  .  ?        ?  
 14  1  1  A   14  LEU  B    18  .  ?        ?  
 15  1  1  A   15  ALA  B    19  .  ?        ?  
 16  1  1  A   16  ALA  B    20  .  ?        ?  
 17  1  1  A   17  MET  B    21  .  ?        ?  
 18  1  1  A   18  LYS  B    22  .  ?        ?  
 19  1  1  A   19  LEU  B    23  .  ?        ?  
 20  1  1  A   20  ALA  B    24  .  ?        ?  
 21  1  1  A   21  LEU  B    25  .  ?        ?  
 22  1  1  A   22  GLU  B    26  .  ?        ?  
 23  1  1  A   23  ASP  B    27  .  ?        ?  
 24  1  1  A   24  ASP  B    28  .  ?        ?  
 25  1  1  A   25  PHE  B    29  .  ?        ?  
 26  1  1  A   26  ASP  B    30  .  ?        1  
 27  1  1  A   27  VAL  B    31  .  ?        2  
 28  1  1  A   28  LEU  B    32  .  ?        2  
 29  1  1  A   29  THR  B    33  .  ?        ?  
 30  1  1  A   30  ALA  B    34  .  ?        ?  
 31  1  1  A   31  GLN  B    35  .  ?        1  
 32  1  1  A   32  GLY  B    36  .  ?        ?  
 33  1  1  A   33  ALA  B    37  .  ?        ?  
 34  1  1  A   34  GLU  B    38  .  ?        ?  
 35  1  1  A   35  ALA  B    39  .  ?        ?  
 36  1  1  A   36  ALA  B    40  .  ?        ?  
 37  1  1  A   37  ILE  B    41  .  ?        ?  
 38  1  1  A   38  ALA  B    42  .  ?        ?  
 39  1  1  A   39  ILE  B    43  .  ?        1  
 40  1  1  A   40  LEU  B    44  .  ?        ?  
 41  1  1  A   41  GLU  B    45  .  ?        ?  
 42  1  1  A   42  GLU  B    46  .  ?        ?  
 43  1  1  A   43  GLU  B    47  .  ?        ?  
 44  1  1  A   44  TRP  B    48  .  ?        ?  
 45  1  1  A   45  VAL  B    49  .  ?        ?  
 46  1  1  A   46  GLN  B    50  .  ?        5  
 47  1  1  A   47  VAL  B    51  .  ?        1  
 48  1  1  A   48  ILE  B    52  .  ?        1  
 49  1  1  A   49  ILE  B    53  .  ?        ?  
 50  1  1  A   50  CYS  B    54  .  ?        2  
 51  1  1  A   51  ASP  B    55  .  ?        1  
 52  1  1  A   52  GLN  B    56  .  ?        4  
 53  1  1  A   53  ARG  B    57  .  ?        2  
 54  1  1  A   54  MET  B    58  .  ?        1  
 55  1  1  A   55  PRO  B    59  .  ?        ?  
 56  1  1  A   56  GLY  B    60  .  ?        ?  
 57  1  1  A   57  ARG  B    61  .  ?        ?  
 58  1  1  A   58  THR  B    62  .  ?        1  
 59  1  1  A   59  GLY  B    63  .  ?        ?  
 60  1  1  A   60  VAL  B    64  .  ?        4  
 61  1  1  A   61  ASP  B    65  .  ?        1  
 62  1  1  A   62  PHE  B    66  .  ?        4  
 63  1  1  A   63  LEU  B    67  .  ?        ?  
 64  1  1  A   64  THR  B    68  .  ?        1  
 65  1  1  A   65  GLU  B    69  .  ?        ?  
 66  1  1  A   66  VAL  B    70  .  ?        1  
 67  1  1  A   67  ARG  B    71  .  ?        1  
 68  1  1  A   68  GLU  B    72  .  ?        ?  
 69  1  1  A   69  ARG  B    73  .  ?        ?  
 70  1  1  A   70  TRP  B    74  .  ?        ?  
 71  1  1  A   71  PRO  B    75  .  ?        ?  
 72  1  1  A   72  GLU  B    76  .  ?        ?  
 73  1  1  A   73  THR  B    77  .  ?        ?  
 74  1  1  A   74  VAL  B    78  .  ?        ?  
 75  1  1  A   75  ARG  B    79  .  ?        2  
 76  1  1  A   76  ILE  B    80  .  ?        ?  
 77  1  1  A   77  ILE  B    81  .  ?        3  
 78  1  1  A   78  ILE  B    82  .  ?        2  
 79  1  1  A   79  THR  B    83  .  ?        5  
 80  1  1  A   80  GLY  B    84  .  ?        ?  
 81  1  1  A   81  TYR  B    85  .  ?        2  
 82  1  1  A   82  THR  B    86  .  ?        ?  
 83  1  1  A   83  ASP  B    87  .  ?        ?  
 84  1  1  A   84  SER  B    88  .  ?        ?  
 85  1  1  A   85  ALA  B    89  .  ?        ?  
 86  1  1  A   86  SER  B    90  .  ?        ?  
 87  1  1  A   87  MET  B    91  .  ?        1  
 88  1  1  A   88  MET  B    92  .  ?        ?  
 89  1  1  A   89  ALA  B    93  .  ?        ?  
 90  1  1  A   90  ALA  B    94  .  ?        1  
 91  1  1  A   91  ILE  B    95  .  ?        ?  
 92  1  1  A   92  ASN  B    96  .  ?        ?  
 93  1  1  A   93  ASP  B    97  .  ?        ?  
 94  1  1  A   94  ALA  B    98  .  ?        ?  
 95  1  1  A   95  GLY  B    99  .  ?        ?  
 96  1  1  A   96  ILE  B   100  .  ?        ?  
 97  1  1  A   97  HIS  B   101  .  ?        2  
 98  1  1  A   98  GLN  B   102  .  ?        1  
 99  1  1  A   99  PHE  B   103  .  ?        3  
100  1  1  A  100  LEU  B   104  .  ?        1  
101  1  1  A  101  THR  B   105  .  ?        1  
102  1  1  A  102  LYS  B   106  .  ?        ?  
103  1  1  A  103  PRO  B   107  .  ?        ?  
104  1  1  A  104  TRP  B   108  .  ?        ?  
105  1  1  A  105  HIS  B   109  .  ?        2  
106  1  1  A  106  PRO  B   110  .  ?        1  
107  1  1  A  107  GLU  B   111  .  ?        1  
108  1  1  A  108  GLN  B   112  .  ?        ?  
109  1  1  A  109  LEU  B   113  .  ?        4  
110  1  1  A  110  LEU  B   114  .  ?        2  
111  1  1  A  111  SER  B   115  .  ?        ?  
112  1  1  A  112  SER  B   116  .  ?        ?  
113  1  1  A  113  ALA  B   117  .  ?        ?  
114  1  1  A  114  ARG  B   118  .  ?        ?  
115  1  1  A  115  ASN  B   119  .  ?        ?  
116  1  1  A  116  ALA  B   120  .  ?        ?  
117  1  1  A  117  ALA  B   121  .  ?        ?  
118  1  1  A  118  ARG  B   122  .  ?        ?  
119  1  1  A  119  MET  B   123  .  ?        ?  
120  1  1  A  120  PHE  B   124  .  ?        ?  
121  1  1  A  121  THR  B   125  .  ?        ?  
122  1  1  A  122  LEU  B   126  .  ?        ?  
123  1  1  A  123  ALA  B   127  .  ?        ?  
124  1  1  A  124  ARG  B   128  .  ?        ?  
125  1  1  A  125  GLU  B   129  .  ?        ?  
126  1  1  A  126  ASN  B   130  .  ?        ?  
127  1  1  A  127  GLU  B   131  .  ?        ?  
128  1  1  A  128  ARG  B   132  .  ?        ?  
129  1  1  A  129  LEU  B   133  .  ?        ?  
130  1  1  A  130  SER  B   134  .  ?        1  
131  1  1  A  131  LEU  B   135  .  ?        1  
132  1  1  A  132  GLU  B   136  .  ?        ?  
133  1  1  A  133  MET  B   137  .  ?        ?  
134  1  1  A  134  ARG  B   138  .  ?        1  
135  1  1  A  135  LEU  B   139  .  ?        1  
136  1  1  A  136  LEU  B   140  .  ?        2  
137  1  1  A  137  GLU  B   141  .  ?        ?  
138  1  2  B    .  BEF  B  1142  .  ?        1  
139  1  3  C    .  MG   B  1143  .  ?        ?  
140  1  3  D    .  MG   B  1144  .  ?        ?  
#
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.cis_peptide
_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  ?             ?       ?  ?           ?  ?        4  146.040     5  0.69     8  0.50  molprobity  1.000  
  2    2  Cg_exo    -69.2   126.4  Favored     ?  ?        7  127.780     8  0.38    11  0.44  molprobity  1.000  
  3    3  ?         -96.8  -175.6  Favored     ?  ?        5  114.660     5  0.35     7  0.59  molprobity  1.000  
  4    4  tt       -123.9   136.2  Favored     ?  ?       11   99.730     8  0.62    11  0.67  molprobity  1.000  
  5    5  tp        -97.5   127.5  Favored     ?  ?       11  110.000     8  0.55    11  0.77  molprobity  1.000  
  6    6  mt       -109.6   134.9  Favored     ?  ?       11  106.320     8  0.41    11  1.13  molprobity  1.000  
  7    7  t        -149.8    96.6  Allowed     ?  ?        9  114.520     7  0.26    10  0.62  molprobity  1.000  
  8    8  t0       -142.2   144.9  Favored     ?  ?        4  125.690     8  0.48    11  0.50  molprobity  1.000  
  9    9  p-10      -60.2   -57.1  Favored     ?  ?        4  153.740     8  0.26    11  0.48  molprobity  1.000  
 10   10  mt-10     -74.3   111.0  Favored     ?  ?        6  146.550     9  0.39    13  0.47  molprobity  1.000  
 11   11  Cg_exo    -66.0    -2.9  Favored     ?  ?        7  134.890     8  0.35    11  0.56  molprobity  1.000  
 12   12  p-80      -89.0   -14.3  Favored     ?  ?        7  126.550    11  0.32    15  0.23  molprobity  1.000  
 13   13  p         -95.1   -28.5  Favored     ?  ?        5  115.470     6  0.43     8  0.47  molprobity  1.000  
 14   14  mt        -61.5   -47.0  Favored     ?  ?       11  112.900     8  0.38    11  0.84  molprobity  1.000  
 15   15  ?         -48.1   -54.1  Favored     ?  ?        5  100.620     5  0.43     7  0.41  molprobity  1.000  
 16   16  ?         -63.1   -61.6  Favored     ?  ?        5   95.280     5  0.69     7  0.69  molprobity  1.000  
 17   17  mtm       -49.5   -36.9  Favored     ?  ?        9   96.850     8  0.81    10  0.68  molprobity  1.000  
 18   18  tttt      -62.5   -46.2  Favored     ?  ?       13  106.290     9  0.56    11  0.49  molprobity  1.000  
 19   19  mt        -57.9   -27.7  Favored     ?  ?       11   95.580     8  0.28    11  1.02  molprobity  1.000  
 20   20  ?         -83.2   -29.3  Favored     ?  ?        5   98.770     5  0.54     7  0.33  molprobity  1.000  
 21   21  mt       -112.4   -20.2  Favored     ?  ?       11   94.730     8  0.25    11  0.48  molprobity  1.000  
 22   22  pt-20     -56.0   -42.9  Favored     ?  ?        6   98.840     9  0.64    12  0.58  molprobity  1.000  
 23   23  m-20      -56.9   -11.3  Allowed     ?  ?        4  103.660     8  0.87    11  0.73  molprobity  1.000  
 24   24  m-20     -129.4   -24.1  Favored     ?  ?        4  108.090     8  0.37    11  0.56  molprobity  1.000  
 25   25  m-85     -127.5   172.4  Favored     ?  ?        9  104.430    12  0.46    16  0.39  molprobity  1.000  
 26   26  m-20      -89.1   108.4  Favored     ?  ?        4  121.420     8  0.62    11  1.04  molprobity  1.000  
 27   27  t         -90.0   132.4  Favored     ?  ?        9  104.440     7  0.40    10  0.43  molprobity  1.000  
 28   28  mt       -116.8   139.5  Favored     ?  ?       11  124.210     8  0.60    11  0.87  molprobity  1.000  
 29   29  t        -127.6   143.3  Favored     ?  ?        7  127.810     7  0.53    10  0.76  molprobity  1.000  
 30   30  ?        -144.8   147.8  Favored     ?  ?        5  129.630     5  0.40     7  0.35  molprobity  1.000  
 31   31  mt-30     -90.7    -6.3  Favored     ?  ?        8  152.320     9  0.37    12  0.55  molprobity  1.000  
 32   32  ?         172.5  -175.4  Favored     ?  ?        3  145.510     4  0.26     5  0.36  molprobity  1.000  
 33   33  ?         -49.0   -72.9  OUTLIER     ?  ?        5  158.870     5  0.16     7  0.47  molprobity  1.000  
 34   34  tt0       -55.2   -39.5  Favored     ?  ?        6  189.450     9  0.30    12  0.36  molprobity  1.000  
 35   35  ?         -61.0   -40.5  Favored     ?  ?        5  150.560     5  0.31     7  0.28  molprobity  1.000  
 36   36  ?         -78.8   -38.0  Favored     ?  ?        5  133.580     5  0.45     7  0.53  molprobity  1.000  
 37   37  OUTLIER   -55.0   -43.5  Favored     ?  ?       11  155.990     8  0.30    11  0.70  molprobity  1.000  
 38   38  ?         -43.6   -28.5  Allowed     ?  ?        5  150.010     5  0.21     7  0.56  molprobity  1.000  
 39   39  mt        -91.5   -30.0  Favored     ?  ?       11  137.490     8  0.55    11  1.08  molprobity  1.000  
 40   40  mt        -75.2   -13.8  Favored     ?  ?       11  136.660     8  0.43    11  0.84  molprobity  1.000  
 41   41  tt0       -69.4   -62.4  Allowed     ?  ?        6  166.860     9  0.50    12  0.31  molprobity  1.000  
 42   42  tp10      -76.1   -46.7  Favored     ?  ?        6  193.360     9  0.29    12  0.41  molprobity  1.000  
 43   43  mm-40    -103.9   162.4  Favored     ?  ?        6  173.220     9  0.34    12  0.33  molprobity  1.000  
 44   44  t90      -106.3   129.7  Favored     ?  ?       10  143.390    16  0.32    23  0.34  molprobity  1.000  
 45   45  t        -128.8   124.8  Favored     ?  ?        9  122.410     7  0.35    10  0.61  molprobity  1.000  
 46   46  pt20      -90.2   -32.2  Favored     ?  ?        8  111.970     9  0.56    12  0.52  molprobity  1.000  
 47   47  t        -139.8   137.5  Favored     ?  ?        9   93.410     7  0.71    10  0.75  molprobity  1.000  
 48   48  mt       -125.1   140.5  Favored     ?  ?       11  100.630     8  0.36    11  0.82  molprobity  1.000  
 49   49  mt       -125.5   131.6  Favored     ?  ?       11   96.460     8  0.33    11  0.51  molprobity  1.000  
 50   50  OUTLIER  -132.5   122.1  Favored     ?  ?        5  104.410     6  0.84     8  1.17  molprobity  1.000  
 51   51  t0        -54.7   139.3  Favored     ?  ?        4  114.090     8  0.88    11  1.72  molprobity  1.000  
 52   52  tp60      -80.8   -49.0  Favored     1  ?        8  119.890     9  0.23    12  0.45  molprobity  1.000  
 53   53  mmt180    -78.6    87.1  Favored     ?  ?       13  149.890    11  0.25    14  0.44  molprobity  1.000  
 54   54  mtm      -132.0   134.2  Favored     ?  ?        9  144.880     8  0.31    11  0.32  molprobity  1.000  
 55   55  Cg_exo    -52.0   136.5  Favored     ?  ?        7  184.170     8  0.19    11  0.32  molprobity  1.000  
 56   56  ?          85.0  -100.2  Favored     ?  ?        3  203.010     4  0.51     5  0.55  molprobity  1.000  
 57   57  ttt180   -100.5   130.2  Favored     ?  ?       13  170.730    11  0.33    14  0.47  molprobity  1.000  
 58   58  p         -79.8   150.3  Favored     ?  ?        7  138.210     7  0.53    10  0.92  molprobity  1.000  
 59   59  ?         -39.2   -55.9  Favored     ?  ?        3  119.330     4  0.39     5  0.33  molprobity  1.000  
 60   60  m         -55.6   -36.9  Favored     ?  ?        9  118.380     7  0.40    10  0.74  molprobity  1.000  
 61   61  t0        -69.7   -61.9  Allowed     ?  ?        4  148.980     8  0.51    11  0.40  molprobity  1.000  
 62   62  t80       -33.8   -57.7  Allowed     ?  ?        9  130.900    12  0.27    16  0.46  molprobity  1.000  
 63   63  mt        -68.3   -25.5  Favored     ?  ?       11  110.260     8  0.41    11  0.92  molprobity  1.000  
 64   64  p         -60.6   -38.3  Favored     ?  ?        7  125.710     7  0.32    10  0.73  molprobity  1.000  
 65   65  tt0       -76.3   -45.0  Favored     ?  ?        6  155.320     9  0.47    12  0.36  molprobity  1.000  
 66   66  t         -50.3   -47.5  Favored     ?  ?        9  122.560     7  0.48    10  0.90  molprobity  1.000  
 67   67  OUTLIER   -50.1   -40.8  Favored     ?  ?       13  125.710    11  0.60    14  0.75  molprobity  1.000  
 68   68  mt-10     -80.3   -40.1  Favored     ?  ?        6  147.540     9  0.35    12  0.55  molprobity  1.000  
 69   69  mtp180    -87.2   -25.8  Favored     ?  ?       13  167.180    11  0.29    14  0.52  molprobity  1.000  
 70   70  m-90     -142.4    71.7  Favored     ?  ?       10  143.460    16  0.44    24  0.38  molprobity  1.000  
 71   71  Cg_exo    -71.6   -17.4  Favored     ?  ?        7  116.670     8  0.27    11  0.45  molprobity  1.000  
 72   72  mt-10     -68.7     3.6  Allowed     ?  ?        6  123.260     9  0.33    12  0.68  molprobity  1.000  
 73   73  m        -111.5   134.7  Favored     ?  ?        7  107.930     7  0.57    10  0.85  molprobity  1.000  
 74   74  t         -86.0   125.9  Favored     ?  ?        9   95.660     7  0.35    10  0.31  molprobity  1.000  
 75   75  mtt85    -104.2   134.5  Favored     ?  ?       13  102.830    11  0.41    14  0.41  molprobity  1.000  
 76   76  mt       -136.8   136.1  Favored     ?  ?       11   96.960     8  0.60    11  1.19  molprobity  1.000  
 77   77  OUTLIER  -104.5   156.9  Favored     ?  ?       11  106.890     8  0.32    11  0.32  molprobity  1.000  
 78   78  OUTLIER  -144.3   125.0  Favored     ?  ?       11  106.610     8  0.43    11  1.06  molprobity  1.000  
 79   79  OUTLIER  -138.7   140.6  Favored     ?  ?        7  129.200     7  0.69    10  0.79  molprobity  1.000  
 80   80  ?         -95.0   -18.1  Favored     ?  ?        3  153.900     4  0.32     5  0.34  molprobity  1.000  
 81   81  m-85      -96.5    65.1  Favored     ?  ?        9  167.620    13  0.23    18  0.26  molprobity  1.000  
 82   82  p         -77.9    -5.2  Favored     ?  ?        7  208.040     7  0.18    10  0.74  molprobity  1.000  
 83   83  t0        -86.2    -9.6  Favored     ?  ?        4  224.430     8  0.22    11  0.50  molprobity  1.000  
 84   84  p         -85.7   132.5  Favored     ?  ?        5  196.090     6  0.25     8  0.41  molprobity  1.000  
 85   85  ?         -81.0   -42.8  Favored     ?  ?        5  204.930     5  0.19     7  0.41  molprobity  1.000  
 86   86  OUTLIER   -41.1   -54.6  Favored     ?  ?        5  184.910     6  0.25     8  0.64  molprobity  1.000  
 87   87  ttm       -51.4   -61.6  Favored     ?  ?        9  154.990     8  0.36    10  0.48  molprobity  1.000  
 88   88  mmt       -51.4   -42.7  Favored     ?  ?        9  160.820     8  0.41    10  0.34  molprobity  1.000  
 89   89  ?         -57.7   -50.1  Favored     ?  ?        5  164.510     5  0.16     7  0.50  molprobity  1.000  
 90   90  ?         -56.0   -52.2  Favored     ?  ?        5  141.460     5  0.52     7  0.43  molprobity  1.000  
 91   91  mt        -52.8   -45.2  Favored     ?  ?       11  131.120     8  0.22    11  0.49  molprobity  1.000  
 92   92  m-20      -74.7    -8.1  Favored     ?  ?        6  154.290     8  0.39    11  0.61  molprobity  1.000  
 93   93  m-20      -90.1   -47.7  Favored     ?  ?        4  148.760     8  0.29    11  0.40  molprobity  1.000  
 94   94  ?         -59.6   171.6  Allowed     ?  ?        5  125.350     5  0.30     7  0.28  molprobity  1.000  
 95   95  ?         -99.6    64.2  Allowed     ?  ?        3  124.580     4  0.28     5  0.64  molprobity  1.000  
 96   96  mt       -106.4   119.7  Favored     ?  ?       11  113.990     8  0.33    11  0.54  molprobity  1.000  
 97   97  m80       -80.0   -42.1  Favored     ?  ?        7  111.690    11  0.27    15  0.40  molprobity  1.000  
 98   98  mp0      -133.1   146.2  Favored     ?  ?        8  110.040     9  1.13    12  0.72  molprobity  1.000  
 99   99  OUTLIER  -133.5   120.2  Favored     ?  ?        9  124.980    12  0.48    16  0.57  molprobity  1.000  
100  100  mt       -108.6   150.1  Favored     ?  ?       11  114.710     8  0.52    11  0.60  molprobity  1.000  
101  101  p         -94.5   147.8  Favored     ?  ?        7  135.530     7  0.37    10  0.80  molprobity  1.000  
102  102  mttt      -94.3   136.0  Favored     ?  Y       13  127.740     9  0.29    12  0.78  molprobity  1.000  
103  103  Cg_endo   -99.5  -168.9  Allowed     ?  ?        7  146.270     8  0.60    11  0.72  molprobity  1.000  
104  104  p-90     -156.0   140.8  Favored     ?  ?       10  115.860    16  0.65    23  0.54  molprobity  1.000  
105  105  t60       -67.5   126.7  Favored     1  ?        7  133.510    11  0.37    16  0.78  molprobity  1.000  
106  106  Cg_exo    -32.8   -26.9  OUTLIER     ?  ?        7  117.440     8  0.58    11  0.78  molprobity  1.000  
107  107  tp10     -110.6   -12.0  Favored     ?  ?        6  136.780     9  0.43    12  0.42  molprobity  1.000  
108  108  tp60      -90.9   -61.6  Allowed     ?  ?        8  109.520     9  0.68    12  0.94  molprobity  1.000  
109  109  OUTLIER   -49.1   -42.8  Favored     ?  ?       11  100.640     8  0.55    11  0.66  molprobity  1.000  
110  110  tp        -54.6   -32.5  Favored     ?  ?       11  111.400     8  0.26    11  0.39  molprobity  1.000  
111  111  t         -85.0   -46.6  Favored     ?  ?        5  104.170     6  0.49     8  0.61  molprobity  1.000  
112  112  m         -48.4   -33.4  Favored     ?  ?        5   95.340     6  0.31     8  0.82  molprobity  1.000  
113  113  ?         -65.6   -54.8  Favored     ?  ?        5   97.770     5  0.39     7  0.48  molprobity  1.000  
114  114  mtt180    -59.7   -35.7  Favored     ?  ?       13  122.840    11  0.23    14  0.67  molprobity  1.000  
115  115  OUTLIER   -48.6   -75.5  OUTLIER     ?  ?        6  102.060     8  0.50    11  0.98  molprobity  1.000  
116  116  ?         -32.3   -53.7  Allowed     ?  ?        5   97.320     5  0.48     7  0.48  molprobity  1.000  
117  117  ?         -69.7   -30.8  Favored     ?  ?        5  105.280     5  0.38     7  0.53  molprobity  1.000  
118  118  mtm-85    -70.2   -44.7  Favored     ?  ?       13  132.700    11  0.35    14  0.66  molprobity  1.000  
119  119  ttm       -56.8   -42.5  Favored     ?  ?        9  109.870     8  0.42    10  0.53  molprobity  1.000  
120  120  OUTLIER   -64.6   -33.9  Favored     ?  ?        9  109.330    12  0.66    16  0.79  molprobity  1.000  
121  121  OUTLIER   -68.4   -48.8  Favored     ?  ?        7  119.430     7  0.28    10  0.52  molprobity  1.000  
122  122  mt        -54.6   -64.3  Allowed     ?  ?       11  128.450     8  0.27    11  0.76  molprobity  1.000  
123  123  ?         -43.7   -44.5  Favored     ?  ?        5  111.020     5  0.37     7  0.28  molprobity  1.000  
124  124  ttt-85    -70.9   -37.6  Favored     ?  ?       13  127.070    11  0.36    14  0.57  molprobity  1.000  
125  125  tt0       -82.3   -31.2  Favored     ?  ?        6  157.320     9  0.53    12  0.52  molprobity  1.000  
126  126  t30       -52.7   -23.5  Favored     ?  ?        6  141.870     8  0.34    11  0.36  molprobity  1.000  
127  127  tt0       -91.7   -42.1  Favored     ?  ?        6  138.420     9  0.37    12  0.53  molprobity  1.000  
128  128  ttt-85    -46.6   -55.6  Favored     ?  ?       13  160.230    11  0.21    14  0.65  molprobity  1.000  
129  129  mt        -46.0   -56.1  Favored     ?  ?       11  156.880     8  0.21    11  0.30  molprobity  1.000  
130  130  m         -51.6   -73.6  OUTLIER     ?  ?        5  143.460     6  0.31     8  0.30  molprobity  1.000  
131  131  mt        -33.8   -50.8  Allowed     ?  ?       11  146.260     8  0.22    11  0.46  molprobity  1.000  
132  132  mt-10     -76.3   -24.8  Favored     ?  ?        6  167.230     9  0.27    12  0.38  molprobity  1.000  
133  133  ttt       -87.2    -8.9  Favored     ?  ?        9  166.190     8  0.40    10  0.23  molprobity  1.000  
134  134  mtt180    -79.7   -41.4  Favored     ?  ?       13  175.000    11  0.35    14  0.73  molprobity  1.000  
135  135  mt        -71.1    31.8  OUTLIER     ?  ?       11  166.010     8  0.32    11  0.32  molprobity  1.000  
136  136  mt       -127.3   -56.9  Allowed     ?  ?       11  172.940     8  0.26    11  0.29  molprobity  1.000  
137  137  ?             ?       ?  ?           ?  ?        2  169.060     4  0.37     4  0.21  molprobity  1.000  
138  138  ?             ?       ?  ?           ?  ?        ?  123.050     0     ?     ?     ?  mogul       1.000  
139  139  ?             ?       ?  ?           ?  ?        ?  123.420     ?     ?     ?     ?  ?           1.000  
140  140  ?             ?       ?  ?           ?  ?        ?  123.420     ?     ?     ?     ?  ?           0.500  
#
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  HB2    1  0.63  2.18  
 2    2  HB2    2  0.49  2.43  
 3    2  HB3    3  0.50  1.93  
 4    3  HB1    4  0.50  2.12  
 5    3  O      5  0.48  2.14  
 6    3  O      6  0.42  2.68  
 7    4  HG13   7  0.59  1.82  
 8    5  HB3    8  0.53  1.90  
 9    5  HD11   9  0.53  1.89  
10    9  OD1   10  0.49  2.30  
11    9  OD1   11  0.41  2.54  
12    9  HB3   12  0.41  2.02  
13    9  N     11  0.41  2.54  
14   10  HA    13  0.45  1.76  
15   11  HG3   14  0.50  2.12  
16   11  HD3   13  0.45  1.76  
17   26  O      4  0.50  2.12  
18   27  O     15  0.61  2.00  
19   27  C     16  0.47  2.34  
20   28  HD23  15  0.61  2.00  
21   28  HD23  16  0.47  2.34  
22   31  OE1   14  0.50  2.12  
23   39  HD12   9  0.53  1.89  
24   46  CD     1  0.63  2.18  
25   46  HB3    3  0.50  1.93  
26   46  CG     2  0.49  2.43  
27   46  CG     6  0.42  2.68  
28   46  HG2    5  0.48  2.14  
29   47  HB     7  0.59  1.82  
30   48  HG12   8  0.53  1.90  
31   50  HG    17  0.49  1.61  
32   50  SG    18  0.43  2.41  
33   51  OD2   10  0.49  2.30  
34   52  HE22  19  0.73  1.54  
35   52  HE22  20  0.52  2.19  
36   52  OE1   21  0.70  1.91  
37   52  NE2   22  0.44  2.33  
38   53  HG3   23  0.75  2.22  
39   53  HG3   24  0.67  2.29  
40   54  HG2   12  0.41  2.02  
41   58  HB    21  0.70  1.91  
42   60  O     25  0.87  1.75  
43   60  HG22  19  0.73  1.54  
44   60  CG2   20  0.52  2.19  
45   60  HG13  22  0.44  2.33  
46   61  O     26  0.46  2.53  
47   62  O     27  0.56  2.06  
48   62  HD2   17  0.49  1.61  
49   62  HD2   18  0.43  2.41  
50   62  C     26  0.46  2.53  
51   64  HG23  25  0.87  1.75  
52   66  HG23  27  0.56  2.06  
53   67  HA    28  0.41  2.35  
54   75  H     29  0.61  2.18  
55   75  NH2   28  0.41  2.35  
56   77  HD13  30  0.42  1.87  
57   77  HA    30  0.42  1.87  
58   77  CG2   31  0.42  2.82  
59   78  HG22  32  0.59  1.84  
60   78  N     31  0.42  2.82  
61   79  HG22  33  0.58  1.67  
62   79  HG22  34  0.58  2.38  
63   79  HA    35  0.58  1.93  
64   79  CG2   36  0.47  2.26  
65   79  O     37  0.42  2.19  
66   81  CD1   23  0.75  2.22  
67   81  CE1   24  0.67  2.29  
68   87  O     38  0.40  2.22  
69   90  HB3   38  0.40  2.22  
70   97  HB2   39  0.94  1.68  
71   97  CE1   29  0.61  2.18  
72   98  OE1   39  0.94  1.68  
73   99  HE2   33  0.58  1.67  
74   99  HE2   36  0.47  2.26  
75   99  CE2   34  0.58  2.38  
76  100  HB2   32  0.59  1.84  
77  101  HA    37  0.42  2.19  
78  105  HA    40  0.44  1.55  
79  105  HD2   41  0.42  1.85  
80  106  HD2   40  0.44  1.55  
81  107  HB3   41  0.42  1.85  
82  109  HD22  42  0.64  1.98  
83  109  HD22  43  0.42  2.39  
84  109  O     42  0.64  1.98  
85  109  C     43  0.42  2.39  
86  110  HD12  44  0.68  1.93  
87  110  O     44  0.68  1.93  
88  130  O     45  0.44  2.56  
89  131  C     45  0.44  2.56  
90  134  C     46  0.51  2.14  
91  135  O     47  0.46  2.16  
92  136  H     46  0.51  2.14  
93  136  HD23  47  0.46  2.16  
94  138  F1    35  0.58  1.93  
#
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   5  0.814  0.541   4.422  
  2    2   7  0.901  0.301   1.502  
  3    3   5  0.939  0.145  -0.479  
  4    4   8  0.975  0.210  -0.025  
  5    5   8  0.983  0.345   1.576  
  6    6   8  0.979  0.341   1.528  
  7    7   7  0.976  0.302   1.216  
  8    8   8  0.862  0.150  -0.524  
  9    9   8  0.892  0.153  -0.487  
 10   10   9  0.867  0.209  -0.172  
 11   11   7  0.848  0.215   0.401  
 12   12  10  0.916  0.177  -0.170  
 13   13   6  0.924  0.181   0.045  
 14   14   8  0.985  0.192  -0.280  
 15   15   5  0.957  0.208   0.301  
 16   16   5  0.982  0.156  -0.343  
 17   17   8  0.939  0.251   0.762  
 18   18   9  0.967  0.210  -0.337  
 19   19   8  0.978  0.179  -0.438  
 20   20   5  0.957  0.183  -0.009  
 21   21   8  0.908  0.177  -0.462  
 22   22   9  0.947  0.115  -1.203  
 23   23   8  0.914  0.224   0.395  
 24   24   8  0.941  0.089  -1.282  
 25   25  11  0.973  0.149  -0.716  
 26   26   8  0.907  0.259   0.830  
 27   27   7  0.962  0.124  -0.973  
 28   28   8  0.981  0.190  -0.305  
 29   29   7  0.952  0.162  -0.295  
 30   30   5  0.985  0.168  -0.194  
 31   31   9  0.883  0.262   0.607  
 32   32   4  0.930  0.152  -0.251  
 33   33   5  0.976  0.119  -0.801  
 34   34   9  0.878  0.288   0.694  
 35   35   5  0.960  0.132  -0.640  
 36   36   5  0.976  0.107  -0.949  
 37   37   8  0.978  0.174  -0.466  
 38   38   5  0.974  0.150  -0.417  
 39   39   8  0.982  0.197  -0.184  
 40   40   8  0.953  0.145  -0.851  
 41   41   9  0.848  0.231   0.069  
 42   42   9  0.843  0.311   0.946  
 43   43   9  0.924  0.267   0.464  
 44   44  14  0.884  0.298   1.459  
 45   45   7  0.967  0.202  -0.014  
 46   46   9  0.886  0.250   0.464  
 47   47   7  0.974  0.327   1.524  
 48   48   8  0.979  0.385   2.120  
 49   49   8  0.969  0.477   3.248  
 50   50   6  0.912  0.406   3.890  
 51   51   8  0.883  0.182  -0.127  
 52   52   9  0.933  0.205  -0.073  
 53   53  11  0.825  0.528   3.201  
 54   54   8  0.887  0.183  -0.099  
 55   55   7  0.835  0.297   1.451  
 56   56   4  0.824  0.175   0.019  
 57   57  11  0.916  0.216  -0.107  
 58   58   7  0.885  0.222   0.521  
 59   59   4  0.970  0.262   1.037  
 60   60   7  0.952  0.214   0.134  
 61   61   8  0.948  0.183  -0.114  
 62   62  11  0.938  0.263   0.649  
 63   63   8  0.954  0.191  -0.292  
 64   64   7  0.945  0.208   0.331  
 65   65   9  0.923  0.192  -0.359  
 66   66   7  0.970  0.143  -0.739  
 67   67  11  0.843  0.277   0.540  
 68   68   9  0.861  0.313   0.968  
 69   69  11  0.887  0.286   0.635  
 70   70  14  0.912  0.196   0.031  
 71   71   7  0.908  0.174  -0.124  
 72   72   9  0.913  0.151  -0.808  
 73   73   7  0.928  0.255   0.970  
 74   74   7  0.957  0.316   1.389  
 75   75  11  0.872  0.294   0.720  
 76   76   8  0.966  0.366   1.887  
 77   77   8  0.986  0.240   0.343  
 78   78   8  0.953  0.220   0.098  
 79   79   7  0.919  0.299   1.569  
 80   80   4  0.873  0.428   2.981  
 81   81  12  0.883  0.383   2.412  
 82   82   7  0.842  0.198   0.195  
 83   83   8  0.876  0.216   0.296  
 84   84   6  0.898  0.229   0.686  
 85   85   5  0.949  0.310   1.563  
 86   86   6  0.914  0.254   1.020  
 87   87   8  0.966  0.221   0.382  
 88   88   8  0.925  0.146  -0.567  
 89   89   5  0.956  0.345   1.996  
 90   90   5  0.974  0.167  -0.207  
 91   91   8  0.966  0.138  -0.907  
 92   92   8  0.870  0.224   0.449  
 93   93   8  0.930  0.256   0.793  
 94   94   5  0.954  0.159  -0.306  
 95   95   4  0.782  0.227   0.628  
 96   96   8  0.975  0.171  -0.502  
 97   97  10  0.903  0.139  -0.666  
 98   98   9  0.809  0.259   0.571  
 99   99  11  0.944  0.217   0.098  
100  100   8  0.962  0.204  -0.135  
101  101   7  0.922  0.162  -0.295  
102  102   9  0.959  0.157  -0.869  
103  103   7  0.827  0.240   0.721  
104  104  14  0.944  0.163  -0.431  
105  105  10  0.946  0.195   0.065  
106  106   7  0.959  0.227   0.554  
107  107   9  0.941  0.184  -0.446  
108  108   9  0.843  0.173  -0.454  
109  109   8  0.959  0.208  -0.086  
110  110   8  0.972  0.270   0.666  
111  111   6  0.974  0.104  -0.983  
112  112   6  0.978  0.127  -0.676  
113  113   5  0.980  0.163  -0.256  
114  114  11  0.953  0.142  -0.892  
115  115   8  0.954  0.132  -0.760  
116  116   5  0.977  0.145  -0.479  
117  117   5  0.984  0.133  -0.627  
118  118  11  0.917  0.258   0.338  
119  119   8  0.976  0.199   0.104  
120  120  11  0.965  0.182  -0.321  
121  121   7  0.963  0.164  -0.268  
122  122   8  0.976  0.251   0.436  
123  123   5  0.967  0.149  -0.429  
124  124  11  0.922  0.229   0.031  
125  125   9  0.934  0.305   0.880  
126  126   8  0.940  0.190   0.003  
127  127   9  0.936  0.192  -0.359  
128  128  11  0.921  0.313   0.922  
129  129   8  0.955  0.213  -0.025  
130  130   6  0.939  0.128  -0.662  
131  131   8  0.957  0.311   1.164  
132  132   9  0.948  0.173  -0.567  
133  133   8  0.949  0.140  -0.643  
134  134  11  0.911  0.355   1.367  
135  135   8  0.961  0.241   0.314  
136  136   8  0.943  0.366   1.831  
137  137   5  0.886  0.297   0.793  
138  138   4  0.922  0.266       ?  
139  139   1  0.884  0.132       ?  
140  140   1  0.890  0.606       ?  
#
loop_
_pdbx_vrpt_software.ordinal
_pdbx_vrpt_software.name
_pdbx_vrpt_software.version
_pdbx_vrpt_software.success_y_or_n
1  molprobity   4.02b-467                                                             Y  
2  mogul        "1.8.4, CSD as541be (2020)"                                           Y  
3  eds          2.36                                                                  Y  
4  dcc          '"2.27  (2023-04-10)"'                                                Y  
5  xtriage      1.13                                                                  Y  
6  percentiles  "20191225.v01 (using entries in the PDB archive December 25th 2019)"  Y  
##
