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
35589 1lvz 5376 cing 2-parsed STAR dipolar coupling 15


data_1lvz_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1lvz 
    _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_1lvz   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1lvz 
    _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   1lvz   "Master copy"    parsed_1lvz   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1lvz 
    _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   1lvz.mr   .   .   "MR format"     1    comment                  "Not applicable"    "Not applicable"      0   parsed_1lvz   1   
        1   1lvz.mr   .   .    n/a            2    comment                  "Not applicable"    "Not applicable"      0   parsed_1lvz   1   
        1   1lvz.mr   .   .    XPLOR/CNS      3    distance                  NOE                 ambi               121   parsed_1lvz   1   
        1   1lvz.mr   .   .    XPLOR/CNS      4    distance                 "NOE not seen"       simple               8   parsed_1lvz   1   
        1   1lvz.mr   .   .    XPLOR/CNS      5    distance                 "hydrogen bond"      simple              11   parsed_1lvz   1   
        1   1lvz.mr   .   .    n/a            6    comment                  "Not applicable"    "Not applicable"      0   parsed_1lvz   1   
        1   1lvz.mr   .   .    XPLOR/CNS      7   "dihedral angle"          "Not applicable"    "Not applicable"     12   parsed_1lvz   1   
        1   1lvz.mr   .   .    n/a            8    comment                  "Not applicable"    "Not applicable"      0   parsed_1lvz   1   
        1   1lvz.mr   .   .    XPLOR/CNS      9   "dipolar coupling"        "Not applicable"    "Not applicable"      9   parsed_1lvz   1   
        1   1lvz.mr   .   .    n/a           10    comment                  "Not applicable"    "Not applicable"      0   parsed_1lvz   1   
        1   1lvz.mr   .   .    XPLOR/CNS     11   "dipolar coupling"        "Not applicable"    "Not applicable"     14   parsed_1lvz   1   
        1   1lvz.mr   .   .    n/a           12    comment                  "Not applicable"    "Not applicable"      0   parsed_1lvz   1   
        1   1lvz.mr   .   .    XPLOR/CNS     13   "dipolar coupling"        "Not applicable"    "Not applicable"     15   parsed_1lvz   1   
        1   1lvz.mr   .   .    n/a           14    comment                  "Not applicable"    "Not applicable"      0   parsed_1lvz   1   
        1   1lvz.mr   .   .   "MR format"    15   "nomenclature mapping"    "Not applicable"    "Not applicable"      0   parsed_1lvz   1   
    stop_

save_


save_CNS/XPLOR_dipolar_coupling_13
    _RDC_constraint_list.Sf_category         RDC_constraints 
    _RDC_constraint_list.Entry_ID            parsed_1lvz 
    _RDC_constraint_list.ID                  1 
    _RDC_constraint_list.Constraint_file_ID  1 
    _RDC_constraint_list.Block_ID            13 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -0.7   -15.7      -0.5      .   .   .    2   .   CB   .    2   .   HB#   parsed_1lvz   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    0.3     0.1000   15.3000   .   .   .    2   .   CD   .    2   .   HD#   parsed_1lvz   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    1.3     1.1000   16.3000   .   .   .    3   .   CB   .    3   .   HB#   parsed_1lvz   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -2.3   -17.3000   -2.1000   .   .   .    4   .   CB   .    4   .   HB#   parsed_1lvz   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -2.6   -17.6000   -2.4000   .   .   .    5   .   CB   .    5   .   HB#   parsed_1lvz   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    1.0     0.8000   16.0000   .   .   .    5   .   CG   .    5   .   CD1   parsed_1lvz   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -2.2   -17.2000   -2.0000   .   .   .    5   .   CG   .    5   .   CD2   parsed_1lvz   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    2.0     1.8000   17.0000   .   .   .    6   .   CB   .    6   .   HB#   parsed_1lvz   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    1.6     1.4000   16.6000   .   .   .    6   .   CG   .    6   .   HG#   parsed_1lvz   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -0.4   -15.4000   -0.2000   .   .   .    6   .   CE   .    6   .   HE#   parsed_1lvz   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    1.9     1.7000   16.9000   .   .   .    7   .   CB   .    7   .   HB#   parsed_1lvz   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -2.3   -17.3000   -2.1000   .   .   .    8   .   CB   .    8   .   HB#   parsed_1lvz   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -2.4   -17.4000   -2.2000   .   .   .   10   .   CB   .   10   .   HB#   parsed_1lvz   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    2.3     2.1000   17.3000   .   .   .   10   .   CG   .   10   .   CD1   parsed_1lvz   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -1.4   -16.4000   -1.2000   .   .   .   10   .   CG   .   10   .   CD2   parsed_1lvz   1   
    stop_


    loop_
        _RDC_constraint_comment_org.ID 
        _RDC_constraint_comment_org.Comment_text 
        _RDC_constraint_comment_org.Comment_begin_line 
        _RDC_constraint_comment_org.Comment_begin_column 
        _RDC_constraint_comment_org.Comment_end_line 
        _RDC_constraint_comment_org.Comment_end_column 
        _RDC_constraint_comment_org.Entry_ID 
        _RDC_constraint_comment_org.RDC_constraint_list_ID 

         1   "***** Arg2 CB-HB#    half-open square potential"           7   1     7   50   parsed_1lvz   1   
         2   "***** Arg2 CD-HD#    half-open square potential"          15   1    15   50   parsed_1lvz   1   
         3   "***** Glu3 CB-HB#    half-open square potential"          23   1    23   50   parsed_1lvz   1   
         4   "***** Asn4 CB-HB#    half-open square potential"          31   1    31   50   parsed_1lvz   1   
         5   "***** Leu5 CB-HB#    half-open square potential"          39   1    39   50   parsed_1lvz   1   
         6   "***** Leu5 CG-CD1    half-open square potential"          47   1    47   50   parsed_1lvz   1   
         7   "***** Leu5 CG-CD2 value   half-open square potential"     55   1    55   55   parsed_1lvz   1   
         8   "***** Lys6 CB-HB#    half-open square potential"          63   1    63   50   parsed_1lvz   1   
         9   "***** Lys6 CG-HG#    half-open square potential"          71   1    71   50   parsed_1lvz   1   
        10   "***** Lys6 CE-HE#    half-open square potential"          79   1    79   50   parsed_1lvz   1   
        11   "***** Asp7 CB-HB#    half-open square potential"          87   1    87   50   parsed_1lvz   1   
        12   "***** Ser8 CB-HB#    half-open square potential"          95   1    95   50   parsed_1lvz   1   
        13   "***** Leu10 CB-HB#    half-open square potential"        103   1   103   51   parsed_1lvz   1   
        14   "***** Leu10 CG-CD1    half-open square potential"        111   1   111   51   parsed_1lvz   1   
        15   "***** Leu10 CG-CD2    half-open square potential"        119   1   119   51   parsed_1lvz   1   
    stop_

save_





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