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
562013 2m30 7376 cing 2-parsed STAR dihedral angle


data_2m30_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2m30 
    _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_2m30   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2m30 
    _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   2m30   "Master copy"    parsed_2m30   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2m30 
    _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   2m30.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"      0   parsed_2m30   1   
        1   2m30.mr   .   .    AMBER         2    distance                  NOE                 simple             762   parsed_2m30   1   
        1   2m30.mr   .   .    AMBER         3   "dihedral angle"          "Not applicable"    "Not applicable"      0   parsed_2m30   1   
        1   2m30.mr   .   .    AMBER         4    unknown                  "Not applicable"    "Not applicable"      0   parsed_2m30   1   
        1   2m30.mr   .   .   "MR format"    5   "nomenclature mapping"    "Not applicable"    "Not applicable"      0   parsed_2m30   1   
    stop_

save_


save_AMBER_dihedral_3
    _Torsion_angle_constraint_list.Sf_category         torsion_angle_constraints 
    _Torsion_angle_constraint_list.Entry_ID            parsed_2m30 
    _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 

        .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   parsed_2m30   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   "N angles for residue 2"        1   1     1   25   parsed_2m30   1   
          2   "N angles for residue 3"        6   1     6   25   parsed_2m30   1   
          3   "N angles for residue 6"       11   1    11   25   parsed_2m30   1   
          4   "N angles for residue 7"       16   1    16   25   parsed_2m30   1   
          5   "N angles for residue 10"      21   1    21   26   parsed_2m30   1   
          6   "N angles for residue 11"      26   1    26   26   parsed_2m30   1   
          7   "N angles for residue 13"      31   1    31   26   parsed_2m30   1   
          8   "N angles for residue 14"      36   1    36   26   parsed_2m30   1   
          9   "N angles for residue 15"      41   1    41   26   parsed_2m30   1   
         10   "N angles for residue 16"      46   1    46   26   parsed_2m30   1   
         11   "N angles for residue 18"      51   1    51   26   parsed_2m30   1   
         12   "N angles for residue 20"      56   1    56   26   parsed_2m30   1   
         13   "N angles for residue 22"      61   1    61   26   parsed_2m30   1   
         14   "N angles for residue 23"      66   1    66   26   parsed_2m30   1   
         15   "N angles for residue 25"      71   1    71   26   parsed_2m30   1   
         16   "N angles for residue 28"      76   1    76   26   parsed_2m30   1   
         17   "N angles for residue 30"      81   1    81   26   parsed_2m30   1   
         18   "N angles for residue 31"      86   1    86   26   parsed_2m30   1   
         19   "N angles for residue 33"      91   1    91   26   parsed_2m30   1   
         20   "N angles for residue 34"      96   1    96   26   parsed_2m30   1   
         21   "N angles for residue 35"     101   1   101   26   parsed_2m30   1   
         22   "N angles for residue 36"     106   1   106   26   parsed_2m30   1   
         23   "N angles for residue 37"     111   1   111   26   parsed_2m30   1   
         24   "N angles for residue 38"     116   1   116   26   parsed_2m30   1   
         25   "N angles for residue 40"     121   1   121   26   parsed_2m30   1   
         26   "N angles for residue 43"     126   1   126   26   parsed_2m30   1   
         27   "N angles for residue 44"     131   1   131   26   parsed_2m30   1   
         28   "N angles for residue 45"     136   1   136   26   parsed_2m30   1   
         29   "N angles for residue 47"     141   1   141   26   parsed_2m30   1   
         30   "N angles for residue 48"     146   1   146   26   parsed_2m30   1   
         31   "N angles for residue 49"     151   1   151   26   parsed_2m30   1   
         32   "N angles for residue 50"     156   1   156   26   parsed_2m30   1   
         33   "N angles for residue 52"     161   1   161   26   parsed_2m30   1   
         34   "N angles for residue 53"     166   1   166   26   parsed_2m30   1   
         35   "N angles for residue 54"     171   1   171   26   parsed_2m30   1   
         36   "N angles for residue 56"     176   1   176   26   parsed_2m30   1   
         37   "N angles for residue 60"     181   1   181   26   parsed_2m30   1   
         38   "N angles for residue 61"     186   1   186   26   parsed_2m30   1   
         39   "N angles for residue 62"     191   1   191   26   parsed_2m30   1   
         40   "N angles for residue 64"     196   1   196   26   parsed_2m30   1   
         41   "N angles for residue 65"     201   1   201   26   parsed_2m30   1   
         42   "N angles for residue 66"     206   1   206   26   parsed_2m30   1   
         43   "N angles for residue 68"     211   1   211   26   parsed_2m30   1   
         44   "N angles for residue 69"     216   1   216   26   parsed_2m30   1   
         45   "N angles for residue 70"     221   1   221   26   parsed_2m30   1   
         46   "N angles for residue 71"     226   1   226   26   parsed_2m30   1   
         47   "N angles for residue 72"     231   1   231   26   parsed_2m30   1   
         48   "N angles for residue 73"     236   1   236   26   parsed_2m30   1   
         49   "N angles for residue 74"     241   1   241   26   parsed_2m30   1   
         50   "N angles for residue 76"     246   1   246   26   parsed_2m30   1   
         51   "N angles for residue 77"     251   1   251   26   parsed_2m30   1   
         52   "N angles for residue 79"     256   1   256   26   parsed_2m30   1   
         53   "N angles for residue 80"     261   1   261   26   parsed_2m30   1   
         54   "N angles for residue 85"     266   1   266   26   parsed_2m30   1   
         55   "N angles for residue 86"     271   1   271   26   parsed_2m30   1   
         56   "N angles for residue 90"     276   1   276   26   parsed_2m30   1   
         57   "N angles for residue 97"     281   1   281   26   parsed_2m30   1   
         58   "N angles for residue 98"     286   1   286   26   parsed_2m30   1   
         59   "N angles for residue 101"    291   1   291   27   parsed_2m30   1   
         60   "N angles for residue 102"    296   1   296   27   parsed_2m30   1   
         61   "N angles for residue 105"    301   1   301   27   parsed_2m30   1   
         62   "N angles for residue 106"    306   1   306   27   parsed_2m30   1   
         63   "N angles for residue 108"    311   1   311   27   parsed_2m30   1   
         64   "N angles for residue 109"    316   1   316   27   parsed_2m30   1   
         65   "N angles for residue 110"    321   1   321   27   parsed_2m30   1   
         66   "N angles for residue 111"    326   1   326   27   parsed_2m30   1   
         67   "N angles for residue 113"    331   1   331   27   parsed_2m30   1   
         68   "N angles for residue 115"    336   1   336   27   parsed_2m30   1   
         69   "N angles for residue 117"    341   1   341   27   parsed_2m30   1   
         70   "N angles for residue 118"    346   1   346   27   parsed_2m30   1   
         71   "N angles for residue 120"    351   1   351   27   parsed_2m30   1   
         72   "N angles for residue 123"    356   1   356   27   parsed_2m30   1   
         73   "N angles for residue 125"    361   1   361   27   parsed_2m30   1   
         74   "N angles for residue 126"    366   1   366   27   parsed_2m30   1   
         75   "N angles for residue 128"    371   1   371   27   parsed_2m30   1   
         76   "N angles for residue 129"    376   1   376   27   parsed_2m30   1   
         77   "N angles for residue 130"    381   1   381   27   parsed_2m30   1   
         78   "N angles for residue 131"    386   1   386   27   parsed_2m30   1   
         79   "N angles for residue 132"    391   1   391   27   parsed_2m30   1   
         80   "N angles for residue 133"    396   1   396   27   parsed_2m30   1   
         81   "N angles for residue 135"    401   1   401   27   parsed_2m30   1   
         82   "N angles for residue 138"    406   1   406   27   parsed_2m30   1   
         83   "N angles for residue 139"    411   1   411   27   parsed_2m30   1   
         84   "N angles for residue 140"    416   1   416   27   parsed_2m30   1   
         85   "N angles for residue 142"    421   1   421   27   parsed_2m30   1   
         86   "N angles for residue 143"    426   1   426   27   parsed_2m30   1   
         87   "N angles for residue 144"    431   1   431   27   parsed_2m30   1   
         88   "N angles for residue 145"    436   1   436   27   parsed_2m30   1   
         89   "N angles for residue 147"    441   1   441   27   parsed_2m30   1   
         90   "N angles for residue 148"    446   1   446   27   parsed_2m30   1   
         91   "N angles for residue 149"    451   1   451   27   parsed_2m30   1   
         92   "N angles for residue 151"    456   1   456   27   parsed_2m30   1   
         93   "N angles for residue 155"    461   1   461   27   parsed_2m30   1   
         94   "N angles for residue 156"    466   1   466   27   parsed_2m30   1   
         95   "N angles for residue 157"    471   1   471   27   parsed_2m30   1   
         96   "N angles for residue 159"    476   1   476   27   parsed_2m30   1   
         97   "N angles for residue 160"    481   1   481   27   parsed_2m30   1   
         98   "N angles for residue 161"    486   1   486   27   parsed_2m30   1   
         99   "N angles for residue 163"    491   1   491   27   parsed_2m30   1   
        100   "N angles for residue 164"    496   1   496   27   parsed_2m30   1   
        101   "N angles for residue 165"    501   1   501   27   parsed_2m30   1   
        102   "N angles for residue 166"    506   1   506   27   parsed_2m30   1   
        103   "N angles for residue 167"    511   1   511   27   parsed_2m30   1   
        104   "N angles for residue 168"    516   1   516   27   parsed_2m30   1   
        105   "N angles for residue 169"    521   1   521   27   parsed_2m30   1   
        106   "N angles for residue 171"    526   1   526   27   parsed_2m30   1   
        107   "N angles for residue 172"    531   1   531   27   parsed_2m30   1   
        108   "N angles for residue 174"    536   1   536   27   parsed_2m30   1   
        109   "N angles for residue 175"    541   1   541   27   parsed_2m30   1   
        110   "N angles for residue 180"    546   1   546   27   parsed_2m30   1   
        111   "N angles for residue 181"    551   1   551   27   parsed_2m30   1   
        112   "N angles for residue 185"    556   1   556   27   parsed_2m30   1   
    stop_

save_





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