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
36822 1om2 4496 cing 2-parsed STAR dihedral angle 39


data_1om2_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1om2 
    _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_1om2   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1om2 
    _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   1om2   "Master copy"    parsed_1om2   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1om2 
    _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   1om2.mr   .   .   "MR format"     1    comment                  "Not applicable"    "Not applicable"       0   parsed_1om2   1   
        1   1om2.mr   .   .    EMBOSS         2    distance                  NOE                 simple             1052   parsed_1om2   1   
        1   1om2.mr   .   .    EMBOSS         3   "dihedral angle"          "Not applicable"    "Not applicable"      39   parsed_1om2   1   
        1   1om2.mr   .   .    DYANA/DIANA    4   "dihedral angle"          "Not applicable"    "Not applicable"       0   parsed_1om2   1   
        1   1om2.mr   .   .    DYANA/DIANA    5    distance                 "hydrogen bond"      simple                0   parsed_1om2   1   
        1   1om2.mr   .   .    DYANA/DIANA    6    distance                  NOE                 simple                0   parsed_1om2   1   
        1   1om2.mr   .   .    n/a            7    comment                  "Not applicable"    "Not applicable"       0   parsed_1om2   1   
        1   1om2.mr   .   .    EMBOSS         8   "dihedral angle"          "Not applicable"    "Not applicable"       0   parsed_1om2   1   
        1   1om2.mr   .   .    n/a            9    comment                  "Not applicable"    "Not applicable"       0   parsed_1om2   1   
        1   1om2.mr   .   .    EMBOSS        10    distance                  NOE                 simple                0   parsed_1om2   1   
        1   1om2.mr   .   .    n/a           11    comment                  "Not applicable"    "Not applicable"       0   parsed_1om2   1   
        1   1om2.mr   .   .   "MR format"    12   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_1om2   1   
    stop_

save_


save_Emboss_dihedral_3
    _Torsion_angle_constraint_list.Sf_category         torsion_angle_constraints 
    _Torsion_angle_constraint_list.Entry_ID            parsed_1om2 
    _Torsion_angle_constraint_list.ID                  1 
    _Torsion_angle_constraint_list.Constraint_file_ID  1 
    _Torsion_angle_constraint_list.Block_ID            3 
    _Torsion_angle_constraint_list.Details            "Generated by Wattos" 

    loop_
        _Torsion_angle_constraint.ID 
        _Torsion_angle_constraint.Torsion_angle_name 
        _Torsion_angle_constraint.Assembly_atom_ID_1 
        _Torsion_angle_constraint.Entity_assembly_ID_1 
        _Torsion_angle_constraint.Entity_ID_1 
        _Torsion_angle_constraint.Comp_index_ID_1 
        _Torsion_angle_constraint.Seq_ID_1 
        _Torsion_angle_constraint.Comp_ID_1 
        _Torsion_angle_constraint.Atom_ID_1 
        _Torsion_angle_constraint.Resonance_ID_1 
        _Torsion_angle_constraint.Assembly_atom_ID_2 
        _Torsion_angle_constraint.Entity_assembly_ID_2 
        _Torsion_angle_constraint.Entity_ID_2 
        _Torsion_angle_constraint.Comp_index_ID_2 
        _Torsion_angle_constraint.Seq_ID_2 
        _Torsion_angle_constraint.Comp_ID_2 
        _Torsion_angle_constraint.Atom_ID_2 
        _Torsion_angle_constraint.Resonance_ID_2 
        _Torsion_angle_constraint.Assembly_atom_ID_3 
        _Torsion_angle_constraint.Entity_assembly_ID_3 
        _Torsion_angle_constraint.Entity_ID_3 
        _Torsion_angle_constraint.Comp_index_ID_3 
        _Torsion_angle_constraint.Seq_ID_3 
        _Torsion_angle_constraint.Comp_ID_3 
        _Torsion_angle_constraint.Atom_ID_3 
        _Torsion_angle_constraint.Resonance_ID_3 
        _Torsion_angle_constraint.Assembly_atom_ID_4 
        _Torsion_angle_constraint.Entity_assembly_ID_4 
        _Torsion_angle_constraint.Entity_ID_4 
        _Torsion_angle_constraint.Comp_index_ID_4 
        _Torsion_angle_constraint.Seq_ID_4 
        _Torsion_angle_constraint.Comp_ID_4 
        _Torsion_angle_constraint.Atom_ID_4 
        _Torsion_angle_constraint.Resonance_ID_4 
        _Torsion_angle_constraint.Angle_lower_bound_val 
        _Torsion_angle_constraint.Angle_upper_bound_val 
        _Torsion_angle_constraint.Source_experiment_ID 
        _Torsion_angle_constraint.Auth_asym_ID_1 
        _Torsion_angle_constraint.Auth_seq_ID_1 
        _Torsion_angle_constraint.Auth_comp_ID_1 
        _Torsion_angle_constraint.Auth_atom_ID_1 
        _Torsion_angle_constraint.Auth_asym_ID_2 
        _Torsion_angle_constraint.Auth_seq_ID_2 
        _Torsion_angle_constraint.Auth_comp_ID_2 
        _Torsion_angle_constraint.Auth_atom_ID_2 
        _Torsion_angle_constraint.Auth_asym_ID_3 
        _Torsion_angle_constraint.Auth_seq_ID_3 
        _Torsion_angle_constraint.Auth_comp_ID_3 
        _Torsion_angle_constraint.Auth_atom_ID_3 
        _Torsion_angle_constraint.Auth_asym_ID_4 
        _Torsion_angle_constraint.Auth_seq_ID_4 
        _Torsion_angle_constraint.Auth_comp_ID_4 
        _Torsion_angle_constraint.Auth_atom_ID_4 
        _Torsion_angle_constraint.Entry_ID 
        _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 

         1   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -140.0   -100.0   .   1   48   .   C   1   49   .   N   1   49   .   CA   1   49   .   C   parsed_1om2   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0    -80.0   .   1   11   .   C   1   12   .   N   1   12   .   CA   1   12   .   C   parsed_1om2   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0    -80.0   .   1   32   .   C   1   33   .   N   1   33   .   CA   1   33   .   C   parsed_1om2   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0    -80.0   .   1   51   .   C   1   52   .   N   1   52   .   CA   1   52   .   C   parsed_1om2   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0    -80.0   .   1   59   .   C   1   60   .   N   1   60   .   CA   1   60   .   C   parsed_1om2   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -160.0    -80.0   .   1   62   .   C   1   63   .   N   1   63   .   CA   1   63   .   C   parsed_1om2   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   12   .   C   1   13   .   N   1   13   .   CA   1   13   .   C   parsed_1om2   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   14   .   C   1   15   .   N   1   15   .   CA   1   15   .   C   parsed_1om2   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   16   .   C   1   17   .   N   1   17   .   CA   1   17   .   C   parsed_1om2   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   18   .   C   1   19   .   N   1   19   .   CA   1   19   .   C   parsed_1om2   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   19   .   C   1   20   .   N   1   20   .   CA   1   20   .   C   parsed_1om2   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   20   .   C   1   21   .   N   1   21   .   CA   1   21   .   C   parsed_1om2   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   22   .   C   1   23   .   N   1   23   .   CA   1   23   .   C   parsed_1om2   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   24   .   C   1   25   .   N   1   25   .   CA   1   25   .   C   parsed_1om2   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   25   .   C   1   26   .   N   1   26   .   CA   1   26   .   C   parsed_1om2   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   27   .   C   1   28   .   N   1   28   .   CA   1   28   .   C   parsed_1om2   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   35   .   C   1   36   .   N   1   36   .   CA   1   36   .   C   parsed_1om2   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   36   .   C   1   37   .   N   1   37   .   CA   1   37   .   C   parsed_1om2   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   37   .   C   1   38   .   N   1   38   .   CA   1   38   .   C   parsed_1om2   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   39   .   C   1   40   .   N   1   40   .   CA   1   40   .   C   parsed_1om2   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   40   .   C   1   41   .   N   1   41   .   CA   1   41   .   C   parsed_1om2   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   41   .   C   1   42   .   N   1   42   .   CA   1   42   .   C   parsed_1om2   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   43   .   C   1   44   .   N   1   44   .   CA   1   44   .   C   parsed_1om2   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   44   .   C   1   45   .   N   1   45   .   CA   1   45   .   C   parsed_1om2   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   45   .   C   1   46   .   N   1   46   .   CA   1   46   .   C   parsed_1om2   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   47   .   C   1   48   .   N   1   48   .   CA   1   48   .   C   parsed_1om2   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   49   .   C   1   50   .   N   1   50   .   CA   1   50   .   C   parsed_1om2   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   53   .   C   1   54   .   N   1   54   .   CA   1   54   .   C   parsed_1om2   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   55   .   C   1   56   .   N   1   56   .   CA   1   56   .   C   parsed_1om2   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   56   .   C   1   57   .   N   1   57   .   CA   1   57   .   C   parsed_1om2   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   57   .   C   1   58   .   N   1   58   .   CA   1   58   .   C   parsed_1om2   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   58   .   C   1   59   .   N   1   59   .   CA   1   59   .   C   parsed_1om2   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   60   .   C   1   61   .   N   1   61   .   CA   1   61   .   C   parsed_1om2   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   69   .   C   1   70   .   N   1   70   .   CA   1   70   .   C   parsed_1om2   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   70   .   C   1   71   .   N   1   71   .   CA   1   71   .   C   parsed_1om2   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   71   .   C   1   72   .   N   1   72   .   CA   1   72   .   C   parsed_1om2   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   75   .   C   1   76   .   N   1   76   .   CA   1   76   .   C   parsed_1om2   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   78   .   C   1   79   .   N   1   79   .   CA   1   79   .   C   parsed_1om2   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -90.0    -40.0   .   1   82   .   C   1   83   .   N   1   83   .   CA   1   83   .   C   parsed_1om2   1   
    stop_


    loop_
        _TA_constraint_comment_org.ID 
        _TA_constraint_comment_org.Comment_text 
        _TA_constraint_comment_org.Comment_begin_line 
        _TA_constraint_comment_org.Comment_begin_column 
        _TA_constraint_comment_org.Comment_end_line 
        _TA_constraint_comment_org.Comment_end_column 
        _TA_constraint_comment_org.Entry_ID 
        _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 

         1   "VAL PHI"      1   69    1   77   parsed_1om2   1   
         2   "ASP- PHI"     2   69    2   78   parsed_1om2   1   
         3   "GLN PHI"      3   69    3   77   parsed_1om2   1   
         4   "GLN PHI"      4   69    4   77   parsed_1om2   1   
         5   "LEU PHI"      5   69    5   77   parsed_1om2   1   
         6   "THR PHI"      6   69    6   77   parsed_1om2   1   
         7   "ALA PHI"      7   69    7   77   parsed_1om2   1   
         8   "ALA PHI"      8   69    8   77   parsed_1om2   1   
         9   "GLN PHI"      9   69    9   77   parsed_1om2   1   
        10   "PHE PHI"     10   69   10   77   parsed_1om2   1   
        11   "PHE PHI"     11   69   11   77   parsed_1om2   1   
        12   "LEU PHI"     12   69   12   77   parsed_1om2   1   
        13   "GLU- PHI"    13   69   13   78   parsed_1om2   1   
        14   "GLN PHI"     14   69   14   77   parsed_1om2   1   
        15   "LEU PHI"     15   69   15   77   parsed_1om2   1   
        16   "GLU- PHI"    16   69   16   78   parsed_1om2   1   
        17   "TYR PHI"     17   69   17   77   parsed_1om2   1   
        18   "GLU- PHI"    18   69   18   78   parsed_1om2   1   
        19   "LYS+ PHI"    19   69   19   78   parsed_1om2   1   
        20   "VAL PHI"     20   69   20   77   parsed_1om2   1   
        21   "ASP- PHI"    21   69   21   78   parsed_1om2   1   
        22   "HIS PHI"     22   69   22   77   parsed_1om2   1   
        23   "THR PHI"     23   69   23   77   parsed_1om2   1   
        24   "ASN PHI"     24   69   24   77   parsed_1om2   1   
        25   "ALA PHI"     25   69   25   77   parsed_1om2   1   
        26   "ALA PHI"     26   69   26   77   parsed_1om2   1   
        27   "CYS PHI"     27   69   27   77   parsed_1om2   1   
        28   "GLN PHI"     28   69   28   77   parsed_1om2   1   
        29   "LEU PHI"     29   69   29   77   parsed_1om2   1   
        30   "LEU PHI"     30   69   30   77   parsed_1om2   1   
        31   "GLN PHI"     31   69   31   77   parsed_1om2   1   
        32   "VAL PHI"     32   69   32   77   parsed_1om2   1   
        33   "GLN PHI"     33   69   33   77   parsed_1om2   1   
        34   "GLN PHI"     34   69   34   77   parsed_1om2   1   
        35   "MET PHI"     35   69   35   77   parsed_1om2   1   
        36   "LEU PHI"     36   69   36   77   parsed_1om2   1   
        37   "LEU PHI"     37   69   37   77   parsed_1om2   1   
        38   "ILE PHI"     38   69   38   77   parsed_1om2   1   
        39   "ILE PHI"     39   69   39   77   parsed_1om2   1   
    stop_

save_





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