NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage program type subtype item_count
54492 2z59 cing 2-parsed STAR entry full 39


data_2z59_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2z59 
    _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_2z59   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2z59 
    _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   2z59   "Master copy"    parsed_2z59   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2z59 
    _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   2z59.mr   .   .   "MR format"    1    comment                  "Not applicable"      "Not applicable"     0   parsed_2z59   1   
        1   2z59.mr   .   .    HADDOCK       2    distance                 "general distance"     simple              0   parsed_2z59   1   
        1   2z59.mr   .   .    XPLOR/CNS     3    distance                 "hydrogen bond"        simple             27   parsed_2z59   1   
        1   2z59.mr   .   .    XPLOR/CNS     4    distance                  NOE                   simple             12   parsed_2z59   1   
        1   2z59.mr   .   .   "MR format"    5   "nomenclature mapping"    "Not applicable"      "Not applicable"     0   parsed_2z59   1   
    stop_

save_


save_MR_file_comment_1
    _Org_constr_file_comment.Sf_category         org_constr_file_comment 
    _Org_constr_file_comment.Entry_ID            parsed_2z59 
    _Org_constr_file_comment.ID                  1 
    _Org_constr_file_comment.Constraint_file_ID  1 
    _Org_constr_file_comment.Block_ID            1 
    _Org_constr_file_comment.Details            "Generated by Wattos" 
    _Org_constr_file_comment.Comment            
;
*HEADER    PROTEIN TRANSPORT                       01-JUL-07   2Z59              
*TITLE     COMPLEX STRUCTURES OF MOUSE RPN13 (22-130AA) AND UBIQUITIN            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROTEIN ADRM1;                                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RESIDUES 22-130;                                           
*COMPND   5 SYNONYM: PROTEASOME COMPONENT RPN13, ADHESION-REGULATING             
*COMPND   6 MOLECULE 1, 110 KDA CELL MEMBRANE GLYCOPROTEIN, GP110, ARM-          
*COMPND   7 1;                                                                   
*COMPND   8 ENGINEERED: YES;                                                     
*COMPND   9 MOL_ID: 2;                                                           
*COMPND  10 MOLECULE: UBIQUITIN;                                                 
*COMPND  11 CHAIN: B;                                                            
*COMPND  12 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
*SOURCE   3 ORGANISM_COMMON: MOUSE;                                              
*SOURCE   4 GENE: ADRM1;                                                         
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)PLYSS;                            
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PRSET;                                
*SOURCE   8 MOL_ID: 2;                                                           
*SOURCE   9 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE  10 ORGANISM_COMMON: HUMAN;                                              
*SOURCE  11 GENE: RPS27A, UBA80, UBCEP1;                                         
*SOURCE  12 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE  13 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE  14 EXPRESSION_SYSTEM_VECTOR_TYPE: PET                                   
*KEYWDS    PROTEASOME, NMR, PH DOMAIN, PROTEIN TRANSPORT                         
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    X.CHEN, P.SCHREINER, M.GROLL, K.J.WALTERS                             
*REVDAT   1   20-MAY-08 2Z59    0                                                


;

save_


save_CNS/XPLOR_distance_constraints_3
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_2z59 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type    "hydrogen bond" 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            3 
    _Distance_constraint_list.Details            "Generated by Wattos" 

    loop_
        _Dist_constraint_tree.Constraint_ID 
        _Dist_constraint_tree.Node_ID 
        _Dist_constraint_tree.Down_node_ID 
        _Dist_constraint_tree.Right_node_ID 
        _Dist_constraint_tree.Logic_operation 
        _Dist_constraint_tree.Entry_ID 
        _Dist_constraint_tree.Distance_constraint_list_ID 

         1   1   .   .   .   parsed_2z59   1   
         2   1   .   .   .   parsed_2z59   1   
         3   1   .   .   .   parsed_2z59   1   
         4   1   .   .   .   parsed_2z59   1   
         5   1   .   .   .   parsed_2z59   1   
         6   1   .   .   .   parsed_2z59   1   
         7   1   .   .   .   parsed_2z59   1   
         8   1   .   .   .   parsed_2z59   1   
         9   1   .   .   .   parsed_2z59   1   
        10   1   .   .   .   parsed_2z59   1   
        11   1   .   .   .   parsed_2z59   1   
        12   1   .   .   .   parsed_2z59   1   
        13   1   .   .   .   parsed_2z59   1   
        14   1   .   .   .   parsed_2z59   1   
        15   1   .   .   .   parsed_2z59   1   
        16   1   .   .   .   parsed_2z59   1   
        17   1   .   .   .   parsed_2z59   1   
        18   1   .   .   .   parsed_2z59   1   
        19   1   .   .   .   parsed_2z59   1   
        20   1   .   .   .   parsed_2z59   1   
        21   1   .   .   .   parsed_2z59   1   
        22   1   .   .   .   parsed_2z59   1   
        23   1   .   .   .   parsed_2z59   1   
        24   1   .   .   .   parsed_2z59   1   
        25   1   .   .   .   parsed_2z59   1   
        26   1   .   .   .   parsed_2z59   1   
        27   1   .   .   .   parsed_2z59   1   
    stop_


    loop_
        _Dist_constraint.Tree_node_member_constraint_ID 
        _Dist_constraint.Tree_node_member_node_ID 
        _Dist_constraint.Constraint_tree_node_member_ID 
        _Dist_constraint.Assembly_atom_ID 
        _Dist_constraint.Entity_assembly_ID 
        _Dist_constraint.Entity_ID 
        _Dist_constraint.Comp_index_ID 
        _Dist_constraint.Seq_ID 
        _Dist_constraint.Comp_ID 
        _Dist_constraint.Atom_ID 
        _Dist_constraint.Resonance_ID 
        _Dist_constraint.Auth_asym_ID 
        _Dist_constraint.Auth_seq_ID 
        _Dist_constraint.Auth_comp_ID 
        _Dist_constraint.Auth_atom_ID 
        _Dist_constraint.Entry_ID 
        _Dist_constraint.Distance_constraint_list_ID 

         1   1   1   .   .   .   .   .   .   .   .   B    3   .   N   parsed_2z59   1   
         1   1   2   .   .   .   .   .   .   .   .   B   15   .   O   parsed_2z59   1   
         2   1   1   .   .   .   .   .   .   .   .   B    4   .   N   parsed_2z59   1   
         2   1   2   .   .   .   .   .   .   .   .   B   65   .   O   parsed_2z59   1   
         3   1   1   .   .   .   .   .   .   .   .   B    6   .   N   parsed_2z59   1   
         3   1   2   .   .   .   .   .   .   .   .   B   67   .   O   parsed_2z59   1   
         4   1   1   .   .   .   .   .   .   .   .   B    7   .   N   parsed_2z59   1   
         4   1   2   .   .   .   .   .   .   .   .   B   11   .   O   parsed_2z59   1   
         5   1   1   .   .   .   .   .   .   .   .   B   13   .   N   parsed_2z59   1   
         5   1   2   .   .   .   .   .   .   .   .   B    5   .   O   parsed_2z59   1   
         6   1   1   .   .   .   .   .   .   .   .   B   15   .   N   parsed_2z59   1   
         6   1   2   .   .   .   .   .   .   .   .   B    3   .   O   parsed_2z59   1   
         7   1   1   .   .   .   .   .   .   .   .   B   23   .   N   parsed_2z59   1   
         7   1   2   .   .   .   .   .   .   .   .   B   54   .   O   parsed_2z59   1   
         8   1   1   .   .   .   .   .   .   .   .   B   26   .   N   parsed_2z59   1   
         8   1   2   .   .   .   .   .   .   .   .   B   22   .   O   parsed_2z59   1   
         9   1   1   .   .   .   .   .   .   .   .   B   27   .   N   parsed_2z59   1   
         9   1   2   .   .   .   .   .   .   .   .   B   23   .   O   parsed_2z59   1   
        10   1   1   .   .   .   .   .   .   .   .   B   28   .   N   parsed_2z59   1   
        10   1   2   .   .   .   .   .   .   .   .   B   24   .   O   parsed_2z59   1   
        11   1   1   .   .   .   .   .   .   .   .   B   29   .   N   parsed_2z59   1   
        11   1   2   .   .   .   .   .   .   .   .   B   25   .   O   parsed_2z59   1   
        12   1   1   .   .   .   .   .   .   .   .   B   30   .   N   parsed_2z59   1   
        12   1   2   .   .   .   .   .   .   .   .   B   26   .   O   parsed_2z59   1   
        13   1   1   .   .   .   .   .   .   .   .   B   31   .   N   parsed_2z59   1   
        13   1   2   .   .   .   .   .   .   .   .   B   27   .   O   parsed_2z59   1   
        14   1   1   .   .   .   .   .   .   .   .   B   32   .   N   parsed_2z59   1   
        14   1   2   .   .   .   .   .   .   .   .   B   28   .   O   parsed_2z59   1   
        15   1   1   .   .   .   .   .   .   .   .   B   33   .   N   parsed_2z59   1   
        15   1   2   .   .   .   .   .   .   .   .   B   29   .   O   parsed_2z59   1   
        16   1   1   .   .   .   .   .   .   .   .   B   34   .   N   parsed_2z59   1   
        16   1   2   .   .   .   .   .   .   .   .   B   30   .   O   parsed_2z59   1   
        17   1   1   .   .   .   .   .   .   .   .   B   42   .   N   parsed_2z59   1   
        17   1   2   .   .   .   .   .   .   .   .   B   70   .   O   parsed_2z59   1   
        18   1   1   .   .   .   .   .   .   .   .   B   44   .   N   parsed_2z59   1   
        18   1   2   .   .   .   .   .   .   .   .   B   68   .   O   parsed_2z59   1   
        19   1   1   .   .   .   .   .   .   .   .   B   45   .   N   parsed_2z59   1   
        19   1   2   .   .   .   .   .   .   .   .   B   48   .   O   parsed_2z59   1   
        20   1   1   .   .   .   .   .   .   .   .   B   50   .   N   parsed_2z59   1   
        20   1   2   .   .   .   .   .   .   .   .   B   43   .   O   parsed_2z59   1   
        21   1   1   .   .   .   .   .   .   .   .   B   56   .   N   parsed_2z59   1   
        21   1   2   .   .   .   .   .   .   .   .   B   21   .   O   parsed_2z59   1   
        22   1   1   .   .   .   .   .   .   .   .   B   57   .   N   parsed_2z59   1   
        22   1   2   .   .   .   .   .   .   .   .   B   19   .   O   parsed_2z59   1   
        23   1   1   .   .   .   .   .   .   .   .   B   64   .   N   parsed_2z59   1   
        23   1   2   .   .   .   .   .   .   .   .   B    2   .   O   parsed_2z59   1   
        24   1   1   .   .   .   .   .   .   .   .   B   67   .   N   parsed_2z59   1   
        24   1   2   .   .   .   .   .   .   .   .   B    4   .   O   parsed_2z59   1   
        25   1   1   .   .   .   .   .   .   .   .   B   68   .   N   parsed_2z59   1   
        25   1   2   .   .   .   .   .   .   .   .   B   44   .   O   parsed_2z59   1   
        26   1   1   .   .   .   .   .   .   .   .   B   69   .   N   parsed_2z59   1   
        26   1   2   .   .   .   .   .   .   .   .   B    6   .   O   parsed_2z59   1   
        27   1   1   .   .   .   .   .   .   .   .   B   70   .   N   parsed_2z59   1   
        27   1   2   .   .   .   .   .   .   .   .   B   42   .   O   parsed_2z59   1   
    stop_


    loop_
        _Dist_constraint_value.Constraint_ID 
        _Dist_constraint_value.Tree_node_ID 
        _Dist_constraint_value.Source_experiment_ID 
        _Dist_constraint_value.Spectral_peak_ID 
        _Dist_constraint_value.Intensity_val 
        _Dist_constraint_value.Intensity_lower_val_err 
        _Dist_constraint_value.Intensity_upper_val_err 
        _Dist_constraint_value.Distance_val 
        _Dist_constraint_value.Distance_lower_bound_val 
        _Dist_constraint_value.Distance_upper_bound_val 
        _Dist_constraint_value.Entry_ID 
        _Dist_constraint_value.Distance_constraint_list_ID 

         1   1   .   .   .   .   .   2.96   2.96   2.96   parsed_2z59   1   
         2   1   .   .   .   .   .   2.90   2.90   2.90   parsed_2z59   1   
         3   1   .   .   .   .   .   2.89   2.89   2.89   parsed_2z59   1   
         4   1   .   .   .   .   .   2.89   2.89   2.89   parsed_2z59   1   
         5   1   .   .   .   .   .   2.85   2.85   2.85   parsed_2z59   1   
         6   1   .   .   .   .   .   2.86   2.86   2.86   parsed_2z59   1   
         7   1   .   .   .   .   .   2.90   2.90   2.90   parsed_2z59   1   
         8   1   .   .   .   .   .   3.08   3.08   3.08   parsed_2z59   1   
         9   1   .   .   .   .   .   2.93   2.93   2.93   parsed_2z59   1   
        10   1   .   .   .   .   .   3.10   3.10   3.10   parsed_2z59   1   
        11   1   .   .   .   .   .   3.09   3.09   3.09   parsed_2z59   1   
        12   1   .   .   .   .   .   3.00   3.00   3.00   parsed_2z59   1   
        13   1   .   .   .   .   .   2.99   2.99   2.99   parsed_2z59   1   
        14   1   .   .   .   .   .   3.07   3.07   3.07   parsed_2z59   1   
        15   1   .   .   .   .   .   3.13   3.13   3.13   parsed_2z59   1   
        16   1   .   .   .   .   .   2.85   2.85   2.85   parsed_2z59   1   
        17   1   .   .   .   .   .   2.92   2.92   2.92   parsed_2z59   1   
        18   1   .   .   .   .   .   2.88   2.88   2.88   parsed_2z59   1   
        19   1   .   .   .   .   .   2.91   2.91   2.91   parsed_2z59   1   
        20   1   .   .   .   .   .   2.88   2.88   2.88   parsed_2z59   1   
        21   1   .   .   .   .   .   2.91   2.91   2.91   parsed_2z59   1   
        22   1   .   .   .   .   .   2.98   2.98   2.98   parsed_2z59   1   
        23   1   .   .   .   .   .   2.81   2.81   2.81   parsed_2z59   1   
        24   1   .   .   .   .   .   2.86   2.86   2.86   parsed_2z59   1   
        25   1   .   .   .   .   .   2.87   2.87   2.87   parsed_2z59   1   
        26   1   .   .   .   .   .   2.92   2.92   2.92   parsed_2z59   1   
        27   1   .   .   .   .   .   2.88   2.88   2.88   parsed_2z59   1   
    stop_

save_


save_CNS/XPLOR_distance_constraints_4
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_2z59 
    _Distance_constraint_list.ID                  2 
    _Distance_constraint_list.Constraint_type     NOE 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            4 
    _Distance_constraint_list.Details            "Generated by Wattos" 

    loop_
        _Dist_constraint_tree.Constraint_ID 
        _Dist_constraint_tree.Node_ID 
        _Dist_constraint_tree.Down_node_ID 
        _Dist_constraint_tree.Right_node_ID 
        _Dist_constraint_tree.Logic_operation 
        _Dist_constraint_tree.Entry_ID 
        _Dist_constraint_tree.Distance_constraint_list_ID 

         1   1   .   .   .   parsed_2z59   2   
         2   1   .   .   .   parsed_2z59   2   
         3   1   .   .   .   parsed_2z59   2   
         4   1   .   .   .   parsed_2z59   2   
         5   1   .   .   .   parsed_2z59   2   
         6   1   .   .   .   parsed_2z59   2   
         7   1   .   .   .   parsed_2z59   2   
         8   1   .   .   .   parsed_2z59   2   
         9   1   .   .   .   parsed_2z59   2   
        10   1   .   .   .   parsed_2z59   2   
        11   1   .   .   .   parsed_2z59   2   
        12   1   .   .   .   parsed_2z59   2   
    stop_


    loop_
        _Dist_constraint.Tree_node_member_constraint_ID 
        _Dist_constraint.Tree_node_member_node_ID 
        _Dist_constraint.Constraint_tree_node_member_ID 
        _Dist_constraint.Assembly_atom_ID 
        _Dist_constraint.Entity_assembly_ID 
        _Dist_constraint.Entity_ID 
        _Dist_constraint.Comp_index_ID 
        _Dist_constraint.Seq_ID 
        _Dist_constraint.Comp_ID 
        _Dist_constraint.Atom_ID 
        _Dist_constraint.Resonance_ID 
        _Dist_constraint.Auth_asym_ID 
        _Dist_constraint.Auth_seq_ID 
        _Dist_constraint.Auth_comp_ID 
        _Dist_constraint.Auth_atom_ID 
        _Dist_constraint.Entry_ID 
        _Dist_constraint.Distance_constraint_list_ID 

         1   1   1   .   .   .   .   .   .   .   .   A    76   .   HN     parsed_2z59   2   
         1   1   2   .   .   .   .   .   .   .   .   B    49   .   HG#    parsed_2z59   2   
         2   1   1   .   .   .   .   .   .   .   .   A    78   .   HN     parsed_2z59   2   
         2   1   2   .   .   .   .   .   .   .   .   B    70   .   HG2#   parsed_2z59   2   
         3   1   1   .   .   .   .   .   .   .   .   A    79   .   HN     parsed_2z59   2   
         3   1   2   .   .   .   .   .   .   .   .   B     8   .   HD2#   parsed_2z59   2   
         4   1   1   .   .   .   .   .   .   .   .   A    79   .   HN     parsed_2z59   2   
         4   1   2   .   .   .   .   .   .   .   .   B    68   .   HE1    parsed_2z59   2   
         5   1   1   .   .   .   .   .   .   .   .   A    98   .   HN     parsed_2z59   2   
         5   1   2   .   .   .   .   .   .   .   .   B    46   .   HB#    parsed_2z59   2   
         6   1   1   .   .   .   .   .   .   .   .   A   100   .   HN     parsed_2z59   2   
         6   1   2   .   .   .   .   .   .   .   .   B    46   .   HB#    parsed_2z59   2   
         7   1   1   .   .   .   .   .   .   .   .   A   100   .   HN     parsed_2z59   2   
         7   1   2   .   .   .   .   .   .   .   .   B    46   .   HA     parsed_2z59   2   
         8   1   1   .   .   .   .   .   .   .   .   A   101   .   HN     parsed_2z59   2   
         8   1   2   .   .   .   .   .   .   .   .   B    46   .   HB#    parsed_2z59   2   
         9   1   1   .   .   .   .   .   .   .   .   A   101   .   HN     parsed_2z59   2   
         9   1   2   .   .   .   .   .   .   .   .   B    45   .   HD#    parsed_2z59   2   
        10   1   1   .   .   .   .   .   .   .   .   A   101   .   HN     parsed_2z59   2   
        10   1   2   .   .   .   .   .   .   .   .   B    45   .   HE#    parsed_2z59   2   
        11   1   1   .   .   .   .   .   .   .   .   A   103   .   HN     parsed_2z59   2   
        11   1   2   .   .   .   .   .   .   .   .   B    46   .   HB#    parsed_2z59   2   
        12   1   1   .   .   .   .   .   .   .   .   A   104   .   HN     parsed_2z59   2   
        12   1   2   .   .   .   .   .   .   .   .   B    46   .   HB#    parsed_2z59   2   
    stop_


    loop_
        _Dist_constraint_value.Constraint_ID 
        _Dist_constraint_value.Tree_node_ID 
        _Dist_constraint_value.Source_experiment_ID 
        _Dist_constraint_value.Spectral_peak_ID 
        _Dist_constraint_value.Intensity_val 
        _Dist_constraint_value.Intensity_lower_val_err 
        _Dist_constraint_value.Intensity_upper_val_err 
        _Dist_constraint_value.Distance_val 
        _Dist_constraint_value.Distance_lower_bound_val 
        _Dist_constraint_value.Distance_upper_bound_val 
        _Dist_constraint_value.Entry_ID 
        _Dist_constraint_value.Distance_constraint_list_ID 

         1   1   .   .   .   .   .   6.00   1.80   6.50   parsed_2z59   2   
         2   1   .   .   .   .   .   6.00   1.80   6.50   parsed_2z59   2   
         3   1   .   .   .   .   .   6.00   1.80   6.50   parsed_2z59   2   
         4   1   .   .   .   .   .   6.00   1.80   6.50   parsed_2z59   2   
         5   1   .   .   .   .   .   6.00   1.80   6.50   parsed_2z59   2   
         6   1   .   .   .   .   .   6.00   1.80   6.50   parsed_2z59   2   
         7   1   .   .   .   .   .   6.00   1.80   6.50   parsed_2z59   2   
         8   1   .   .   .   .   .   6.00   1.80   6.50   parsed_2z59   2   
         9   1   .   .   .   .   .   6.00   1.80   6.50   parsed_2z59   2   
        10   1   .   .   .   .   .   6.00   1.80   6.50   parsed_2z59   2   
        11   1   .   .   .   .   .   6.00   1.80   6.50   parsed_2z59   2   
        12   1   .   .   .   .   .   6.00   1.80   6.50   parsed_2z59   2   
    stop_

save_





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