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
544089 2lht 17865 cing 2-parsed STAR dipolar coupling 41


data_2lht_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2lht 
    _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_2lht   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2lht 
    _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   2lht   "Master copy"    parsed_2lht   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2lht 
    _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   2lht.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_2lht   1   
        1   2lht.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             1414   parsed_2lht   1   
        1   2lht.mr   .   .    XPLOR/CNS     3   "dihedral angle"          "Not applicable"    "Not applicable"     186   parsed_2lht   1   
        1   2lht.mr   .   .    XPLOR/CNS     4   "dipolar coupling"        "Not applicable"    "Not applicable"      41   parsed_2lht   1   
        1   2lht.mr   .   .   "MR format"    5   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_2lht   1   
    stop_

save_


save_CNS/XPLOR_dipolar_coupling_4
    _RDC_constraint_list.Sf_category         RDC_constraints 
    _RDC_constraint_list.Entry_ID            parsed_2lht 
    _RDC_constraint_list.ID                  1 
    _RDC_constraint_list.Constraint_file_ID  1 
    _RDC_constraint_list.Block_ID            4 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    7.578   .   .   .   .   .    58   .   N   .    58   .   HN   parsed_2lht   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    6.286   .   .   .   .   .    59   .   N   .    59   .   HN   parsed_2lht   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    7.998   .   .   .   .   .    60   .   N   .    60   .   HN   parsed_2lht   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    7.375   .   .   .   .   .    61   .   N   .    61   .   HN   parsed_2lht   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    6.601   .   .   .   .   .    62   .   N   .    62   .   HN   parsed_2lht   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    7.857   .   .   .   .   .    63   .   N   .    63   .   HN   parsed_2lht   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -7.766   .   .   .   .   .    66   .   N   .    66   .   HN   parsed_2lht   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -5.234   .   .   .   .   .    67   .   N   .    67   .   HN   parsed_2lht   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    2.167   .   .   .   .   .    68   .   N   .    68   .   HN   parsed_2lht   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    3.179   .   .   .   .   .    69   .   N   .    69   .   HN   parsed_2lht   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -5.946   .   .   .   .   .    70   .   N   .    70   .   HN   parsed_2lht   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -4.370   .   .   .   .   .    71   .   N   .    71   .   HN   parsed_2lht   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    5.018   .   .   .   .   .    73   .   N   .    73   .   HN   parsed_2lht   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    7.632   .   .   .   .   .    76   .   N   .    76   .   HN   parsed_2lht   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    8.217   .   .   .   .   .    77   .   N   .    77   .   HN   parsed_2lht   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    9.825   .   .   .   .   .    78   .   N   .    78   .   HN   parsed_2lht   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    2.324   .   .   .   .   .    79   .   N   .    79   .   HN   parsed_2lht   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    6.769   .   .   .   .   .    80   .   N   .    80   .   HN   parsed_2lht   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    6.856   .   .   .   .   .    81   .   N   .    81   .   HN   parsed_2lht   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   10.827   .   .   .   .   .    82   .   N   .    82   .   HN   parsed_2lht   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -3.053   .   .   .   .   .   111   .   N   .   111   .   HN   parsed_2lht   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -3.594   .   .   .   .   .   113   .   N   .   113   .   HN   parsed_2lht   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -1.267   .   .   .   .   .   114   .   N   .   114   .   HN   parsed_2lht   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -2.282   .   .   .   .   .   115   .   N   .   115   .   HN   parsed_2lht   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -1.488   .   .   .   .   .   116   .   N   .   116   .   HN   parsed_2lht   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -2.433   .   .   .   .   .   118   .   N   .   118   .   HN   parsed_2lht   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -1.823   .   .   .   .   .   119   .   N   .   119   .   HN   parsed_2lht   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -2.159   .   .   .   .   .   120   .   N   .   120   .   HN   parsed_2lht   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -5.230   .   .   .   .   .   123   .   N   .   123   .   HN   parsed_2lht   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -1.311   .   .   .   .   .   126   .   N   .   126   .   HN   parsed_2lht   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -1.839   .   .   .   .   .   127   .   N   .   127   .   HN   parsed_2lht   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -2.499   .   .   .   .   .   128   .   N   .   128   .   HN   parsed_2lht   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    0.223   .   .   .   .   .   129   .   N   .   129   .   HN   parsed_2lht   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -2.787   .   .   .   .   .   130   .   N   .   130   .   HN   parsed_2lht   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -2.045   .   .   .   .   .   131   .   N   .   131   .   HN   parsed_2lht   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    1.698   .   .   .   .   .   132   .   N   .   132   .   HN   parsed_2lht   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -3.102   .   .   .   .   .   133   .   N   .   133   .   HN   parsed_2lht   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    0.868   .   .   .   .   .   134   .   N   .   134   .   HN   parsed_2lht   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -3.530   .   .   .   .   .   135   .   N   .   135   .   HN   parsed_2lht   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -0.344   .   .   .   .   .   136   .   N   .   136   .   HN   parsed_2lht   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -2.000   .   .   .   .   .   137   .   N   .   137   .   HN   parsed_2lht   1   
    stop_

save_





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