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
580716 2mqv 25052 cing 2-parsed STAR distance NOE simple 42


data_2mqv_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2mqv 
    _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_2mqv   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2mqv 
    _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   2mqv   "Master copy"    parsed_2mqv   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2mqv 
    _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   2mqv.mr   .   .   "MR format"     1    comment                  "Not applicable"      "Not applicable"      0   parsed_2mqv   1   
        1   2mqv.mr   .   .    DYANA/DIANA    2   "dihedral angle"          "Not applicable"      "Not applicable"    290   parsed_2mqv   1   
        1   2mqv.mr   .   .    DYANA/DIANA    3    distance                 "general distance"     simple              12   parsed_2mqv   1   
        1   2mqv.mr   .   .    DYANA/DIANA    4    distance                 "hydrogen bond"        simple              27   parsed_2mqv   1   
        1   2mqv.mr   .   .    DYANA/DIANA    5    distance                  NOE                   simple             145   parsed_2mqv   1   
        1   2mqv.mr   .   .    DYANA/DIANA    6    distance                 "general distance"     simple              22   parsed_2mqv   1   
        1   2mqv.mr   .   .    DYANA/DIANA    7    distance                  NOE                   simple              42   parsed_2mqv   1   
        1   2mqv.mr   .   .    DYANA/DIANA    8    distance                 "general distance"     simple               0   parsed_2mqv   1   
        1   2mqv.mr   .   .    DYANA/DIANA    9    distance                 "hydrogen bond"        simple               0   parsed_2mqv   1   
        1   2mqv.mr   .   .    DYANA/DIANA   10    distance                  NOE                   simple               0   parsed_2mqv   1   
        1   2mqv.mr   .   .    DYANA/DIANA   11    distance                  NOE                   simple               0   parsed_2mqv   1   
        1   2mqv.mr   .   .    DYANA/DIANA   12    distance                 "general distance"     simple               0   parsed_2mqv   1   
        1   2mqv.mr   .   .   "MR format"    13   "nomenclature mapping"    "Not applicable"      "Not applicable"      0   parsed_2mqv   1   
    stop_

save_


save_DYANA/DIANA_distance_constraints_7
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_2mqv 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type     NOE 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            7 
    _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_2mqv   1   
         2   1   .   .   .   parsed_2mqv   1   
         3   1   .   .   .   parsed_2mqv   1   
         4   1   .   .   .   parsed_2mqv   1   
         5   1   .   .   .   parsed_2mqv   1   
         6   1   .   .   .   parsed_2mqv   1   
         7   1   .   .   .   parsed_2mqv   1   
         8   1   .   .   .   parsed_2mqv   1   
         9   1   .   .   .   parsed_2mqv   1   
        10   1   .   .   .   parsed_2mqv   1   
        11   1   .   .   .   parsed_2mqv   1   
        12   1   .   .   .   parsed_2mqv   1   
        13   1   .   .   .   parsed_2mqv   1   
        14   1   .   .   .   parsed_2mqv   1   
        15   1   .   .   .   parsed_2mqv   1   
        16   1   .   .   .   parsed_2mqv   1   
        17   1   .   .   .   parsed_2mqv   1   
        18   1   .   .   .   parsed_2mqv   1   
        19   1   .   .   .   parsed_2mqv   1   
        20   1   .   .   .   parsed_2mqv   1   
        21   1   .   .   .   parsed_2mqv   1   
        22   1   .   .   .   parsed_2mqv   1   
        23   1   .   .   .   parsed_2mqv   1   
        24   1   .   .   .   parsed_2mqv   1   
        25   1   .   .   .   parsed_2mqv   1   
        26   1   .   .   .   parsed_2mqv   1   
        27   1   .   .   .   parsed_2mqv   1   
        28   1   .   .   .   parsed_2mqv   1   
        29   1   .   .   .   parsed_2mqv   1   
        30   1   .   .   .   parsed_2mqv   1   
        31   1   .   .   .   parsed_2mqv   1   
        32   1   .   .   .   parsed_2mqv   1   
        33   1   .   .   .   parsed_2mqv   1   
        34   1   .   .   .   parsed_2mqv   1   
        35   1   .   .   .   parsed_2mqv   1   
        36   1   .   .   .   parsed_2mqv   1   
        37   1   .   .   .   parsed_2mqv   1   
        38   1   .   .   .   parsed_2mqv   1   
        39   1   .   .   .   parsed_2mqv   1   
        40   1   .   .   .   parsed_2mqv   1   
        41   1   .   .   .   parsed_2mqv   1   
        42   1   .   .   .   parsed_2mqv   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   .   .   .   .   .   .   .   .   .   107   URA    H1'   parsed_2mqv   1   
         1   1   2   .   .   .   .   .   .   .   .   .    30   LYS    QE    parsed_2mqv   1   
         2   1   1   .   .   .   .   .   .   .   .   .   107   URA    H2'   parsed_2mqv   1   
         2   1   2   .   .   .   .   .   .   .   .   .    28   TYR    HA    parsed_2mqv   1   
         3   1   1   .   .   .   .   .   .   .   .   .   107   URA    H2'   parsed_2mqv   1   
         3   1   2   .   .   .   .   .   .   .   .   .    28   TYR    QD    parsed_2mqv   1   
         4   1   1   .   .   .   .   .   .   .   .   .   107   URA    H2'   parsed_2mqv   1   
         4   1   2   .   .   .   .   .   .   .   .   .    28   TYR    QE    parsed_2mqv   1   
         5   1   1   .   .   .   .   .   .   .   .   .   107   URA    H6    parsed_2mqv   1   
         5   1   2   .   .   .   .   .   .   .   .   .    28   TYR    QE    parsed_2mqv   1   
         6   1   1   .   .   .   .   .   .   .   .   .   107   URA    H5    parsed_2mqv   1   
         6   1   2   .   .   .   .   .   .   .   .   .    28   TYR    QE    parsed_2mqv   1   
         7   1   1   .   .   .   .   .   .   .   .   .   107   URA    H5    parsed_2mqv   1   
         7   1   2   .   .   .   .   .   .   .   .   .    29   CYS-   HA    parsed_2mqv   1   
         8   1   1   .   .   .   .   .   .   .   .   .   107   URA    H5    parsed_2mqv   1   
         8   1   2   .   .   .   .   .   .   .   .   .    29   CYS-   QB    parsed_2mqv   1   
         9   1   1   .   .   .   .   .   .   .   .   .   107   URA    H5    parsed_2mqv   1   
         9   1   2   .   .   .   .   .   .   .   .   .    41   LYS    QE    parsed_2mqv   1   
        10   1   1   .   .   .   .   .   .   .   .   .   107   URA    H5    parsed_2mqv   1   
        10   1   2   .   .   .   .   .   .   .   .   .    41   LYS    QD    parsed_2mqv   1   
        11   1   1   .   .   .   .   .   .   .   .   .   108   RCYT   H1'   parsed_2mqv   1   
        11   1   2   .   .   .   .   .   .   .   .   .    27   ALA    QB    parsed_2mqv   1   
        12   1   1   .   .   .   .   .   .   .   .   .   108   RCYT   H4'   parsed_2mqv   1   
        12   1   2   .   .   .   .   .   .   .   .   .    27   ALA    QB    parsed_2mqv   1   
        13   1   1   .   .   .   .   .   .   .   .   .   108   RCYT   H1'   parsed_2mqv   1   
        13   1   2   .   .   .   .   .   .   .   .   .    36   ALA    QB    parsed_2mqv   1   
        14   1   1   .   .   .   .   .   .   .   .   .   108   RCYT   H1'   parsed_2mqv   1   
        14   1   2   .   .   .   .   .   .   .   .   .    28   TYR    QB    parsed_2mqv   1   
        15   1   1   .   .   .   .   .   .   .   .   .   108   RCYT   H1'   parsed_2mqv   1   
        15   1   2   .   .   .   .   .   .   .   .   .    28   TYR    HA    parsed_2mqv   1   
        16   1   1   .   .   .   .   .   .   .   .   .   108   RCYT   H1'   parsed_2mqv   1   
        16   1   2   .   .   .   .   .   .   .   .   .    28   TYR    QD    parsed_2mqv   1   
        17   1   1   .   .   .   .   .   .   .   .   .   108   RCYT   H6    parsed_2mqv   1   
        17   1   2   .   .   .   .   .   .   .   .   .    28   TYR    HD1   parsed_2mqv   1   
        18   1   1   .   .   .   .   .   .   .   .   .   108   RCYT   H5    parsed_2mqv   1   
        18   1   2   .   .   .   .   .   .   .   .   .    28   TYR    HE1   parsed_2mqv   1   
        19   1   1   .   .   .   .   .   .   .   .   .   108   RCYT   H1'   parsed_2mqv   1   
        19   1   2   .   .   .   .   .   .   .   .   .    42   LYS    QE    parsed_2mqv   1   
        20   1   1   .   .   .   .   .   .   .   .   .   109   URA    H6    parsed_2mqv   1   
        20   1   2   .   .   .   .   .   .   .   .   .    27   ALA    QB    parsed_2mqv   1   
        21   1   1   .   .   .   .   .   .   .   .   .   109   URA    H5    parsed_2mqv   1   
        21   1   2   .   .   .   .   .   .   .   .   .    27   ALA    QB    parsed_2mqv   1   
        22   1   1   .   .   .   .   .   .   .   .   .   109   URA    H6    parsed_2mqv   1   
        22   1   2   .   .   .   .   .   .   .   .   .    21   LEU    QD1   parsed_2mqv   1   
        23   1   1   .   .   .   .   .   .   .   .   .   109   URA    H5    parsed_2mqv   1   
        23   1   2   .   .   .   .   .   .   .   .   .    21   LEU    QD1   parsed_2mqv   1   
        24   1   1   .   .   .   .   .   .   .   .   .   109   URA    H5    parsed_2mqv   1   
        24   1   2   .   .   .   .   .   .   .   .   .    30   LYS    QE    parsed_2mqv   1   
        25   1   1   .   .   .   .   .   .   .   .   .   109   URA    H5    parsed_2mqv   1   
        25   1   2   .   .   .   .   .   .   .   .   .    18   ARG    HA    parsed_2mqv   1   
        26   1   1   .   .   .   .   .   .   .   .   .   109   URA    H5    parsed_2mqv   1   
        26   1   2   .   .   .   .   .   .   .   .   .    18   ARG    QB    parsed_2mqv   1   
        27   1   1   .   .   .   .   .   .   .   .   .   109   URA    H5    parsed_2mqv   1   
        27   1   2   .   .   .   .   .   .   .   .   .    18   ARG    QG    parsed_2mqv   1   
        28   1   1   .   .   .   .   .   .   .   .   .   110   RGUA   H8    parsed_2mqv   1   
        28   1   2   .   .   .   .   .   .   .   .   .    35   TRP    HZ3   parsed_2mqv   1   
        29   1   1   .   .   .   .   .   .   .   .   .   110   RGUA   H8    parsed_2mqv   1   
        29   1   2   .   .   .   .   .   .   .   .   .    27   ALA    QB    parsed_2mqv   1   
        30   1   1   .   .   .   .   .   .   .   .   .   110   RGUA   H8    parsed_2mqv   1   
        30   1   2   .   .   .   .   .   .   .   .   .    36   ALA    QB    parsed_2mqv   1   
        31   1   1   .   .   .   .   .   .   .   .   .   110   RGUA   H8    parsed_2mqv   1   
        31   1   2   .   .   .   .   .   .   .   .   .    21   LEU    QD1   parsed_2mqv   1   
        32   1   1   .   .   .   .   .   .   .   .   .   110   RGUA   H1'   parsed_2mqv   1   
        32   1   2   .   .   .   .   .   .   .   .   .    21   LEU    QD1   parsed_2mqv   1   
        33   1   1   .   .   .   .   .   .   .   .   .   110   RGUA   H8    parsed_2mqv   1   
        33   1   2   .   .   .   .   .   .   .   .   .    37   LYS    QE    parsed_2mqv   1   
        34   1   1   .   .   .   .   .   .   .   .   .   110   RGUA   H2'   parsed_2mqv   1   
        34   1   2   .   .   .   .   .   .   .   .   .    35   TRP    HZ3   parsed_2mqv   1   
        35   1   1   .   .   .   .   .   .   .   .   .   110   RGUA   H1'   parsed_2mqv   1   
        35   1   2   .   .   .   .   .   .   .   .   .    35   TRP    HH2   parsed_2mqv   1   
        36   1   1   .   .   .   .   .   .   .   .   .   110   RGUA   H2'   parsed_2mqv   1   
        36   1   2   .   .   .   .   .   .   .   .   .    35   TRP    HH2   parsed_2mqv   1   
        37   1   1   .   .   .   .   .   .   .   .   .   110   RGUA   H1'   parsed_2mqv   1   
        37   1   2   .   .   .   .   .   .   .   .   .    23   ARG    QD    parsed_2mqv   1   
        38   1   1   .   .   .   .   .   .   .   .   .   110   RGUA   Q2    parsed_2mqv   1   
        38   1   2   .   .   .   .   .   .   .   .   .    35   TRP    HE1   parsed_2mqv   1   
        39   1   1   .   .   .   .   .   .   .   .   .   110   RGUA   Q2    parsed_2mqv   1   
        39   1   2   .   .   .   .   .   .   .   .   .    21   LEU    QD2   parsed_2mqv   1   
        40   1   1   .   .   .   .   .   .   .   .   .   110   RGUA   Q2    parsed_2mqv   1   
        40   1   2   .   .   .   .   .   .   .   .   .    21   LEU    QB    parsed_2mqv   1   
        41   1   1   .   .   .   .   .   .   .   .   .   110   RGUA   Q2    parsed_2mqv   1   
        41   1   2   .   .   .   .   .   .   .   .   .    23   ARG    HA    parsed_2mqv   1   
        42   1   1   .   .   .   .   .   .   .   .   .   110   RGUA   Q2    parsed_2mqv   1   
        42   1   2   .   .   .   .   .   .   .   .   .    25   GLN    H     parsed_2mqv   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   .   .   .   .   .   .   .   5.80   parsed_2mqv   1   
         2   1   .   .   .   .   .   .   .   5.00   parsed_2mqv   1   
         3   1   .   .   .   .   .   .   .   3.20   parsed_2mqv   1   
         4   1   .   .   .   .   .   .   .   3.20   parsed_2mqv   1   
         5   1   .   .   .   .   .   .   .   5.10   parsed_2mqv   1   
         6   1   .   .   .   .   .   .   .   5.10   parsed_2mqv   1   
         7   1   .   .   .   .   .   .   .   5.00   parsed_2mqv   1   
         8   1   .   .   .   .   .   .   .   5.80   parsed_2mqv   1   
         9   1   .   .   .   .   .   .   .   5.90   parsed_2mqv   1   
        10   1   .   .   .   .   .   .   .   5.80   parsed_2mqv   1   
        11   1   .   .   .   .   .   .   .   5.50   parsed_2mqv   1   
        12   1   .   .   .   .   .   .   .   3.80   parsed_2mqv   1   
        13   1   .   .   .   .   .   .   .   3.80   parsed_2mqv   1   
        14   1   .   .   .   .   .   .   .   5.50   parsed_2mqv   1   
        15   1   .   .   .   .   .   .   .   5.00   parsed_2mqv   1   
        16   1   .   .   .   .   .   .   .   5.10   parsed_2mqv   1   
        17   1   .   .   .   .   .   .   .   2.70   parsed_2mqv   1   
        18   1   .   .   .   .   .   .   .   2.70   parsed_2mqv   1   
        19   1   .   .   .   .   .   .   .   5.80   parsed_2mqv   1   
        20   1   .   .   .   .   .   .   .   3.80   parsed_2mqv   1   
        21   1   .   .   .   .   .   .   .   3.80   parsed_2mqv   1   
        22   1   .   .   .   .   .   .   .   3.30   parsed_2mqv   1   
        23   1   .   .   .   .   .   .   .   3.30   parsed_2mqv   1   
        24   1   .   .   .   .   .   .   .   5.80   parsed_2mqv   1   
        25   1   .   .   .   .   .   .   .   5.00   parsed_2mqv   1   
        26   1   .   .   .   .   .   .   .   5.80   parsed_2mqv   1   
        27   1   .   .   .   .   .   .   .   5.80   parsed_2mqv   1   
        28   1   .   .   .   .   .   .   .   5.00   parsed_2mqv   1   
        29   1   .   .   .   .   .   .   .   6.50   parsed_2mqv   1   
        30   1   .   .   .   .   .   .   .   6.50   parsed_2mqv   1   
        31   1   .   .   .   .   .   .   .   6.50   parsed_2mqv   1   
        32   1   .   .   .   .   .   .   .   4.80   parsed_2mqv   1   
        33   1   .   .   .   .   .   .   .   5.80   parsed_2mqv   1   
        34   1   .   .   .   .   .   .   .   5.00   parsed_2mqv   1   
        35   1   .   .   .   .   .   .   .   5.00   parsed_2mqv   1   
        36   1   .   .   .   .   .   .   .   5.00   parsed_2mqv   1   
        37   1   .   .   .   .   .   .   .   4.10   parsed_2mqv   1   
        38   1   .   .   .   .   .   .   .   4.10   parsed_2mqv   1   
        39   1   .   .   .   .   .   .   .   3.80   parsed_2mqv   1   
        40   1   .   .   .   .   .   .   .   6.30   parsed_2mqv   1   
        41   1   .   .   .   .   .   .   .   5.80   parsed_2mqv   1   
        42   1   .   .   .   .   .   .   .   4.10   parsed_2mqv   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    ---------------------------------------------------------    1   1    1   59   parsed_2mqv   1   
        2   "Intermolecular NOEs"                                         2   1    2   23   parsed_2mqv   1   
        3    ---------------------------------------------------------    3   1    3   59   parsed_2mqv   1   
        4   "#"                                                           4   1    4    3   parsed_2mqv   1   
        5   "URA 107"                                                     5   1    5    9   parsed_2mqv   1   
        6   "RCYT 108"                                                   17   1   17   10   parsed_2mqv   1   
        7   "URA 109"                                                    28   1   28    9   parsed_2mqv   1   
        8   "RGUA 110"                                                   38   1   38   10   parsed_2mqv   1   
    stop_

save_





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