data_6DVU

_pdbx_vrpt_database.id    PDB
_pdbx_vrpt_database.code  6DVU
#
_pdbx_vrpt_exptl.ordinal  1
_pdbx_vrpt_exptl.method   x-ray
#
_pdbx_vrpt_summary.entry_id                    6DVU
_pdbx_vrpt_summary.PDB_deposition_date         2018-06-25
_pdbx_vrpt_summary.PDB_revision_number         4
_pdbx_vrpt_summary.PDB_revision_date           2023-10-11
_pdbx_vrpt_summary.report_creation_date        2023-10-08:02:27
_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  "Apolipoprotein C-I"  
2  water    water  
#
loop_
_pdbx_vrpt_asym.label_asym_id
_pdbx_vrpt_asym.entity_id
A  1  
B  1  
C  2  
D  2  
#
loop_
_pdbx_vrpt_percentile_list.id
_pdbx_vrpt_percentile_list.range
_pdbx_vrpt_percentile_list.exp_method
1  all  x-ray  
2  1.8  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   55.43  141614     ?     ?  
 2  2  1   47.70    6793  1.80  1.80  
 3  1  2  100.00  138981     ?     ?  
 4  2  2  100.00    6697  1.80  1.80  
 5  1  3   75.87  138945     ?     ?  
 6  2  3   71.16    6696  1.80  1.80  
 7  1  4   40.11  127900     ?     ?  
 8  2  4   34.51    5850  1.80  1.80  
 9  1  5   12.99  130704     ?     ?  
10  2  5    2.66    5950  1.80  1.80  
#
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   53.07  
 4  6  3  A  1  1  A   41.50  
 5  7  4  A  1  1  A   21.98  
 6  8  4  A  1  1  A   17.47  
 7  3  2  B  1  1  B  100.00  
 8  4  2  B  1  1  B  100.00  
 9  5  3  B  1  1  B  100.00  
10  6  3  B  1  1  B  100.00  
11  7  4  B  1  1  B   66.49  
12  8  4  B  1  1  B   62.55  
#
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  0.54  0.47  437  577  
2  1  1  B  B  0.52  0.48  441  584  
#
_pdbx_vrpt_summary_geometry.ordinal                        1
_pdbx_vrpt_summary_geometry.percent_ramachandran_outliers  0.00
_pdbx_vrpt_summary_geometry.percent_rotamer_outliers       1.04
_pdbx_vrpt_summary_geometry.clashscore                     5.06
_pdbx_vrpt_summary_geometry.num_H_reduce                   912
_pdbx_vrpt_summary_geometry.num_bonds_RMSZ                 878
_pdbx_vrpt_summary_geometry.bonds_RMSZ                     0.47
_pdbx_vrpt_summary_geometry.num_angles_RMSZ                1161
_pdbx_vrpt_summary_geometry.angles_RMSZ                    0.53
#
_pdbx_vrpt_summary_diffraction.exp_method                x-ray
_pdbx_vrpt_summary_diffraction.ordinal                   1
_pdbx_vrpt_summary_diffraction.Babinet_b                 400.000
_pdbx_vrpt_summary_diffraction.bulk_solvent_b            106.119
_pdbx_vrpt_summary_diffraction.Wilson_B_estimate         18.954
_pdbx_vrpt_summary_diffraction.I_over_sigma              1.17(1.81A)
_pdbx_vrpt_summary_diffraction.num_miller_indices        7318
_pdbx_vrpt_summary_diffraction.Babinet_k                 0.334
_pdbx_vrpt_summary_diffraction.bulk_solvent_k            0.405
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L_mean     0.512
_pdbx_vrpt_summary_diffraction.Padilla_Yeates_L2_mean    0.348
_pdbx_vrpt_summary_diffraction.Fo_Fc_correlation         0.927
_pdbx_vrpt_summary_diffraction.DCC_R                     0.23
_pdbx_vrpt_summary_diffraction.DCC_Rfree                 0.28
_pdbx_vrpt_summary_diffraction.EDS_R                     0.24
_pdbx_vrpt_summary_diffraction.EDS_res_high              1.80
_pdbx_vrpt_summary_diffraction.EDS_res_low               33.74
_pdbx_vrpt_summary_diffraction.Wilson_B_aniso            "[15.484,18.450,23.397,0.000,2.647,0.000]"
_pdbx_vrpt_summary_diffraction.data_anisotropy           0.414
_pdbx_vrpt_summary_diffraction.trans_NCS_details         "The largest off-origin peak in the Patterson function is 12.95% 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         1
_pdbx_vrpt_summary_diffraction.centric_outliers          0
_pdbx_vrpt_summary_diffraction.data_completeness         84.97
_pdbx_vrpt_summary_diffraction.number_reflns_R_free      353
_pdbx_vrpt_summary_diffraction.percent_free_reflections  4.82
_pdbx_vrpt_summary_diffraction.percent_RSRZ_outliers     3.85
_pdbx_vrpt_summary_diffraction.PDB_resolution_high       1.80
_pdbx_vrpt_summary_diffraction.PDB_resolution_low        33.00
_pdbx_vrpt_summary_diffraction.PDB_R                     0.22
_pdbx_vrpt_summary_diffraction.PDB_Rfree                 0.28
#
loop_
_pdbx_vrpt_model_instance.id
_pdbx_vrpt_model_instance.PDB_model_num
_pdbx_vrpt_model_instance.entity_id
_pdbx_vrpt_model_instance.label_asym_id
_pdbx_vrpt_model_instance.label_seq_id
_pdbx_vrpt_model_instance.label_comp_id
_pdbx_vrpt_model_instance.auth_asym_id
_pdbx_vrpt_model_instance.auth_seq_id
_pdbx_vrpt_model_instance.label_alt_id
_pdbx_vrpt_model_instance.PDB_ins_code
_pdbx_vrpt_model_instance.count_clashes
  1  1  1  A  31  SER  A    5  .  ?        ?  
  2  1  1  A  32  SER  A    6  .  ?        ?  
  3  1  1  A  33  ALA  A    7  .  ?        ?  
  4  1  1  A  34  LEU  A    8  .  ?        ?  
  5  1  1  A  35  ASP  A    9  .  ?        ?  
  6  1  1  A  36  LYS  A   10  .  ?        ?  
  7  1  1  A  37  LEU  A   11  .  ?        ?  
  8  1  1  A  38  LYS  A   12  .  ?        ?  
  9  1  1  A  39  GLU  A   13  .  ?        ?  
 10  1  1  A  40  PHE  A   14  .  ?        ?  
 11  1  1  A  41  GLY  A   15  .  ?        ?  
 12  1  1  A  42  ASN  A   16  .  ?        ?  
 13  1  1  A  43  THR  A   17  .  ?        ?  
 14  1  1  A  44  LEU  A   18  .  ?        ?  
 15  1  1  A  45  GLU  A   19  .  ?        ?  
 16  1  1  A  46  ASP  A   20  .  ?        ?  
 17  1  1  A  47  LYS  A   21  .  ?        ?  
 18  1  1  A  48  ALA  A   22  .  ?        ?  
 19  1  1  A  49  ARG  A   23  .  ?        ?  
 20  1  1  A  50  GLU  A   24  .  ?        ?  
 21  1  1  A  51  LEU  A   25  .  ?        ?  
 22  1  1  A  52  ILE  A   26  .  ?        ?  
 23  1  1  A  53  SER  A   27  .  ?        1  
 24  1  1  A  54  ARG  A   28  A  ?        ?  
 25  1  1  A  54  ARG  A   28  B  ?        ?  
 26  1  1  A  55  ILE  A   29  .  ?        ?  
 27  1  1  A  56  LYS  A   30  .  ?        ?  
 28  1  1  A  57  GLN  A   31  .  ?        1  
 29  1  1  A  58  SER  A   32  .  ?        ?  
 30  1  1  A  59  GLU  A   33  .  ?        ?  
 31  1  1  A  60  LEU  A   34  .  ?        ?  
 32  1  1  A  61  SER  A   35  .  ?        ?  
 33  1  1  A  62  ALA  A   36  .  ?        ?  
 34  1  1  A  63  LYS  A   37  .  ?        ?  
 35  1  1  A  64  MET  A   38  .  ?        ?  
 36  1  1  A  65  ARG  A   39  .  ?        ?  
 37  1  1  A  66  GLU  A   40  .  ?        ?  
 38  1  1  A  67  TRP  A   41  .  ?        ?  
 39  1  1  A  68  PHE  A   42  .  ?        ?  
 40  1  1  A  69  SER  A   43  .  ?        ?  
 41  1  1  A  70  GLU  A   44  .  ?        2  
 42  1  1  A  71  THR  A   45  .  ?        ?  
 43  1  1  A  72  PHE  A   46  .  ?        ?  
 44  1  1  A  73  GLN  A   47  .  ?        ?  
 45  1  1  A  74  LYS  A   48  .  ?        2  
 46  1  1  A  75  VAL  A   49  .  ?        ?  
 47  1  1  A  76  LYS  A   50  .  ?        ?  
 48  1  1  A  77  GLU  A   51  .  ?        ?  
 49  1  1  A  78  LYS  A   52  .  ?        ?  
 50  1  1  A  79  LEU  A   53  .  ?        ?  
 51  1  1  A  80  LYS  A   54  .  ?        6  
 52  1  1  A  81  ILE  A   55  .  ?        ?  
 53  1  1  B  29  ASP  B    3  .  ?        ?  
 54  1  1  B  30  VAL  B    4  .  ?        ?  
 55  1  1  B  31  SER  B    5  .  ?        ?  
 56  1  1  B  32  SER  B    6  .  ?        ?  
 57  1  1  B  33  ALA  B    7  .  ?        ?  
 58  1  1  B  34  LEU  B    8  .  ?        ?  
 59  1  1  B  35  ASP  B    9  .  ?        ?  
 60  1  1  B  36  LYS  B   10  .  ?        ?  
 61  1  1  B  37  LEU  B   11  .  ?        ?  
 62  1  1  B  38  LYS  B   12  .  ?        ?  
 63  1  1  B  39  GLU  B   13  .  ?        ?  
 64  1  1  B  40  PHE  B   14  .  ?        ?  
 65  1  1  B  41  GLY  B   15  .  ?        ?  
 66  1  1  B  42  ASN  B   16  .  ?        ?  
 67  1  1  B  43  THR  B   17  .  ?        ?  
 68  1  1  B  44  LEU  B   18  .  ?        ?  
 69  1  1  B  45  GLU  B   19  .  ?        1  
 70  1  1  B  46  ASP  B   20  .  ?        ?  
 71  1  1  B  47  LYS  B   21  .  ?        ?  
 72  1  1  B  48  ALA  B   22  .  ?        ?  
 73  1  1  B  49  ARG  B   23  .  ?        1  
 74  1  1  B  50  GLU  B   24  .  ?        ?  
 75  1  1  B  51  LEU  B   25  .  ?        ?  
 76  1  1  B  52  ILE  B   26  .  ?        ?  
 77  1  1  B  53  SER  B   27  .  ?        ?  
 78  1  1  B  54  ARG  B   28  .  ?        ?  
 79  1  1  B  55  ILE  B   29  .  ?        ?  
 80  1  1  B  56  LYS  B   30  .  ?        ?  
 81  1  1  B  57  GLN  B   31  .  ?        ?  
 82  1  1  B  58  SER  B   32  .  ?        ?  
 83  1  1  B  59  GLU  B   33  .  ?        ?  
 84  1  1  B  60  LEU  B   34  .  ?        ?  
 85  1  1  B  61  SER  B   35  .  ?        ?  
 86  1  1  B  62  ALA  B   36  .  ?        ?  
 87  1  1  B  63  LYS  B   37  .  ?        ?  
 88  1  1  B  64  MET  B   38  .  ?        ?  
 89  1  1  B  65  ARG  B   39  .  ?        ?  
 90  1  1  B  66  GLU  B   40  .  ?        1  
 91  1  1  B  67  TRP  B   41  .  ?        ?  
 92  1  1  B  68  PHE  B   42  .  ?        ?  
 93  1  1  B  69  SER  B   43  .  ?        ?  
 94  1  1  B  70  GLU  B   44  .  ?        1  
 95  1  1  B  71  THR  B   45  .  ?        ?  
 96  1  1  B  72  PHE  B   46  .  ?        1  
 97  1  1  B  73  GLN  B   47  .  ?        ?  
 98  1  1  B  74  LYS  B   48  .  ?        ?  
 99  1  1  B  75  VAL  B   49  .  ?        ?  
100  1  1  B  76  LYS  B   50  .  ?        1  
101  1  1  B  77  GLU  B   51  .  ?        ?  
102  1  1  B  78  LYS  B   52  .  ?        ?  
103  1  1  B  79  LEU  B   53  .  ?        ?  
104  1  1  B  80  LYS  B   54  .  ?        ?  
105  1  1  B  81  ILE  B   55  .  ?        ?  
106  1  2  C   .  HOH  A  101  B  ?        ?  
107  1  2  C   .  HOH  A  102  .  ?        ?  
108  1  2  C   .  HOH  A  103  .  ?        ?  
109  1  2  C   .  HOH  A  104  .  ?        ?  
110  1  2  C   .  HOH  A  105  .  ?        ?  
111  1  2  C   .  HOH  A  106  .  ?        ?  
112  1  2  C   .  HOH  A  107  .  ?        ?  
113  1  2  C   .  HOH  A  108  .  ?        ?  
114  1  2  C   .  HOH  A  109  .  ?        ?  
115  1  2  C   .  HOH  A  110  .  ?        ?  
116  1  2  C   .  HOH  A  111  .  ?        ?  
117  1  2  D   .  HOH  B  101  .  ?        ?  
118  1  2  D   .  HOH  B  102  .  ?        ?  
119  1  2  D   .  HOH  B  103  B  ?        ?  
120  1  2  D   .  HOH  B  104  .  ?        ?  
121  1  2  D   .  HOH  B  105  .  ?        ?  
122  1  2  D   .  HOH  B  106  .  ?        ?  
123  1  2  D   .  HOH  B  107  .  ?        ?  
124  1  2  D   .  HOH  B  108  .  ?        ?  
125  1  2  D   .  HOH  B  109  A  ?        ?  
126  1  2  D   .  HOH  B  110  .  ?        ?  
127  1  2  D   .  HOH  B  111  .  ?        ?  
128  1  2  D   .  HOH  B  112  .  ?        ?  
129  1  2  D   .  HOH  B  113  .  ?        ?  
130  1  2  D   .  HOH  B  114  .  ?        ?  
131  1  2  D   .  HOH  B  115  .  ?        ?  
132  1  2  D   .  HOH  B  116  .  ?        ?  
#
loop_
_pdbx_vrpt_model_instance_geometry.ordinal
_pdbx_vrpt_model_instance_geometry.instance_id
_pdbx_vrpt_model_instance_geometry.rotamer_class
_pdbx_vrpt_model_instance_geometry.phi
_pdbx_vrpt_model_instance_geometry.psi
_pdbx_vrpt_model_instance_geometry.ramachandran_class
_pdbx_vrpt_model_instance_geometry.flippable_sidechain
_pdbx_vrpt_model_instance_geometry.num_H_reduce
_pdbx_vrpt_model_instance_geometry.OWAB
_pdbx_vrpt_model_instance_geometry.num_bonds_RMSZ
_pdbx_vrpt_model_instance_geometry.bonds_RMSZ
_pdbx_vrpt_model_instance_geometry.num_angles_RMSZ
_pdbx_vrpt_model_instance_geometry.angles_RMSZ
_pdbx_vrpt_model_instance_geometry.program_for_bond_angle_geometry
_pdbx_vrpt_model_instance_geometry.average_occupancy
  1    1  m             ?       ?  ?           ?     4   55.520     6  0.71     8  0.42  molprobity  1.000  
  2    2  t         -65.0   -51.1  Favored     ?     5   52.350     6  0.34     8  0.48  molprobity  1.000  
  3    3  ?         -63.4   -31.1  Favored     ?     5   38.780     5  0.29     7  0.26  molprobity  1.000  
  4    4  mt        -70.0   -53.8  Favored     ?    11   36.340     8  0.32    11  0.39  molprobity  1.000  
  5    5  m-20      -66.0   -25.8  Favored     ?     4   55.500     8  0.39    11  0.35  molprobity  1.000  
  6    6  ttpt      -67.3   -41.7  Favored     ?    13   49.540     9  0.36    11  0.53  molprobity  1.000  
  7    7  mt        -69.9   -30.1  Favored     ?    11   43.210     8  0.33    11  0.24  molprobity  1.000  
  8    8  mtmt      -71.9   -37.5  Favored     ?    13   37.070     9  0.32    11  0.41  molprobity  1.000  
  9    9  mt-10     -65.3   -41.2  Favored     ?     6   47.620     9  0.30    12  0.76  molprobity  1.000  
 10   10  t80       -57.8   -50.0  Favored     ?     9   34.080    12  0.52    16  0.48  molprobity  1.000  
 11   11  ?         -57.7   -42.8  Favored     ?     3   26.600     4  0.82     5  0.31  molprobity  1.000  
 12   12  m-20      -67.9   -41.0  Favored     ?     6   40.370     8  0.35    11  0.67  molprobity  1.000  
 13   13  m         -60.6   -46.9  Favored     ?     7   31.670     7  0.34    10  0.35  molprobity  1.000  
 14   14  mt        -54.9   -44.3  Favored     ?    11   26.120     8  0.36    11  0.73  molprobity  1.000  
 15   15  tm-20     -65.4   -43.2  Favored     ?     6   32.180     9  0.45    12  0.38  molprobity  1.000  
 16   16  t70       -65.6   -39.6  Favored     ?     4   34.170     8  0.41    11  0.49  molprobity  1.000  
 17   17  mttt      -68.9   -34.7  Favored     ?    13   29.210     9  0.63    11  0.55  molprobity  1.000  
 18   18  ?         -61.6   -44.0  Favored     ?     5   19.900     5  0.36     7  0.32  molprobity  1.000  
 19   19  mtm105    -69.1   -42.4  Favored     ?    13   31.840    11  0.30    14  0.63  molprobity  1.000  
 20   20  tp10      -54.1   -50.1  Favored     ?     6   35.290     9  0.51    12  0.49  molprobity  1.000  
 21   21  tp        -54.4   -47.5  Favored     ?    11   18.880     8  0.43    11  0.58  molprobity  1.000  
 22   22  mt        -58.3   -43.9  Favored     ?    11   20.850     8  0.39    11  0.47  molprobity  1.000  
 23   23  t         -63.2   -41.3  Favored     ?     5   23.950     6  0.70     8  0.36  molprobity  1.000  
 24   24  mtt180    -68.0   -39.0  Favored     ?    13   26.840    11  0.40    14  0.59  molprobity  1.000  
 25   25  mtt180    -68.0   -39.0  Favored     ?    13   26.840    11  0.40    14  0.59  molprobity  1.000  
 26   26  mt        -58.5   -45.0  Favored     ?    11   20.360     8  0.35    11  0.79  molprobity  1.000  
 27   27  mttp      -69.4   -33.7  Favored     ?    13   37.200     9  0.53    11  0.38  molprobity  1.000  
 28   28  mt-30     -71.6   -38.0  Favored     ?     8   26.180     9  0.39    12  0.58  molprobity  1.000  
 29   29  m         -64.3   -41.6  Favored     ?     5   19.190     6  0.58     8  0.67  molprobity  1.000  
 30   30  tt0       -61.3   -44.1  Favored     ?     6   29.290     9  0.45    12  0.32  molprobity  1.000  
 31   31  tp        -61.2   -47.2  Favored     ?    11   21.320     8  0.22    11  0.52  molprobity  1.000  
 32   32  t         -57.8   -49.2  Favored     ?     5   18.520     6  0.46     8  0.33  molprobity  1.000  
 33   33  ?         -64.6   -42.0  Favored     ?     5   17.240     5  0.42     7  0.35  molprobity  1.000  
 34   34  mtmp?     -65.6   -35.7  Favored     ?    13   28.490     9  0.40    11  0.50  molprobity  1.000  
 35   35  mtp       -71.1   -39.4  Favored     ?     9   26.420     8  0.51    10  0.36  molprobity  1.000  
 36   36  ttm-85    -54.3   -54.8  Favored     ?    13   34.780    11  0.61    14  0.79  molprobity  1.000  
 37   37  mm-40     -62.6   -46.6  Favored     ?     6   37.290     9  0.45    12  0.34  molprobity  1.000  
 38   38  t90       -58.6   -51.7  Favored     ?    10   19.700    16  0.60    23  0.68  molprobity  1.000  
 39   39  m-30      -56.1   -46.6  Favored     ?     9   20.150    12  0.50    16  0.65  molprobity  1.000  
 40   40  t         -63.5   -44.2  Favored     ?     5   23.040     6  0.90     8  0.60  molprobity  1.000  
 41   41  tt0       -64.8   -41.7  Favored     ?     6   30.950     9  0.97    12  0.72  molprobity  1.000  
 42   42  m         -62.2   -43.5  Favored     ?     7   17.400     7  0.44    10  0.44  molprobity  1.000  
 43   43  t80       -60.3   -43.6  Favored     ?     9   27.320    12  0.73    16  0.58  molprobity  1.000  
 44   44  mm-40     -64.8   -39.7  Favored     1     8   30.620     9  0.30    12  0.44  molprobity  1.000  
 45   45  mttt      -61.3   -38.6  Favored     ?    13   28.460     9  0.44    11  1.02  molprobity  1.000  
 46   46  t         -67.1   -45.7  Favored     ?     9   25.990     7  0.39    10  0.53  molprobity  1.000  
 47   47  mttt      -51.1   -55.2  Favored     ?    13   41.160     9  0.28    11  0.63  molprobity  1.000  
 48   48  mt-10     -57.7   -39.9  Favored     ?     6   36.860     9  0.44    12  0.41  molprobity  1.000  
 49   49  mttm      -75.6   -18.7  Favored     ?    13   41.510     9  0.34    11  0.46  molprobity  1.000  
 50   50  mt       -118.4    29.4  Favored     ?    11   32.830     8  0.17    11  0.38  molprobity  1.000  
 51   51  OUTLIER    55.4  -130.9  Allowed     ?    13   63.920     9  0.22    11  0.37  molprobity  1.000  
 52   52  mt            ?       ?  ?           ?    11   67.380     7  0.14     8  0.50  molprobity  1.000  
 53   53  t0            ?       ?  ?           ?     3   41.830     8  0.69    11  0.48  molprobity  1.000  
 54   54  t         -65.9   -33.7  Favored     ?     9   44.090     7  0.26    10  0.73  molprobity  1.000  
 55   55  t         -62.2   -54.1  Favored     ?     5   34.250     6  0.75     8  0.44  molprobity  1.000  
 56   56  m         -56.8   -32.6  Favored     ?     5   34.280     6  0.68     8  0.22  molprobity  1.000  
 57   57  ?         -66.6   -52.1  Favored     ?     5   28.710     5  0.74     7  0.45  molprobity  1.000  
 58   58  mt        -62.2   -39.0  Favored     ?    11   26.090     8  0.34    11  0.56  molprobity  1.000  
 59   59  m-20      -63.6   -40.8  Favored     ?     4   26.010     8  0.51    11  0.43  molprobity  1.000  
 60   60  tptt      -63.7   -37.3  Favored     ?    13   27.750     9  0.47    11  0.30  molprobity  1.000  
 61   61  mt        -69.6   -34.2  Favored     ?    11   19.830     8  0.25    11  0.24  molprobity  1.000  
 62   62  mttt      -61.8   -44.3  Favored     ?    13   24.650     9  0.45    11  0.86  molprobity  1.000  
 63   63  tt0       -65.1   -41.8  Favored     ?     6   26.620     9  0.68    12  0.54  molprobity  1.000  
 64   64  t80       -58.8   -52.6  Favored     ?     9   17.300    12  0.67    16  0.48  molprobity  1.000  
 65   65  ?         -55.4   -44.6  Favored     ?     3   16.270     4  0.76     5  0.19  molprobity  1.000  
 66   66  m-80      -61.5   -47.0  Favored     ?     6   27.580     8  0.49    11  0.57  molprobity  1.000  
 67   67  m         -62.8   -42.8  Favored     ?     7   20.130     7  0.56    10  0.60  molprobity  1.000  
 68   68  tp        -59.1   -39.5  Favored     ?    11   16.280     8  0.53    11  0.76  molprobity  1.000  
 69   69  tm-20     -61.7   -45.1  Favored     ?     6   28.040     9  0.47    12  0.68  molprobity  1.000  
 70   70  m-20      -65.4   -38.6  Favored     ?     4   25.750     8  0.47    11  0.70  molprobity  1.000  
 71   71  mmtm      -71.3   -32.1  Favored     ?    13   26.620     9  0.53    11  0.38  molprobity  1.000  
 72   72  ?         -63.5   -42.4  Favored     ?     5   16.290     5  0.56     7  0.47  molprobity  1.000  
 73   73  mtm-85    -64.8   -43.5  Favored     ?    13   38.900    11  0.40    14  0.39  molprobity  1.000  
 74   74  mt-10     -61.2   -38.3  Favored     ?     6   35.300     9  0.33    12  0.36  molprobity  1.000  
 75   75  tp        -59.7   -44.9  Favored     ?    11   24.300     8  0.27    11  0.42  molprobity  1.000  
 76   76  mt        -62.7   -41.4  Favored     ?    11   23.680     8  0.37    11  0.66  molprobity  1.000  
 77   77  p         -62.9   -43.4  Favored     ?     5   30.240     6  0.50     8  0.87  molprobity  1.000  
 78   78  mmt180    -59.0   -40.0  Favored     ?    13   45.610    11  0.47    14  0.66  molprobity  1.000  
 79   79  mt        -60.7   -41.0  Favored     ?    11   25.670     8  0.27    11  0.51  molprobity  1.000  
 80   80  mmtt      -66.7   -30.9  Favored     ?    13   36.970     9  0.45    11  0.35  molprobity  1.000  
 81   81  mt-30     -66.0   -41.3  Favored     ?     8   33.570     9  0.31    12  0.50  molprobity  1.000  
 82   82  p         -72.0   -39.9  Favored     ?     5   30.940     6  0.41     8  0.45  molprobity  1.000  
 83   83  tt0       -48.0   -47.2  Favored     ?     6   30.360     9  0.54    12  0.54  molprobity  1.000  
 84   84  tp        -60.5   -45.2  Favored     ?    11   26.480     8  0.28    11  0.48  molprobity  1.000  
 85   85  t         -60.0   -47.2  Favored     ?     5   23.200     6  0.64     8  0.27  molprobity  1.000  
 86   86  ?         -64.6   -41.8  Favored     ?     5   21.480     5  0.38     7  0.37  molprobity  1.000  
 87   87  mttt      -62.8   -40.4  Favored     ?    13   31.830     9  0.55    11  0.32  molprobity  1.000  
 88   88  mmm       -71.3   -39.3  Favored     ?     9   22.000     8  0.45    10  0.55  molprobity  1.000  
 89   89  ttm-85    -57.1   -39.8  Favored     ?    13   37.480    11  0.45    14  0.32  molprobity  1.000  
 90   90  tt0       -65.7   -43.8  Favored     ?     6   35.290     9  0.52    12  0.38  molprobity  1.000  
 91   91  t90       -65.7   -43.1  Favored     ?    10   23.660    16  0.46    23  0.29  molprobity  1.000  
 92   92  m-85      -60.6   -47.8  Favored     ?     9   20.030    12  0.29    16  0.32  molprobity  1.000  
 93   93  p         -68.4   -45.3  Favored     ?     5   29.930     6  0.55     8  0.47  molprobity  1.000  
 94   94  mm-40     -61.4   -48.0  Favored     ?     6   38.680     9  0.29    12  0.29  molprobity  1.000  
 95   95  m         -60.2   -43.5  Favored     ?     7   24.420     7  0.43    10  0.61  molprobity  1.000  
 96   96  t80       -63.4   -39.1  Favored     ?     9   25.340    12  0.73    16  0.49  molprobity  1.000  
 97   97  tp60      -51.1   -45.0  Favored     ?     8   45.870     9  0.36    12  0.46  molprobity  1.000  
 98   98  mptp?     -67.3   -35.5  Favored     ?    13   41.990     9  0.36    11  0.53  molprobity  1.000  
 99   99  t         -60.7   -51.9  Favored     ?     9   29.390     7  0.46    10  0.61  molprobity  1.000  
100  100  mtpt      -54.6   -48.9  Favored     ?    13   36.000     9  0.42    11  0.69  molprobity  1.000  
101  101  mt-10     -62.2   -40.0  Favored     ?     6   43.400     9  0.36    12  0.40  molprobity  1.000  
102  102  tptt      -70.3   -33.6  Favored     ?    13   38.060     9  0.50    11  0.54  molprobity  1.000  
103  103  mt        -95.9   -43.0  Favored     ?    11   30.050     8  0.25    11  0.94  molprobity  1.000  
104  104  mtpt      -60.4   -33.3  Favored     ?    13   65.940     9  0.30    11  0.71  molprobity  1.000  
105  105  mt            ?       ?  ?           ?    11   60.550     7  0.22     8  0.49  molprobity  1.000  
106  106  ?             ?       ?  ?           ?     ?   35.530     ?     ?     ?     ?  ?           0.500  
107  107  ?             ?       ?  ?           ?     ?   37.510     ?     ?     ?     ?  ?           1.000  
108  108  ?             ?       ?  ?           ?     ?   50.430     ?     ?     ?     ?  ?           1.000  
109  109  ?             ?       ?  ?           ?     ?   52.370     ?     ?     ?     ?  ?           1.000  
110  110  ?             ?       ?  ?           ?     ?   51.960     ?     ?     ?     ?  ?           1.000  
111  111  ?             ?       ?  ?           ?     ?   42.300     ?     ?     ?     ?  ?           1.000  
112  112  ?             ?       ?  ?           ?     ?  102.210     ?     ?     ?     ?  ?           1.000  
113  113  ?             ?       ?  ?           ?     ?   39.760     ?     ?     ?     ?  ?           1.000  
114  114  ?             ?       ?  ?           ?     ?   42.410     ?     ?     ?     ?  ?           1.000  
115  115  ?             ?       ?  ?           ?     ?   49.780     ?     ?     ?     ?  ?           1.000  
116  116  ?             ?       ?  ?           ?     ?   40.540     ?     ?     ?     ?  ?           1.000  
117  117  ?             ?       ?  ?           ?     ?   52.380     ?     ?     ?     ?  ?           1.000  
118  118  ?             ?       ?  ?           ?     ?   54.760     ?     ?     ?     ?  ?           1.000  
119  119  ?             ?       ?  ?           ?     ?   34.610     ?     ?     ?     ?  ?           0.500  
120  120  ?             ?       ?  ?           ?     ?   32.430     ?     ?     ?     ?  ?           1.000  
121  121  ?             ?       ?  ?           ?     ?   65.930     ?     ?     ?     ?  ?           1.000  
122  122  ?             ?       ?  ?           ?     ?   38.470     ?     ?     ?     ?  ?           1.000  
123  123  ?             ?       ?  ?           ?     ?   53.510     ?     ?     ?     ?  ?           1.000  
124  124  ?             ?       ?  ?           ?     ?   40.730     ?     ?     ?     ?  ?           1.000  
125  125  ?             ?       ?  ?           ?     ?   27.740     ?     ?     ?     ?  ?           0.500  
126  126  ?             ?       ?  ?           ?     ?   42.510     ?     ?     ?     ?  ?           1.000  
127  127  ?             ?       ?  ?           ?     ?   47.860     ?     ?     ?     ?  ?           1.000  
128  128  ?             ?       ?  ?           ?     ?   65.390     ?     ?     ?     ?  ?           1.000  
129  129  ?             ?       ?  ?           ?     ?   47.300     ?     ?     ?     ?  ?           1.000  
130  130  ?             ?       ?  ?           ?     ?   47.830     ?     ?     ?     ?  ?           1.000  
131  131  ?             ?       ?  ?           ?     ?   73.740     ?     ?     ?     ?  ?           1.000  
132  132  ?             ?       ?  ?           ?     ?   43.030     ?     ?     ?     ?  ?           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   23  O    1  0.42  2.19  
 2   28  HG3  1  0.42  2.19  
 3   41  HG2  2  0.51  1.91  
 4   41  CG   3  0.44  2.47  
 5   45  HE3  2  0.51  1.91  
 6   45  HE3  3  0.44  2.47  
 7   51  HD3  4  0.61  2.14  
 8   51  HD3  5  0.41  1.84  
 9   51  N    4  0.61  2.14  
10   51  N    6  0.46  2.78  
11   51  CD   6  0.46  2.78  
12   51  H    5  0.41  1.84  
13   69  OE1  7  0.46  2.48  
14   73  NH1  7  0.46  2.48  
15   90  O    8  0.41  2.21  
16   94  HG2  8  0.41  2.21  
17   96  CE2  9  0.60  2.37  
18  100  HD2  9  0.60  2.37  
#
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   6  0.791  0.122   0.231  
  2    2   6  0.875  0.184   1.342  
  3    3   5  0.719  0.225   2.505  
  4    4   8  0.865  0.140   0.622  
  5    5   8  0.874  0.189   1.118  
  6    6   9  0.796  0.182   0.523  
  7    7   8  0.905  0.175   1.405  
  8    8   9  0.924  0.094  -0.758  
  9    9   9  0.927  0.137  -0.061  
 10   10  11  0.906  0.126   0.485  
 11   11   4  0.867  0.108   0.105  
 12   12   8  0.913  0.094  -0.343  
 13   13   7  0.957  0.086  -0.382  
 14   14   8  0.947  0.105  -0.161  
 15   15   9  0.823  0.168   0.377  
 16   16   8  0.908  0.140   0.337  
 17   17   9  0.944  0.095  -0.744  
 18   18   5  0.940  0.105   0.061  
 19   19  11  0.891  0.144   0.192  
 20   20   9  0.949  0.143   0.024  
 21   21   8  0.971  0.084  -0.631  
 22   22   8  0.974  0.081  -0.708  
 23   23   6  0.951  0.085  -0.432  
 24   24  19  0.934  0.134   0.037  
 25   25  19  0.934  0.134   0.037  
 26   26   8  0.949  0.098  -0.320  
 27   27   9  0.925  0.169   0.333  
 28   28   9  0.947  0.078  -0.784  
 29   29   6  0.954  0.080  -0.522  
 30   30   9  0.921  0.111  -0.428  
 31   31   8  0.972  0.068  -0.989  
 32   32   6  0.954  0.082  -0.486  
 33   33   5  0.977  0.056  -0.937  
 34   34   9  0.973  0.082  -0.933  
 35   35   8  0.894  0.110   0.026  
 36   36  11  0.926  0.132   0.006  
 37   37   9  0.919  0.189   0.674  
 38   38  14  0.956  0.080  -0.494  
 39   39  11  0.927  0.087  -0.420  
 40   40   6  0.937  0.097  -0.217  
 41   41   9  0.926  0.121  -0.287  
 42   42   7  0.957  0.086  -0.382  
 43   43  11  0.934  0.103  -0.049  
 44   44   9  0.950  0.067  -0.955  
 45   45   9  0.945  0.102  -0.642  
 46   46   7  0.918  0.122   0.307  
 47   47   9  0.927  0.099  -0.686  
 48   48   9  0.937  0.124  -0.244  
 49   49   9  0.916  0.134  -0.176  
 50   50   8  0.587  0.311   4.447  
 51   51   9  0.832  0.228   1.192  
 52   52   8  0.298  0.285   3.950  
 53   53   8  0.858  0.150   0.496  
 54   54   7  0.900  0.127   0.418  
 55   55   6  0.884  0.142   0.590  
 56   56   6  0.908  0.152   0.769  
 57   57   5  0.941  0.083  -0.387  
 58   58   8  0.942  0.101  -0.251  
 59   59   8  0.951  0.099  -0.317  
 60   60   9  0.969  0.081  -0.948  
 61   61   8  0.974  0.078  -0.765  
 62   62   9  0.965  0.077  -1.006  
 63   63   9  0.946  0.098  -0.612  
 64   64  11  0.968  0.069  -0.838  
 65   65   4  0.964  0.075  -0.484  
 66   66   8  0.931  0.134   0.320  
 67   67   7  0.950  0.070  -0.695  
 68   68   8  0.926  0.096  -0.362  
 69   69   9  0.929  0.142   0.010  
 70   70   8  0.946  0.078  -0.652  
 71   71   9  0.968  0.095  -0.744  
 72   72   5  0.985  0.046  -1.141  
 73   73  11  0.920  0.147   0.238  
 74   74   9  0.922  0.110  -0.442  
 75   75   8  0.946  0.096  -0.362  
 76   76   8  0.961  0.091  -0.479  
 77   77   6  0.896  0.144   0.625  
 78   78  11  0.898  0.156   0.378  
 79   79   8  0.957  0.088  -0.548  
 80   80   9  0.916  0.119  -0.394  
 81   81   9  0.927  0.126  -0.039  
 82   82   6  0.910  0.127   0.321  
 83   83   9  0.924  0.125  -0.230  
 84   84   8  0.925  0.117   0.107  
 85   85   6  0.951  0.085  -0.432  
 86   86   5  0.949  0.083  -0.387  
 87   87   9  0.929  0.120  -0.380  
 88   88   8  0.967  0.062  -0.925  
 89   89  11  0.926  0.096  -0.551  
 90   90   9  0.944  0.163   0.306  
 91   91  14  0.940  0.099  -0.018  
 92   92  11  0.951  0.086  -0.443  
 93   93   6  0.940  0.087  -0.396  
 94   94   9  0.882  0.146   0.066  
 95   95   7  0.939  0.085  -0.401  
 96   96  11  0.960  0.078  -0.629  
 97   97   9  0.926  0.201   1.126  
 98   98   9  0.914  0.130  -0.234  
 99   99   7  0.929  0.116   0.173  
100  100   9  0.916  0.116  -0.438  
101  101   9  0.830  0.160   0.264  
102  102   9  0.929  0.117  -0.424  
103  103   8  0.824  0.131   0.421  
104  104   9  0.453  0.314   2.444  
105  105   8  0.835  0.188   1.735  
106  106   1  0.800  0.493       ?  
107  107   1  0.904  0.114       ?  
108  108   1  0.869  0.135       ?  
109  109   1  0.619  0.159       ?  
110  110   1  0.799  0.346       ?  
111  111   1  0.910  0.270       ?  
112  112   1  0.018  0.919       ?  
113  113   1  0.889  0.301       ?  
114  114   1  0.758  0.175       ?  
115  115   1  0.798  0.554       ?  
116  116   1  0.947  0.395       ?  
117  117   1  0.743  0.206       ?  
118  118   1  0.618  0.441       ?  
119  119   1  0.816  0.679       ?  
120  120   1  0.725  0.125       ?  
121  121   1  0.461  0.511       ?  
122  122   1  0.888  0.139       ?  
123  123   1  0.861  0.354       ?  
124  124   1  0.890  0.124       ?  
125  125   1  0.943  0.515       ?  
126  126   1  0.812  0.200       ?  
127  127   1  0.561  0.257       ?  
128  128   1  0.652  0.479       ?  
129  129   1  0.836  0.265       ?  
130  130   1  0.814  0.379       ?  
131  131   1  0.599  0.635       ?  
132  132   1  0.925  0.092       ?  
#
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          2.35.1                                                                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  
##
