NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage program type subtype subsubtype item_count
639082 6r9z 27863 cing 2-parsed STAR distance NOE simple 41


data_6r9z_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_6r9z 
    _Study_list.ID           1 

    loop_
        _Study.ID 
        _Study.Name 
        _Study.Type 
        _Study.Details 
        _Study.Entry_ID 
        _Study.Study_list_ID 

        1   "Conversion project"    NMR   .   parsed_6r9z   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_6r9z 
    _Entry.Title                       "Original constraint list(s)" 
    _Entry.Version_type                 original 
    _Entry.Submission_date              . 
    _Entry.Accession_date               . 
    _Entry.Last_release_date            . 
    _Entry.Original_release_date        . 
    _Entry.Origination                  . 
    _Entry.NMR_STAR_version             3.1 
    _Entry.Original_NMR_STAR_version    . 
    _Entry.Experimental_method          NMR 
    _Entry.Experimental_method_subtype  . 

    loop_
        _Related_entries.Database_name 
        _Related_entries.Database_accession_code 
        _Related_entries.Relationship 
        _Related_entries.Entry_ID 

        PDB   6r9z   "Master copy"    parsed_6r9z   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_6r9z 
    _Constraint_stat_list.ID           1 

    loop_
        _Constraint_file.ID 
        _Constraint_file.Constraint_filename 
        _Constraint_file.Software_ID 
        _Constraint_file.Software_label 
        _Constraint_file.Software_name 
        _Constraint_file.Block_ID 
        _Constraint_file.Constraint_type 
        _Constraint_file.Constraint_subtype 
        _Constraint_file.Constraint_subsubtype 
        _Constraint_file.Constraint_number 
        _Constraint_file.Entry_ID 
        _Constraint_file.Constraint_stat_list_ID 

        1   6r9z.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"     0   parsed_6r9z   1   
        1   6r9z.mr   .   .    DYANA/DIANA   2    distance                  NOE                 simple             41   parsed_6r9z   1   
        1   6r9z.mr   .   .   "MR format"    3   "nomenclature mapping"    "Not applicable"    "Not applicable"     0   parsed_6r9z   1   
    stop_

save_


save_DYANA/DIANA_distance_constraints_2
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_6r9z 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type     NOE 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            2 
    _Distance_constraint_list.Details            "Generated by Wattos" 

    loop_
        _Dist_constraint_tree.Constraint_ID 
        _Dist_constraint_tree.Node_ID 
        _Dist_constraint_tree.Down_node_ID 
        _Dist_constraint_tree.Right_node_ID 
        _Dist_constraint_tree.Logic_operation 
        _Dist_constraint_tree.Entry_ID 
        _Dist_constraint_tree.Distance_constraint_list_ID 

         1   1   .   .   .   parsed_6r9z   1   
         2   1   .   .   .   parsed_6r9z   1   
         3   1   .   .   .   parsed_6r9z   1   
         4   1   .   .   .   parsed_6r9z   1   
         5   1   .   .   .   parsed_6r9z   1   
         6   1   .   .   .   parsed_6r9z   1   
         7   1   .   .   .   parsed_6r9z   1   
         8   1   .   .   .   parsed_6r9z   1   
         9   1   .   .   .   parsed_6r9z   1   
        10   1   .   .   .   parsed_6r9z   1   
        11   1   .   .   .   parsed_6r9z   1   
        12   1   .   .   .   parsed_6r9z   1   
        13   1   .   .   .   parsed_6r9z   1   
        14   1   .   .   .   parsed_6r9z   1   
        15   1   .   .   .   parsed_6r9z   1   
        16   1   .   .   .   parsed_6r9z   1   
        17   1   .   .   .   parsed_6r9z   1   
        18   1   .   .   .   parsed_6r9z   1   
        19   1   .   .   .   parsed_6r9z   1   
        20   1   .   .   .   parsed_6r9z   1   
        21   1   .   .   .   parsed_6r9z   1   
        22   1   .   .   .   parsed_6r9z   1   
        23   1   .   .   .   parsed_6r9z   1   
        24   1   .   .   .   parsed_6r9z   1   
        25   1   .   .   .   parsed_6r9z   1   
        26   1   .   .   .   parsed_6r9z   1   
        27   1   .   .   .   parsed_6r9z   1   
        28   1   .   .   .   parsed_6r9z   1   
        29   1   .   .   .   parsed_6r9z   1   
        30   1   .   .   .   parsed_6r9z   1   
        31   1   .   .   .   parsed_6r9z   1   
        32   1   .   .   .   parsed_6r9z   1   
        33   1   .   .   .   parsed_6r9z   1   
        34   1   .   .   .   parsed_6r9z   1   
        35   1   .   .   .   parsed_6r9z   1   
        36   1   .   .   .   parsed_6r9z   1   
        37   1   .   .   .   parsed_6r9z   1   
        38   1   .   .   .   parsed_6r9z   1   
        39   1   .   .   .   parsed_6r9z   1   
        40   1   .   .   .   parsed_6r9z   1   
        41   1   .   .   .   parsed_6r9z   1   
    stop_


    loop_
        _Dist_constraint.Tree_node_member_constraint_ID 
        _Dist_constraint.Tree_node_member_node_ID 
        _Dist_constraint.Constraint_tree_node_member_ID 
        _Dist_constraint.Assembly_atom_ID 
        _Dist_constraint.Entity_assembly_ID 
        _Dist_constraint.Entity_ID 
        _Dist_constraint.Comp_index_ID 
        _Dist_constraint.Seq_ID 
        _Dist_constraint.Comp_ID 
        _Dist_constraint.Atom_ID 
        _Dist_constraint.Resonance_ID 
        _Dist_constraint.Auth_asym_ID 
        _Dist_constraint.Auth_seq_ID 
        _Dist_constraint.Auth_comp_ID 
        _Dist_constraint.Auth_atom_ID 
        _Dist_constraint.Entry_ID 
        _Dist_constraint.Distance_constraint_list_ID 

         1   1   1   .   .   .   .   .   .   .   .   .   4   ASN   HB3   parsed_6r9z   1   
         1   1   2   .   .   .   .   .   .   .   .   .   5   PRO   HD2   parsed_6r9z   1   
         2   1   1   .   .   .   .   .   .   .   .   .   4   ASN   HB3   parsed_6r9z   1   
         2   1   2   .   .   .   .   .   .   .   .   .   5   PRO   HD3   parsed_6r9z   1   
         3   1   1   .   .   .   .   .   .   .   .   .   3   VAL   HB    parsed_6r9z   1   
         3   1   2   .   .   .   .   .   .   .   .   .   4   ASN   H     parsed_6r9z   1   
         4   1   1   .   .   .   .   .   .   .   .   .   3   VAL   HA    parsed_6r9z   1   
         4   1   2   .   .   .   .   .   .   .   .   .   4   ASN   H     parsed_6r9z   1   
         5   1   1   .   .   .   .   .   .   .   .   .   3   VAL   QQG   parsed_6r9z   1   
         5   1   2   .   .   .   .   .   .   .   .   .   4   ASN   H     parsed_6r9z   1   
         6   1   1   .   .   .   .   .   .   .   .   .   7   VAL   HA    parsed_6r9z   1   
         6   1   2   .   .   .   .   .   .   .   .   .   8   PRO   HD3   parsed_6r9z   1   
         7   1   1   .   .   .   .   .   .   .   .   .   2   GLU   H     parsed_6r9z   1   
         7   1   2   .   .   .   .   .   .   .   .   .   2   GLU   QG    parsed_6r9z   1   
         8   1   1   .   .   .   .   .   .   .   .   .   7   VAL   QQG   parsed_6r9z   1   
         8   1   2   .   .   .   .   .   .   .   .   .   9   NHE   HA1   parsed_6r9z   1   
         9   1   1   .   .   .   .   .   .   .   .   .   8   PRO   HA    parsed_6r9z   1   
         9   1   2   .   .   .   .   .   .   .   .   .   9   NHE   HA1   parsed_6r9z   1   
        10   1   1   .   .   .   .   .   .   .   .   .   7   VAL   HA    parsed_6r9z   1   
        10   1   2   .   .   .   .   .   .   .   .   .   8   PRO   HD2   parsed_6r9z   1   
        11   1   1   .   .   .   .   .   .   .   .   .   7   VAL   QQG   parsed_6r9z   1   
        11   1   2   .   .   .   .   .   .   .   .   .   8   PRO   HD2   parsed_6r9z   1   
        12   1   1   .   .   .   .   .   .   .   .   .   4   ASN   HB2   parsed_6r9z   1   
        12   1   2   .   .   .   .   .   .   .   .   .   5   PRO   HD2   parsed_6r9z   1   
        13   1   1   .   .   .   .   .   .   .   .   .   4   ASN   HB2   parsed_6r9z   1   
        13   1   2   .   .   .   .   .   .   .   .   .   5   PRO   HD3   parsed_6r9z   1   
        14   1   1   .   .   .   .   .   .   .   .   .   3   VAL   HA    parsed_6r9z   1   
        14   1   2   .   .   .   .   .   .   .   .   .   4   ASN   HA    parsed_6r9z   1   
        15   1   1   .   .   .   .   .   .   .   .   .   6   PRO   HA    parsed_6r9z   1   
        15   1   2   .   .   .   .   .   .   .   .   .   7   VAL   H     parsed_6r9z   1   
        16   1   1   .   .   .   .   .   .   .   .   .   7   VAL   H     parsed_6r9z   1   
        16   1   2   .   .   .   .   .   .   .   .   .   7   VAL   HB    parsed_6r9z   1   
        17   1   1   .   .   .   .   .   .   .   .   .   7   VAL   H     parsed_6r9z   1   
        17   1   2   .   .   .   .   .   .   .   .   .   7   VAL   QQG   parsed_6r9z   1   
        18   1   1   .   .   .   .   .   .   .   .   .   4   ASN   HA    parsed_6r9z   1   
        18   1   2   .   .   .   .   .   .   .   .   .   5   PRO   HD2   parsed_6r9z   1   
        19   1   1   .   .   .   .   .   .   .   .   .   2   GLU   HA    parsed_6r9z   1   
        19   1   2   .   .   .   .   .   .   .   .   .   3   VAL   H     parsed_6r9z   1   
        20   1   1   .   .   .   .   .   .   .   .   .   2   GLU   HA    parsed_6r9z   1   
        20   1   2   .   .   .   .   .   .   .   .   .   2   GLU   QG    parsed_6r9z   1   
        21   1   1   .   .   .   .   .   .   .   .   .   7   VAL   HA    parsed_6r9z   1   
        21   1   2   .   .   .   .   .   .   .   .   .   7   VAL   QQG   parsed_6r9z   1   
        22   1   1   .   .   .   .   .   .   .   .   .   3   VAL   H     parsed_6r9z   1   
        22   1   2   .   .   .   .   .   .   .   .   .   3   VAL   HB    parsed_6r9z   1   
        23   1   1   .   .   .   .   .   .   .   .   .   3   VAL   H     parsed_6r9z   1   
        23   1   2   .   .   .   .   .   .   .   .   .   3   VAL   QQG   parsed_6r9z   1   
        24   1   1   .   .   .   .   .   .   .   .   .   7   VAL   QQG   parsed_6r9z   1   
        24   1   2   .   .   .   .   .   .   .   .   .   8   PRO   HD3   parsed_6r9z   1   
        25   1   1   .   .   .   .   .   .   .   .   .   4   ASN   HA    parsed_6r9z   1   
        25   1   2   .   .   .   .   .   .   .   .   .   5   PRO   HD3   parsed_6r9z   1   
        26   1   1   .   .   .   .   .   .   .   .   .   3   VAL   HA    parsed_6r9z   1   
        26   1   2   .   .   .   .   .   .   .   .   .   3   VAL   QQG   parsed_6r9z   1   
        27   1   1   .   .   .   .   .   .   .   .   .   2   GLU   HA    parsed_6r9z   1   
        27   1   2   .   .   .   .   .   .   .   .   .   3   VAL   QQG   parsed_6r9z   1   
        28   1   1   .   .   .   .   .   .   .   .   .   3   VAL   QQG   parsed_6r9z   1   
        28   1   2   .   .   .   .   .   .   .   .   .   4   ASN   HA    parsed_6r9z   1   
        29   1   1   .   .   .   .   .   .   .   .   .   2   GLU   H     parsed_6r9z   1   
        29   1   2   .   .   .   .   .   .   .   .   .   2   GLU   QB    parsed_6r9z   1   
        30   1   1   .   .   .   .   .   .   .   .   .   3   VAL   QQG   parsed_6r9z   1   
        30   1   2   .   .   .   .   .   .   .   .   .   5   PRO   QD    parsed_6r9z   1   
        31   1   1   .   .   .   .   .   .   .   .   .   4   ASN   H     parsed_6r9z   1   
        31   1   2   .   .   .   .   .   .   .   .   .   4   ASN   QB    parsed_6r9z   1   
        32   1   1   .   .   .   .   .   .   .   .   .   4   ASN   HA    parsed_6r9z   1   
        32   1   2   .   .   .   .   .   .   .   .   .   4   ASN   QD2   parsed_6r9z   1   
        33   1   1   .   .   .   .   .   .   .   .   .   4   ASN   QB    parsed_6r9z   1   
        33   1   2   .   .   .   .   .   .   .   .   .   4   ASN   QD2   parsed_6r9z   1   
        34   1   1   .   .   .   .   .   .   .   .   .   4   ASN   QB    parsed_6r9z   1   
        34   1   2   .   .   .   .   .   .   .   .   .   5   PRO   QD    parsed_6r9z   1   
        35   1   1   .   .   .   .   .   .   .   .   .   5   PRO   HA    parsed_6r9z   1   
        35   1   2   .   .   .   .   .   .   .   .   .   6   PRO   QD    parsed_6r9z   1   
        36   1   1   .   .   .   .   .   .   .   .   .   5   PRO   QB    parsed_6r9z   1   
        36   1   2   .   .   .   .   .   .   .   .   .   6   PRO   QD    parsed_6r9z   1   
        37   1   1   .   .   .   .   .   .   .   .   .   5   PRO   QD    parsed_6r9z   1   
        37   1   2   .   .   .   .   .   .   .   .   .   7   VAL   QQG   parsed_6r9z   1   
        38   1   1   .   .   .   .   .   .   .   .   .   6   PRO   QB    parsed_6r9z   1   
        38   1   2   .   .   .   .   .   .   .   .   .   7   VAL   H     parsed_6r9z   1   
        39   1   1   .   .   .   .   .   .   .   .   .   6   PRO   QD    parsed_6r9z   1   
        39   1   2   .   .   .   .   .   .   .   .   .   7   VAL   H     parsed_6r9z   1   
        40   1   1   .   .   .   .   .   .   .   .   .   7   VAL   HA    parsed_6r9z   1   
        40   1   2   .   .   .   .   .   .   .   .   .   8   PRO   QD    parsed_6r9z   1   
        41   1   1   .   .   .   .   .   .   .   .   .   7   VAL   QQG   parsed_6r9z   1   
        41   1   2   .   .   .   .   .   .   .   .   .   8   PRO   QD    parsed_6r9z   1   
    stop_


    loop_
        _Dist_constraint_value.Constraint_ID 
        _Dist_constraint_value.Tree_node_ID 
        _Dist_constraint_value.Source_experiment_ID 
        _Dist_constraint_value.Spectral_peak_ID 
        _Dist_constraint_value.Intensity_val 
        _Dist_constraint_value.Intensity_lower_val_err 
        _Dist_constraint_value.Intensity_upper_val_err 
        _Dist_constraint_value.Distance_val 
        _Dist_constraint_value.Distance_lower_bound_val 
        _Dist_constraint_value.Distance_upper_bound_val 
        _Dist_constraint_value.Entry_ID 
        _Dist_constraint_value.Distance_constraint_list_ID 

         1   1   .   .   .   .   .   .   .   4.50   parsed_6r9z   1   
         2   1   .   .   .   .   .   .   .   4.50   parsed_6r9z   1   
         3   1   .   .   .   .   .   .   .   4.57   parsed_6r9z   1   
         4   1   .   .   .   .   .   .   .   3.13   parsed_6r9z   1   
         5   1   .   .   .   .   .   .   .   4.70   parsed_6r9z   1   
         6   1   .   .   .   .   .   .   .   2.96   parsed_6r9z   1   
         7   1   .   .   .   .   .   .   .   3.73   parsed_6r9z   1   
         8   1   .   .   .   .   .   .   .   4.79   parsed_6r9z   1   
         9   1   .   .   .   .   .   .   .   2.93   parsed_6r9z   1   
        10   1   .   .   .   .   .   .   .   2.96   parsed_6r9z   1   
        11   1   .   .   .   .   .   .   .   4.71   parsed_6r9z   1   
        12   1   .   .   .   .   .   .   .   4.50   parsed_6r9z   1   
        13   1   .   .   .   .   .   .   .   4.50   parsed_6r9z   1   
        14   1   .   .   .   .   .   .   .   4.72   parsed_6r9z   1   
        15   1   .   .   .   .   .   .   .   2.53   parsed_6r9z   1   
        16   1   .   .   .   .   .   .   .   3.23   parsed_6r9z   1   
        17   1   .   .   .   .   .   .   .   3.90   parsed_6r9z   1   
        18   1   .   .   .   .   .   .   .   2.86   parsed_6r9z   1   
        19   1   .   .   .   .   .   .   .   3.15   parsed_6r9z   1   
        20   1   .   .   .   .   .   .   .   3.52   parsed_6r9z   1   
        21   1   .   .   .   .   .   .   .   2.98   parsed_6r9z   1   
        22   1   .   .   .   .   .   .   .   3.67   parsed_6r9z   1   
        23   1   .   .   .   .   .   .   .   3.27   parsed_6r9z   1   
        24   1   .   .   .   .   .   .   .   4.71   parsed_6r9z   1   
        25   1   .   .   .   .   .   .   .   2.86   parsed_6r9z   1   
        26   1   .   .   .   .   .   .   .   2.67   parsed_6r9z   1   
        27   1   .   .   .   .   .   .   .   3.92   parsed_6r9z   1   
        28   1   .   .   .   .   .   .   .   4.55   parsed_6r9z   1   
        29   1   .   .   .   .   .   .   .   3.18   parsed_6r9z   1   
        30   1   .   .   .   .   .   .   .   4.60   parsed_6r9z   1   
        31   1   .   .   .   .   .   .   .   3.69   parsed_6r9z   1   
        32   1   .   .   .   .   .   .   .   4.44   parsed_6r9z   1   
        33   1   .   .   .   .   .   .   .   3.15   parsed_6r9z   1   
        34   1   .   .   .   .   .   .   .   3.17   parsed_6r9z   1   
        35   1   .   .   .   .   .   .   .   2.68   parsed_6r9z   1   
        36   1   .   .   .   .   .   .   .   3.64   parsed_6r9z   1   
        37   1   .   .   .   .   .   .   .   4.21   parsed_6r9z   1   
        38   1   .   .   .   .   .   .   .   3.98   parsed_6r9z   1   
        39   1   .   .   .   .   .   .   .   4.86   parsed_6r9z   1   
        40   1   .   .   .   .   .   .   .   2.49   parsed_6r9z   1   
        41   1   .   .   .   .   .   .   .   4.04   parsed_6r9z   1   
    stop_


    loop_
        _Dist_constraint_comment_org.ID 
        _Dist_constraint_comment_org.Comment_text 
        _Dist_constraint_comment_org.Comment_begin_line 
        _Dist_constraint_comment_org.Comment_begin_column 
        _Dist_constraint_comment_org.Comment_end_line 
        _Dist_constraint_comment_org.Comment_end_column 
        _Dist_constraint_comment_org.Entry_ID 
        _Dist_constraint_comment_org.Distance_constraint_list_ID 

         1   "Restraints file 1: PP_final.upl"      1    1    1   33   parsed_6r9z   1   
         2   "peak     4 #SUP  0.70  #QF  0.70"     2   49    2   81   parsed_6r9z   1   
         3   "peak     5 #SUP  1.00"                3   49    3   70   parsed_6r9z   1   
         4   "peak    16 #SUP  0.98  #QF  0.98"     4   49    4   81   parsed_6r9z   1   
         5   "peak    18 #SUP  0.81  #QF  0.81"     5   49    5   81   parsed_6r9z   1   
         6   "peak    22 #SUP  1.00"                6   49    6   70   parsed_6r9z   1   
         7   "peak    40 #SUP  1.00"                7   49    7   70   parsed_6r9z   1   
         8   "peak    54 #SUP  0.94  #QF  0.94"     8   49    8   81   parsed_6r9z   1   
         9   "peak    62 #SUP  0.92  #QF  0.92"     9   49    9   81   parsed_6r9z   1   
        10   "peak    64 #SUP  0.67  #QF  0.67"    10   49   10   81   parsed_6r9z   1   
        11   "peak    65 #SUP  1.00"               11   49   11   70   parsed_6r9z   1   
        12   "peak    70 #SUP  1.00"               12   49   12   70   parsed_6r9z   1   
        13   "peak    96 #SUP  1.00"               13   49   13   70   parsed_6r9z   1   
        14   "peak    97 #SUP  0.99  #QF  0.99"    14   49   14   81   parsed_6r9z   1   
        15   "peak   103 #SUP  0.99  #QF  0.99"    15   49   15   81   parsed_6r9z   1   
        16   "peak   148 #SUP  0.61  #QF  0.61"    16   49   16   81   parsed_6r9z   1   
        17   "peak   150 #SUP  0.78  #QF  0.78"    17   49   17   81   parsed_6r9z   1   
        18   "peak   154 #SUP  1.00"               18   49   18   70   parsed_6r9z   1   
        19   "peak   176 #SUP  0.93  #QF  0.93"    19   49   19   81   parsed_6r9z   1   
        20   "peak   189 #SUP  0.95  #QF  0.95"    20   49   20   81   parsed_6r9z   1   
        21   "peak   190 #SUP  1.00"               21   49   21   70   parsed_6r9z   1   
        22   "peak   201 #SUP  1.00"               22   49   22   70   parsed_6r9z   1   
        23   "peak   223 #SUP  0.87  #QF  0.87"    23   49   23   81   parsed_6r9z   1   
        24   "peak   226 #SUP  1.00"               24   49   24   70   parsed_6r9z   1   
        25   "peak   243 #SUP  0.99  #QF  0.33"    25   49   25   81   parsed_6r9z   1   
        26   "peak   246 #SUP  0.95  #QF  0.95"    26   49   26   81   parsed_6r9z   1   
        27   "peak   269 #SUP  1.00"               27   49   27   70   parsed_6r9z   1   
        28   "peak   272 #SUP  0.99  #QF  0.99"    28   49   28   81   parsed_6r9z   1   
        29   "peak   274 #SUP  1.00"               29   49   29   70   parsed_6r9z   1   
        30   "peak    51"                          30   49   30   59   parsed_6r9z   1   
        31   "peak   177"                          31   49   31   59   parsed_6r9z   1   
        32   "peak    20"                          32   49   32   59   parsed_6r9z   1   
        33   "peak   122"                          33   49   33   59   parsed_6r9z   1   
        34   "peak   121"                          34   49   34   59   parsed_6r9z   1   
        35   "peak    97"                          35   49   35   59   parsed_6r9z   1   
        36   "peak   170"                          36   49   36   59   parsed_6r9z   1   
        37   "peak   174"                          37   49   37   59   parsed_6r9z   1   
        38   "peak   243"                          38   49   38   59   parsed_6r9z   1   
        39   "peak   151"                          39   49   39   59   parsed_6r9z   1   
        40   "peak   153"                          40   49   40   59   parsed_6r9z   1   
        41   "peak    65"                          41   49   41   59   parsed_6r9z   1   
        42   "peak    70"                          42   49   42   59   parsed_6r9z   1   
    stop_

save_





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