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 item_count
514358 2lf0 17735 cing 2-parsed STAR dipolar coupling 70


data_2lf0_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2lf0 
    _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_2lf0   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2lf0 
    _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   2lf0   "Master copy"    parsed_2lf0   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2lf0 
    _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   2lf0.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_2lf0   1   
        1   2lf0.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             3307   parsed_2lf0   1   
        1   2lf0.mr   .   .    XPLOR/CNS     3   "dihedral angle"          "Not applicable"    "Not applicable"     200   parsed_2lf0   1   
        1   2lf0.mr   .   .    XPLOR/CNS     4    distance                 "hydrogen bond"      simple              112   parsed_2lf0   1   
        1   2lf0.mr   .   .    XPLOR/CNS     5   "dipolar coupling"        "Not applicable"    "Not applicable"     147   parsed_2lf0   1   
        1   2lf0.mr   .   .    XPLOR/CNS     6   "dipolar coupling"        "Not applicable"    "Not applicable"     138   parsed_2lf0   1   
        1   2lf0.mr   .   .    XPLOR/CNS     7   "dipolar coupling"        "Not applicable"    "Not applicable"      70   parsed_2lf0   1   
        1   2lf0.mr   .   .   "MR format"    8   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_2lf0   1   
    stop_

save_


save_CNS/XPLOR_dipolar_coupling_7
    _RDC_constraint_list.Sf_category         RDC_constraints 
    _RDC_constraint_list.Entry_ID            parsed_2lf0 
    _RDC_constraint_list.ID                  1 
    _RDC_constraint_list.Constraint_file_ID  1 
    _RDC_constraint_list.Block_ID            7 
    _RDC_constraint_list.Details            "Generated by Wattos" 

    loop_
        _RDC_constraint.ID 
        _RDC_constraint.Assembly_atom_ID_1 
        _RDC_constraint.Entity_assembly_ID_1 
        _RDC_constraint.Entity_ID_1 
        _RDC_constraint.Comp_index_ID_1 
        _RDC_constraint.Seq_ID_1 
        _RDC_constraint.Comp_ID_1 
        _RDC_constraint.Atom_ID_1 
        _RDC_constraint.Resonance_ID_1 
        _RDC_constraint.Assembly_atom_ID_2 
        _RDC_constraint.Entity_assembly_ID_2 
        _RDC_constraint.Entity_ID_2 
        _RDC_constraint.Comp_index_ID_2 
        _RDC_constraint.Seq_ID_2 
        _RDC_constraint.Comp_ID_2 
        _RDC_constraint.Atom_ID_2 
        _RDC_constraint.Resonance_ID_2 
        _RDC_constraint.RDC_val 
        _RDC_constraint.RDC_lower_bound 
        _RDC_constraint.RDC_upper_bound 
        _RDC_constraint.RDC_val_err 
        _RDC_constraint.Source_experiment_ID 
        _RDC_constraint.Auth_asym_ID_1 
        _RDC_constraint.Auth_seq_ID_1 
        _RDC_constraint.Auth_comp_ID_1 
        _RDC_constraint.Auth_atom_ID_1 
        _RDC_constraint.Auth_asym_ID_2 
        _RDC_constraint.Auth_seq_ID_2 
        _RDC_constraint.Auth_comp_ID_2 
        _RDC_constraint.Auth_atom_ID_2 
        _RDC_constraint.Entry_ID 
        _RDC_constraint.RDC_constraint_list_ID 

         1   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.7050   .   .   .   .   .     5   .   HN   .     5   .   N   parsed_2lf0   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.0470   .   .   .   .   .     8   .   HN   .     8   .   N   parsed_2lf0   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.3380   .   .   .   .   .    11   .   HN   .    11   .   N   parsed_2lf0   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.1630   .   .   .   .   .    13   .   HN   .    13   .   N   parsed_2lf0   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.0550   .   .   .   .   .    14   .   HN   .    14   .   N   parsed_2lf0   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.9130   .   .   .   .   .    15   .   HN   .    15   .   N   parsed_2lf0   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.3570   .   .   .   .   .    16   .   HN   .    16   .   N   parsed_2lf0   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.9000   .   .   .   .   .    17   .   HN   .    17   .   N   parsed_2lf0   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.6850   .   .   .   .   .    18   .   HN   .    18   .   N   parsed_2lf0   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.4040   .   .   .   .   .    19   .   HN   .    19   .   N   parsed_2lf0   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.3450   .   .   .   .   .    20   .   HN   .    20   .   N   parsed_2lf0   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.8140   .   .   .   .   .    21   .   HN   .    21   .   N   parsed_2lf0   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.3760   .   .   .   .   .    23   .   HN   .    23   .   N   parsed_2lf0   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.1700   .   .   .   .   .    24   .   HN   .    24   .   N   parsed_2lf0   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.7780   .   .   .   .   .    25   .   HN   .    25   .   N   parsed_2lf0   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.8960   .   .   .   .   .    32   .   HN   .    32   .   N   parsed_2lf0   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.6950   .   .   .   .   .    33   .   HN   .    33   .   N   parsed_2lf0   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.8370   .   .   .   .   .    34   .   HN   .    34   .   N   parsed_2lf0   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.6820   .   .   .   .   .    35   .   HN   .    35   .   N   parsed_2lf0   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.9350   .   .   .   .   .    37   .   HN   .    37   .   N   parsed_2lf0   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.0930   .   .   .   .   .    38   .   HN   .    38   .   N   parsed_2lf0   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.9140   .   .   .   .   .    39   .   HN   .    39   .   N   parsed_2lf0   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.3600   .   .   .   .   .    40   .   HN   .    40   .   N   parsed_2lf0   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.8920   .   .   .   .   .    41   .   HN   .    41   .   N   parsed_2lf0   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.2720   .   .   .   .   .    42   .   HN   .    42   .   N   parsed_2lf0   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.9290   .   .   .   .   .    43   .   HN   .    43   .   N   parsed_2lf0   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.0140   .   .   .   .   .    44   .   HN   .    44   .   N   parsed_2lf0   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.2450   .   .   .   .   .    45   .   HN   .    45   .   N   parsed_2lf0   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.7480   .   .   .   .   .    46   .   HN   .    46   .   N   parsed_2lf0   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.3420   .   .   .   .   .    47   .   HN   .    47   .   N   parsed_2lf0   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.7620   .   .   .   .   .    48   .   HN   .    48   .   N   parsed_2lf0   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.1490   .   .   .   .   .    49   .   HN   .    49   .   N   parsed_2lf0   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.1820   .   .   .   .   .    50   .   HN   .    50   .   N   parsed_2lf0   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.7910   .   .   .   .   .    51   .   HN   .    51   .   N   parsed_2lf0   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.4610   .   .   .   .   .    52   .   HN   .    52   .   N   parsed_2lf0   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.8050   .   .   .   .   .    53   .   HN   .    53   .   N   parsed_2lf0   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0740   .   .   .   .   .    55   .   HN   .    55   .   N   parsed_2lf0   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.5600   .   .   .   .   .    56   .   HN   .    56   .   N   parsed_2lf0   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.7600   .   .   .   .   .    63   .   HN   .    63   .   N   parsed_2lf0   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -16.8830   .   .   .   .   .    66   .   HN   .    66   .   N   parsed_2lf0   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.9590   .   .   .   .   .    67   .   HN   .    67   .   N   parsed_2lf0   1   
        42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.5830   .   .   .   .   .    68   .   HN   .    68   .   N   parsed_2lf0   1   
        43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -22.0730   .   .   .   .   .    69   .   HN   .    69   .   N   parsed_2lf0   1   
        44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -21.6070   .   .   .   .   .    72   .   HN   .    72   .   N   parsed_2lf0   1   
        45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -23.8640   .   .   .   .   .    73   .   HN   .    73   .   N   parsed_2lf0   1   
        46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -23.2290   .   .   .   .   .    74   .   HN   .    74   .   N   parsed_2lf0   1   
        47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -22.2910   .   .   .   .   .    75   .   HN   .    75   .   N   parsed_2lf0   1   
        48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.4590   .   .   .   .   .    76   .   HN   .    76   .   N   parsed_2lf0   1   
        49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -17.2560   .   .   .   .   .    79   .   HN   .    79   .   N   parsed_2lf0   1   
        50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -17.3660   .   .   .   .   .    81   .   HN   .    81   .   N   parsed_2lf0   1   
        51   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -22.1760   .   .   .   .   .    82   .   HN   .    82   .   N   parsed_2lf0   1   
        52   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.0560   .   .   .   .   .    85   .   HN   .    85   .   N   parsed_2lf0   1   
        53   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.7280   .   .   .   .   .    86   .   HN   .    86   .   N   parsed_2lf0   1   
        54   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.3420   .   .   .   .   .    87   .   HN   .    87   .   N   parsed_2lf0   1   
        55   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.2530   .   .   .   .   .    88   .   HN   .    88   .   N   parsed_2lf0   1   
        56   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.0880   .   .   .   .   .    89   .   HN   .    89   .   N   parsed_2lf0   1   
        57   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    16.8500   .   .   .   .   .    94   .   HN   .    94   .   N   parsed_2lf0   1   
        58   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -18.7080   .   .   .   .   .    95   .   HN   .    95   .   N   parsed_2lf0   1   
        59   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -21.4470   .   .   .   .   .    96   .   HN   .    96   .   N   parsed_2lf0   1   
        60   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -20.6940   .   .   .   .   .    97   .   HN   .    97   .   N   parsed_2lf0   1   
        61   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -16.5870   .   .   .   .   .    98   .   HN   .    98   .   N   parsed_2lf0   1   
        62   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.6420   .   .   .   .   .   103   .   HN   .   103   .   N   parsed_2lf0   1   
        63   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.9650   .   .   .   .   .   104   .   HN   .   104   .   N   parsed_2lf0   1   
        64   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -20.2490   .   .   .   .   .   105   .   HN   .   105   .   N   parsed_2lf0   1   
        65   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.8290   .   .   .   .   .   106   .   HN   .   106   .   N   parsed_2lf0   1   
        66   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.3170   .   .   .   .   .   107   .   HN   .   107   .   N   parsed_2lf0   1   
        67   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.5680   .   .   .   .   .   113   .   HN   .   113   .   N   parsed_2lf0   1   
        68   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -20.0450   .   .   .   .   .   114   .   HN   .   114   .   N   parsed_2lf0   1   
        69   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -22.1450   .   .   .   .   .   115   .   HN   .   115   .   N   parsed_2lf0   1   
        70   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -18.4380   .   .   .   .   .   116   .   HN   .   116   .   N   parsed_2lf0   1   
    stop_

save_





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