data_7CG5

_pdbx_vrpt_database.id    PDB
_pdbx_vrpt_database.code  7CG5
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   x-ray
#
_pdbx_vrpt_summary.entry_id                    7CG5
_pdbx_vrpt_summary.PDB_deposition_date         2020-06-30
_pdbx_vrpt_summary.PDB_revision_number         2
_pdbx_vrpt_summary.PDB_revision_date           2023-11-29
_pdbx_vrpt_summary.report_creation_date        2023-11-20:02:08
_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  "Anti-sigma factor RsgI, N-terminal"  
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  2.85  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   74.38  141614     ?     ?  
 2  2  1   87.70    3438  2.82  2.90  
 3  1  2  100.00  138981     ?     ?  
 4  2  2  100.00    3348  2.82  2.90  
 5  1  3  100.00  138945     ?     ?  
 6  2  3  100.00    3351  2.82  2.90  
 7  1  4    6.79  127900     ?     ?  
 8  2  4    4.74    3103  2.82  2.90  
 9  1  5    8.24  130704     ?     ?  
10  2  5   21.41    3168  2.82  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  A  100.00  
2  4  2  A  1  1  A  100.00  
3  5  3  A  1  1  A  100.00  
4  6  3  A  1  1  A  100.00  
5  7  4  A  1  1  A    6.79  
6  8  4  A  1  1  A    4.74  
#
_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      0.56
_pdbx_vrpt_summary_entity_geometry.bonds_RMSZ       0.38
_pdbx_vrpt_summary_entity_geometry.num_bonds_RMSZ   781
_pdbx_vrpt_summary_entity_geometry.num_angles_RMSZ  1059
#
_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                     3.23
_pdbx_vrpt_summary_geometry.num_H_reduce                   781
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ                 781
_pdbx_vrpt_summary_geometry.bonds_RMSZ                     0.38
_pdbx_vrpt_summary_geometry.num_angles_RMSZ                1059
_pdbx_vrpt_summary_geometry.angles_RMSZ                    0.56
#
_pdbx_vrpt_summary_diffraction.exp_method                x-ray
_pdbx_vrpt_summary_diffraction.ordinal                   1
_pdbx_vrpt_summary_diffraction.bulk_solvent_b            40.331
_pdbx_vrpt_summary_diffraction.Wilson_B_estimate         60.214
_pdbx_vrpt_summary_diffraction.I_over_sigma              2.44(2.86A)
_pdbx_vrpt_summary_diffraction.num_miller_indices        3071
_pdbx_vrpt_summary_diffraction.bulk_solvent_k            0.333
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L_mean     0.489
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L2_mean    0.329
_pdbx_vrpt_summary_diffraction.Fo_Fc_correlation         0.915
_pdbx_vrpt_summary_diffraction.DCC_R                     0.24
_pdbx_vrpt_summary_diffraction.DCC_Rfree                 0.29
_pdbx_vrpt_summary_diffraction.EDS_R                     0.26
_pdbx_vrpt_summary_diffraction.EDS_res_high              2.85
_pdbx_vrpt_summary_diffraction.EDS_res_low               44.31
_pdbx_vrpt_summary_diffraction.Wilson_B_aniso            "[81.814,81.814,35.271,0.000,0.000,0.000]"
_pdbx_vrpt_summary_diffraction.data_anisotropy           0.702
_pdbx_vrpt_summary_diffraction.trans_NCS_details         "The largest off-origin peak in the Patterson function is 10.05% 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         0
_pdbx_vrpt_summary_diffraction.centric_outliers          0
_pdbx_vrpt_summary_diffraction.data_completeness         94.46
_pdbx_vrpt_summary_diffraction.number_reflns_R_free      307
_pdbx_vrpt_summary_diffraction.percent_free_reflections  10.00
_pdbx_vrpt_summary_diffraction.percent_RSRZ_outliers     10.00
_pdbx_vrpt_summary_diffraction.PDB_resolution_high       2.85
_pdbx_vrpt_summary_diffraction.PDB_resolution_low        35.61
_pdbx_vrpt_summary_diffraction.PDB_R                     0.24
_pdbx_vrpt_summary_diffraction.PDB_Rfree                 0.29
#
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  MET  A    1  .  ?        ?  
  2  1  1  A    2  VAL  A    2  .  ?        ?  
  3  1  1  A    3  GLU  A    3  .  ?        ?  
  4  1  1  A    4  ILE  A    4  .  ?        ?  
  5  1  1  A    5  ALA  A    5  .  ?        ?  
  6  1  1  A    6  ILE  A    6  .  ?        ?  
  7  1  1  A    7  ASN  A    7  .  ?        ?  
  8  1  1  A    8  PRO  A    8  .  ?        1  
  9  1  1  A    9  ALA  A    9  .  ?        ?  
 10  1  1  A   10  SER  A   10  .  ?        ?  
 11  1  1  A   11  GLU  A   11  .  ?        ?  
 12  1  1  A   12  ILE  A   12  .  ?        ?  
 13  1  1  A   13  THR  A   13  .  ?        ?  
 14  1  1  A   14  ALA  A   14  .  ?        ?  
 15  1  1  A   15  THR  A   15  .  ?        ?  
 16  1  1  A   16  SER  A   16  .  ?        ?  
 17  1  1  A   17  ALA  A   17  .  ?        ?  
 18  1  1  A   18  PHE  A   18  .  ?        ?  
 19  1  1  A   19  ILE  A   19  .  ?        ?  
 20  1  1  A   20  SER  A   20  .  ?        ?  
 21  1  1  A   21  GLY  A   21  .  ?        ?  
 22  1  1  A   22  THR  A   22  .  ?        ?  
 23  1  1  A   23  VAL  A   23  .  ?        ?  
 24  1  1  A   24  THR  A   24  .  ?        ?  
 25  1  1  A   25  LYS  A   25  .  ?        ?  
 26  1  1  A   36  GLY  A   36  .  ?        ?  
 27  1  1  A   37  CYS  A   37  .  ?        ?  
 28  1  1  A   38  ASN  A   38  .  ?        ?  
 29  1  1  A   39  ILE  A   39  .  ?        ?  
 30  1  1  A   40  SER  A   40  .  ?        ?  
 31  1  1  A   41  LEU  A   41  .  ?        ?  
 32  1  1  A   42  LEU  A   42  .  ?        1  
 33  1  1  A   43  TYR  A   43  .  ?        ?  
 34  1  1  A   44  TRP  A   44  .  ?        1  
 35  1  1  A   45  GLU  A   45  .  ?        ?  
 36  1  1  A   46  ALA  A   46  .  ?        ?  
 37  1  1  A   47  SER  A   47  .  ?        ?  
 38  1  1  A   48  ASN  A   48  .  ?        ?  
 39  1  1  A   49  PRO  A   49  .  ?        1  
 40  1  1  A   50  MET  A   50  .  ?        ?  
 41  1  1  A   51  HIS  A   51  .  ?        ?  
 42  1  1  A   52  VAL  A   52  .  ?        ?  
 43  1  1  A   53  LYS  A   53  .  ?        ?  
 44  1  1  A   54  VAL  A   54  .  ?        1  
 45  1  1  A   55  ALA  A   55  .  ?        ?  
 46  1  1  A   56  SER  A   56  .  ?        ?  
 47  1  1  A   57  SER  A   57  .  ?        ?  
 48  1  1  A   58  ILE  A   58  .  ?        1  
 49  1  1  A   59  SER  A   59  .  ?        ?  
 50  1  1  A   60  LYS  A   60  .  ?        1  
 51  1  1  A   61  LYS  A   61  .  ?        ?  
 52  1  1  A   62  ASP  A   62  .  ?        ?  
 53  1  1  A   63  PHE  A   63  .  ?        ?  
 54  1  1  A   64  PRO  A   64  .  ?        ?  
 55  1  1  A   65  ALA  A   65  .  ?        1  
 56  1  1  A   66  ASP  A   66  .  ?        ?  
 57  1  1  A   67  ILE  A   67  .  ?        1  
 58  1  1  A   68  SER  A   68  .  ?        ?  
 59  1  1  A   69  ALA  A   69  .  ?        ?  
 60  1  1  A   70  THR  A   70  .  ?        ?  
 61  1  1  A   71  ILE  A   71  .  ?        ?  
 62  1  1  A   72  LYS  A   72  .  ?        ?  
 63  1  1  A   73  ASP  A   73  .  ?        ?  
 64  1  1  A   74  LEU  A   74  .  ?        ?  
 65  1  1  A   75  LYS  A   75  .  ?        ?  
 66  1  1  A   76  PRO  A   76  .  ?        ?  
 67  1  1  A   77  HIS  A   77  .  ?        ?  
 68  1  1  A   78  THR  A   78  .  ?        ?  
 69  1  1  A   79  THR  A   79  .  ?        ?  
 70  1  1  A   80  TYR  A   80  .  ?        ?  
 71  1  1  A   81  GLN  A   81  .  ?        ?  
 72  1  1  A   82  PHE  A   82  .  ?        ?  
 73  1  1  A   83  LYS  A   83  .  ?        ?  
 74  1  1  A   84  VAL  A   84  .  ?        ?  
 75  1  1  A   85  THR  A   85  .  ?        ?  
 76  1  1  A   86  VAL  A   86  .  ?        ?  
 77  1  1  A   87  ASN  A   87  .  ?        ?  
 78  1  1  A   88  PHE  A   88  .  ?        ?  
 79  1  1  A   89  TYR  A   89  .  ?        ?  
 80  1  1  A   90  PHE  A   90  .  ?        ?  
 81  1  1  A   91  SER  A   91  .  ?        ?  
 82  1  1  A   92  SER  A   92  .  ?        ?  
 83  1  1  A   93  SER  A   93  .  ?        ?  
 84  1  1  A   94  LEU  A   94  .  ?        ?  
 85  1  1  A   95  GLN  A   95  .  ?        1  
 86  1  1  A   96  THR  A   96  .  ?        ?  
 87  1  1  A   97  PHE  A   97  .  ?        ?  
 88  1  1  A   98  LYS  A   98  .  ?        ?  
 89  1  1  A   99  THR  A   99  .  ?        ?  
 90  1  1  A  100  LEU  A  100  .  ?        ?  
 91  1  1  A  101  ALA  A  101  .  ?        ?  
 92  1  1  A  102  LEU  A  102  .  ?        ?  
 93  1  1  A  103  GLU  A  103  .  ?        ?  
 94  1  1  A  104  SER  A  104  .  ?        ?  
 95  1  1  A  105  LYS  A  105  .  ?        ?  
 96  1  1  A  106  SER  A  106  .  ?        ?  
 97  1  1  A  107  THR  A  107  .  ?        ?  
 98  1  1  A  108  SER  A  108  .  ?        ?  
 99  1  1  A  109  ILE  A  109  .  ?        ?  
100  1  1  A  110  VAL  A  110  .  ?        ?  
101  1  2  B    .  HOH  A  201  .  ?        ?  
102  1  2  B    .  HOH  A  202  .  ?        ?  
#
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.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  pmm?          ?       ?  ?        ?       11  114.180     8  0.42    10  0.72  molprobity  1.000  
  2    2  p        -139.6   147.6  Favored  ?        9   94.420     7  0.19    10  0.33  molprobity  1.000  
  3    3  mt-10    -118.8   133.4  Favored  ?        6   88.600     9  0.24    12  0.34  molprobity  1.000  
  4    4  mp       -126.2   129.8  Favored  ?       11   76.750     8  0.27    11  0.61  molprobity  1.000  
  5    5  ?        -107.2   133.2  Favored  ?        5   70.500     5  0.42     7  0.50  molprobity  1.000  
  6    6  tt       -125.7   134.4  Favored  ?       11   63.260     8  0.60    11  0.94  molprobity  1.000  
  7    7  m120     -105.1   150.0  Favored  ?        6   58.180     8  0.40    12  0.38  molprobity  1.000  
  8    8  Cg_endo   -63.3   151.2  Favored  ?        7   57.900     8  0.24    11  0.39  molprobity  1.000  
  9    9  ?         -70.0   144.3  Favored  ?        5   58.650     5  0.18     7  0.42  molprobity  1.000  
 10   10  p        -127.9   175.0  Favored  ?        5   62.980     6  0.36     8  0.52  molprobity  1.000  
 11   11  mt-10      54.0    44.5  Favored  ?        6   66.830     9  0.47    12  0.37  molprobity  1.000  
 12   12  mt        -84.3   130.8  Favored  ?       11   58.030     8  0.29    11  0.37  molprobity  1.000  
 13   13  p        -127.9  -164.6  Allowed  ?        7   57.700     7  0.26    10  0.64  molprobity  1.000  
 14   14  ?         -65.1   -30.2  Favored  ?        5   53.670     5  0.23     7  0.50  molprobity  1.000  
 15   15  p        -138.0    15.2  Favored  ?        7   55.360     7  0.34    10  0.75  molprobity  1.000  
 16   16  p        -153.7   161.5  Favored  ?        5   61.720     6  0.26     8  0.51  molprobity  1.000  
 17   17  ?        -156.6   158.1  Favored  ?        5   61.870     5  0.31     7  0.66  molprobity  1.000  
 18   18  t80      -112.5   114.6  Favored  ?        9   61.260    12  0.59    16  0.40  molprobity  1.000  
 19   19  pt       -114.3   146.5  Favored  ?       11   60.640     8  0.34    11  0.61  molprobity  1.000  
 20   20  p        -151.4   161.3  Favored  ?        5   59.200     6  0.40     8  0.64  molprobity  1.000  
 21   21  ?        -158.3   176.1  Favored  ?        3   64.030     4  0.42     5  1.07  molprobity  1.000  
 22   22  m        -150.1   138.6  Favored  ?        7   70.040     7  0.31    10  0.61  molprobity  1.000  
 23   23  t        -111.3   122.9  Favored  ?        9   79.420     7  0.41    10  0.56  molprobity  1.000  
 24   24  p        -108.0   -55.0  Favored  ?        7   91.820     7  0.26    10  0.70  molprobity  1.000  
 25   25  mmpt?         ?       ?  ?        ?       13  108.650     8  0.40     8  0.60  molprobity  1.000  
 26   26  ?             ?       ?  ?        ?        2  100.350     4  0.19     5  0.43  molprobity  1.000  
 27   27  m        -123.7   146.0  Favored  ?        5  101.580     6  0.58     8  0.52  molprobity  1.000  
 28   28  t30       -93.4   139.1  Favored  ?        6   70.310     8  0.18    11  0.59  molprobity  1.000  
 29   29  mt       -127.9   134.7  Favored  ?       11   67.850     8  0.35    11  0.67  molprobity  1.000  
 30   30  m        -139.2   139.2  Favored  ?        5   58.580     6  0.32     8  0.51  molprobity  1.000  
 31   31  mt        -95.5   116.5  Favored  ?       11   54.750     8  0.23    11  0.81  molprobity  1.000  
 32   32  mt       -112.9   123.1  Favored  ?       11   52.670     8  0.20    11  0.78  molprobity  1.000  
 33   33  p90      -126.5   151.4  Favored  ?        9   51.240    13  0.36    18  0.50  molprobity  1.000  
 34   34  p90      -161.8   159.5  Favored  ?       10   50.380    16  0.44    23  0.55  molprobity  1.000  
 35   35  pt-20     -81.8   149.9  Favored  ?        6   55.320     9  0.40    12  0.73  molprobity  1.000  
 36   36  ?         -57.3   -44.1  Favored  ?        5   53.560     5  0.23     7  0.16  molprobity  1.000  
 37   37  p         -71.7   -14.9  Favored  ?        5   60.220     6  0.19     8  0.54  molprobity  1.000  
 38   38  t-20     -133.7    80.3  Favored  ?        6   55.730     8  0.25    12  0.38  molprobity  1.000  
 39   39  Cg_endo   -74.2   -10.8  Favored  ?        7   56.400     8  0.30    11  0.48  molprobity  1.000  
 40   40  mmt       -73.1   -44.3  Favored  ?        9   61.180     8  0.22    10  0.37  molprobity  1.000  
 41   41  t-160     -77.4    77.6  Favored  ?        7   56.850    11  0.22    15  0.69  molprobity  1.000  
 42   42  p        -106.0   127.1  Favored  ?        9   54.370     7  0.31    10  0.49  molprobity  1.000  
 43   43  mttt     -107.7   171.2  Favored  ?       13   54.290     9  0.68    11  0.64  molprobity  1.000  
 44   44  t        -118.5   115.8  Favored  ?        9   51.600     7  0.48    10  0.63  molprobity  1.000  
 45   45  ?         -68.5   -44.0  Favored  ?        5   52.700     5  0.26     7  0.31  molprobity  1.000  
 46   46  t        -155.0   150.6  Favored  ?        5   55.250     6  0.33     8  0.57  molprobity  1.000  
 47   47  t        -137.0   120.3  Favored  ?        5   58.690     6  0.27     8  0.61  molprobity  1.000  
 48   48  pt       -133.1   145.3  Favored  ?       11   65.450     8  0.27    11  0.57  molprobity  1.000  
 49   49  p        -115.0    86.5  Favored  ?        5   75.460     6  0.66     8  0.64  molprobity  1.000  
 50   50  mttm      -97.6   131.6  Favored  ?       13   90.230     9  0.53    11  0.77  molprobity  1.000  
 51   51  pttm      -94.1     4.4  Favored  ?       13  111.210     9  0.36    11  0.81  molprobity  1.000  
 52   52  m-20     -111.7   107.7  Favored  ?        4  113.600     8  0.24    11  0.65  molprobity  1.000  
 53   53  m-30     -108.3   144.2  Favored  Y        9  101.380    12  0.41    17  0.37  molprobity  1.000  
 54   54  Cg_endo   -75.3   161.3  Favored  ?        7   99.010     8  0.20    11  0.42  molprobity  1.000  
 55   55  ?        -134.4   133.7  Favored  ?        5   83.180     5  0.21     7  0.58  molprobity  1.000  
 56   56  m-20     -107.4   128.7  Favored  ?        4   71.180     8  0.24    11  0.42  molprobity  1.000  
 57   57  tt       -123.0   132.8  Favored  ?       11   63.320     8  0.24    11  0.52  molprobity  1.000  
 58   58  m        -142.3   150.4  Favored  ?        5   62.690     6  0.42     8  0.62  molprobity  1.000  
 59   59  ?        -164.5   132.3  Favored  ?        5   59.840     5  0.30     7  0.31  molprobity  1.000  
 60   60  t         -93.9    92.4  Favored  ?        7   64.590     7  0.39    10  0.61  molprobity  1.000  
 61   61  pt        -71.2   129.5  Favored  ?       11   61.050     8  0.36    11  0.41  molprobity  1.000  
 62   62  mttt     -108.1   179.5  Favored  ?       13   58.590     9  0.48    11  0.74  molprobity  1.000  
 63   63  t0         53.5    54.8  Favored  ?        4   60.780     8  0.26    11  0.45  molprobity  1.000  
 64   64  mt       -100.8   159.4  Favored  ?       11   54.530     8  0.46    11  0.60  molprobity  1.000  
 65   65  mttm      -78.3   127.4  Favored  ?       13   57.300     9  0.63    12  0.42  molprobity  1.000  
 66   66  Cg_exo    -61.1   150.3  Favored  ?        7   50.110     8  0.21    11  0.50  molprobity  1.000  
 67   67  t-80       56.1    41.0  Favored  ?        7   47.600    11  0.27    15  0.32  molprobity  1.000  
 68   68  m        -129.8   145.5  Favored  ?        7   46.740     7  0.38    10  0.49  molprobity  1.000  
 69   69  m         -89.7   125.8  Favored  ?        7   46.380     7  0.32    10  0.68  molprobity  1.000  
 70   70  m-85     -118.4   157.9  Favored  ?        9   46.670    13  0.72    18  0.34  molprobity  1.000  
 71   71  mt-30    -133.3   152.7  Favored  ?        8   49.220     9  0.53    12  0.58  molprobity  1.000  
 72   72  p90      -148.7   148.9  Favored  ?        9   50.050    12  0.48    16  0.43  molprobity  1.000  
 73   73  pttt     -138.1   176.2  Favored  ?       13   55.300     9  0.37    11  0.57  molprobity  1.000  
 74   74  t        -118.9   128.8  Favored  ?        9   57.410     7  0.18    10  0.48  molprobity  1.000  
 75   75  p        -120.0   135.2  Favored  ?        7   60.650     7  0.27    10  0.49  molprobity  1.000  
 76   76  t        -115.4   124.3  Favored  ?        9   69.310     7  0.33    10  0.52  molprobity  1.000  
 77   77  m-20       54.6    33.1  Favored  ?        6   76.680     8  0.20    11  0.38  molprobity  1.000  
 78   78  m-85       72.6    -7.5  Allowed  ?        9   72.320    12  0.51    16  0.63  molprobity  1.000  
 79   79  t80      -130.5   -21.4  Favored  ?        9  105.730    13  0.47    18  0.49  molprobity  1.000  
 80   80  m-30      -93.3   100.1  Favored  ?        9   80.110    12  0.35    16  0.53  molprobity  1.000  
 81   81  m         -96.3   144.3  Favored  ?        5   76.700     6  0.41     8  0.54  molprobity  1.000  
 82   82  p         -91.9  -171.6  Favored  ?        5   69.910     6  0.25     8  0.64  molprobity  1.000  
 83   83  p         -77.8   167.2  Favored  ?        5   64.400     6  0.38     8  0.64  molprobity  1.000  
 84   84  mt        -86.2   151.1  Favored  ?       11   57.830     8  0.33    11  0.73  molprobity  1.000  
 85   85  tp-100   -125.5   148.9  Favored  ?        8   49.880     9  0.57    12  0.59  molprobity  1.000  
 86   86  m        -128.6   137.6  Favored  ?        7   46.690     7  0.36    10  0.62  molprobity  1.000  
 87   87  p90      -146.2   166.1  Favored  ?        9   46.850    12  0.37    16  0.41  molprobity  1.000  
 88   88  tttt     -134.9   132.1  Favored  ?       13   51.470     9  0.33    11  0.38  molprobity  1.000  
 89   89  p         -65.8   161.8  Favored  ?        7   49.710     7  0.26    10  0.54  molprobity  1.000  
 90   90  mt        -80.4   165.6  Favored  ?       11   50.100     8  0.28    11  0.60  molprobity  1.000  
 91   91  ?         -89.2   171.5  Favored  ?        5   55.270     5  0.32     7  0.66  molprobity  1.000  
 92   92  mt        -73.7   142.5  Favored  ?       11   54.740     8  0.21    11  0.42  molprobity  1.000  
 93   93  mt-10    -147.1   151.2  Favored  ?        6   71.630     9  0.25    12  0.46  molprobity  1.000  
 94   94  m        -121.3  -177.9  Favored  ?        5   64.160     6  0.47     8  0.53  molprobity  1.000  
 95   95  ttmt     -102.2    92.5  Favored  ?       13   80.310     9  0.31    11  0.67  molprobity  1.000  
 96   96  t         -72.7   128.1  Favored  ?        5   89.660     6  0.20     8  0.35  molprobity  1.000  
 97   97  p        -130.0    83.9  Favored  ?        7   85.570     7  0.43    10  0.37  molprobity  1.000  
 98   98  p         -75.9   165.8  Favored  ?        5   82.660     6  0.38     8  0.53  molprobity  1.000  
 99   99  mp       -123.9   121.0  Favored  ?       11   85.860     8  0.31    11  0.71  molprobity  1.000  
100  100  m             ?       ?  ?        ?        9   87.560     6  0.37     7  0.51  molprobity  1.000  
101  101  ?             ?       ?  ?        ?        ?   43.980     ?     ?     ?     ?  ?           1.000  
102  102  ?             ?       ?  ?        ?        ?   41.830     ?     ?     ?     ?  ?           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   8  HA    1  0.63  1.80  
 2  32  HD22  2  0.41  2.02  
 3  34  CD1   3  0.62  2.34  
 4  39  HA    3  0.62  2.34  
 5  44  HG22  2  0.41  2.02  
 6  48  HG12  4  0.66  1.78  
 7  50  HD2   5  0.42  2.01  
 8  55  HB1   5  0.42  2.01  
 9  57  HD12  4  0.66  1.78  
10  85  HG2   1  0.63  1.80  
#
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   8  0.793  0.281   1.142  
  2    2   7  0.968  0.384   2.225  
  3    3   9  0.895  0.400   1.922  
  4    4   8  0.959  0.357   1.777  
  5    5   5  0.965  0.216   0.400  
  6    6   8  0.963  0.163  -0.600  
  7    7   8  0.959  0.130  -0.786  
  8    8   7  0.982  0.171  -0.163  
  9    9   5  0.986  0.189   0.066  
 10   10   6  0.951  0.145  -0.435  
 11   11   9  0.876  0.255   0.332  
 12   12   8  0.933  0.191  -0.257  
 13   13   7  0.971  0.132  -0.703  
 14   14   5  0.951  0.198   0.177  
 15   15   7  0.946  0.243   0.807  
 16   16   6  0.971  0.125  -0.702  
 17   17   5  0.958  0.146  -0.467  
 18   18  11  0.947  0.214   0.062  
 19   19   8  0.966  0.190  -0.270  
 20   20   6  0.974  0.143  -0.462  
 21   21   4  0.943  0.207   0.393  
 22   22   7  0.903  0.197   0.181  
 23   23   7  0.973  0.198  -0.063  
 24   24   7  0.873  0.384   2.725  
 25   25   9  0.814  0.521   2.785  
 26   26   4  0.697  0.253   0.932  
 27   27   6  0.707  0.190   0.483  
 28   28   8  0.976  0.139  -0.668  
 29   29   8  0.974  0.251   0.478  
 30   30   6  0.936  0.153  -0.328  
 31   31   8  0.972  0.222   0.084  
 32   32   8  0.958  0.204  -0.135  
 33   33  12  0.961  0.187  -0.150  
 34   34  14  0.961  0.189  -0.067  
 35   35   9  0.918  0.250   0.277  
 36   36   5  0.974  0.184   0.004  
 37   37   6  0.903  0.200   0.299  
 38   38   8  0.919  0.196   0.081  
 39   39   7  0.953  0.208   0.311  
 40   40   8  0.899  0.137  -0.681  
 41   41  10  0.955  0.129  -0.796  
 42   42   7  0.969  0.266   0.774  
 43   43   9  0.896  0.206  -0.378  
 44   44   7  0.954  0.174  -0.358  
 45   45   5  0.948  0.157  -0.330  
 46   46   6  0.975  0.171  -0.088  
 47   47   6  0.955  0.142  -0.475  
 48   48   8  0.945  0.234   0.270  
 49   49   6  0.918  0.196   0.246  
 50   50   9  0.905  0.267   0.235  
 51   51   9  0.869  0.251   0.074  
 52   52   8  0.684  0.361   2.097  
 53   53  11  0.850  0.357   1.775  
 54   54   7  0.921  0.356   2.206  
 55   55   5  0.924  0.227   0.536  
 56   56   8  0.929  0.201   0.109  
 57   57   8  0.960  0.137  -0.919  
 58   58   6  0.913  0.152  -0.342  
 59   59   5  0.923  0.229   0.561  
 60   60   7  0.954  0.149  -0.472  
 61   61   8  0.964  0.190  -0.270  
 62   62   9  0.857  0.245   0.014  
 63   63   8  0.891  0.282   1.116  
 64   64   8  0.940  0.201  -0.171  
 65   65   9  0.865  0.263   0.195  
 66   66   7  0.936  0.242   0.746  
 67   67  10  0.971  0.200   0.131  
 68   68   7  0.951  0.225   0.562  
 69   69   7  0.964  0.186   0.031  
 70   70  12  0.951  0.199   0.007  
 71   71   9  0.963  0.182  -0.347  
 72   72  11  0.965  0.175  -0.405  
 73   73   9  0.961  0.163  -0.809  
 74   74   7  0.959  0.298   1.167  
 75   75   7  0.932  0.149  -0.472  
 76   76   7  0.966  0.267   0.786  
 77   77   8  0.954  0.111  -1.035  
 78   78  11  0.937  0.275   0.793  
 79   79  12  0.771  0.392   2.529  
 80   80  11  0.920  0.279   0.841  
 81   81   6  0.907  0.366   2.515  
 82   82   6  0.920  0.162  -0.208  
 83   83   6  0.962  0.129  -0.649  
 84   84   8  0.933  0.219   0.047  
 85   85   9  0.930  0.195  -0.192  
 86   86   7  0.951  0.175  -0.118  
 87   87  11  0.966  0.198  -0.129  
 88   88   9  0.973  0.226  -0.177  
 89   89   7  0.969  0.183  -0.010  
 90   90   8  0.967  0.219   0.047  
 91   91   5  0.959  0.248   0.796  
 92   92   8  0.925  0.177  -0.462  
 93   93   9  0.885  0.436   2.317  
 94   94   6  0.921  0.185   0.099  
 95   95   9  0.926  0.293   0.496  
 96   96   6  0.884  0.239   0.820  
 97   97   7  0.834  0.236   0.712  
 98   98   6  0.888  0.288   1.474  
 99   99   8  0.914  0.464   3.088  
100  100   7  0.805  0.378   2.151  
101  101   1  0.711  0.297       ?  
102  102   1  0.924  1.127       ?  
#
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  
##
