NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | in_recoord | stage | program | type | subtype | subsubtype | item_count |
33983 | 1j7r | cing | recoord | 2-parsed | STAR | distance | hydrogen bond | simple | 64 |
data_1j7r_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_1j7r _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_1j7r 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_1j7r _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 1j7r "Master copy" parsed_1j7r stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_1j7r _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 1j7r.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1j7r 1 1 1j7r.mr . . DISCOVER 2 stereochemistry chirality "Not applicable" 0 parsed_1j7r 1 1 1j7r.mr . . DISCOVER 3 distance "hydrogen bond" simple 64 parsed_1j7r 1 1 1j7r.mr . . DISCOVER 4 distance NOE simple 0 parsed_1j7r 1 1 1j7r.mr . . n/a 5 comment "Not applicable" "Not applicable" 0 parsed_1j7r 1 1 1j7r.mr . . DISCOVER 6 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1j7r 1 1 1j7r.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1j7r 1 stop_ save_ save_Discover_distance_constraints_3 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_1j7r _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_1j7r 1 2 1 . . . parsed_1j7r 1 3 1 . . . parsed_1j7r 1 4 1 . . . parsed_1j7r 1 5 1 . . . parsed_1j7r 1 6 1 . . . parsed_1j7r 1 7 1 . . . parsed_1j7r 1 8 1 . . . parsed_1j7r 1 9 1 . . . parsed_1j7r 1 10 1 . . . parsed_1j7r 1 11 1 . . . parsed_1j7r 1 12 1 . . . parsed_1j7r 1 13 1 . . . parsed_1j7r 1 14 1 . . . parsed_1j7r 1 15 1 . . . parsed_1j7r 1 16 1 . . . parsed_1j7r 1 17 1 . . . parsed_1j7r 1 18 1 . . . parsed_1j7r 1 19 1 . . . parsed_1j7r 1 20 1 . . . parsed_1j7r 1 21 1 . . . parsed_1j7r 1 22 1 . . . parsed_1j7r 1 23 1 . . . parsed_1j7r 1 24 1 . . . parsed_1j7r 1 25 1 . . . parsed_1j7r 1 26 1 . . . parsed_1j7r 1 27 1 . . . parsed_1j7r 1 28 1 . . . parsed_1j7r 1 29 1 . . . parsed_1j7r 1 30 1 . . . parsed_1j7r 1 31 1 . . . parsed_1j7r 1 32 1 . . . parsed_1j7r 1 33 1 . . . parsed_1j7r 1 34 1 . . . parsed_1j7r 1 35 1 . . . parsed_1j7r 1 36 1 . . . parsed_1j7r 1 37 1 . . . parsed_1j7r 1 38 1 . . . parsed_1j7r 1 39 1 . . . parsed_1j7r 1 40 1 . . . parsed_1j7r 1 41 1 . . . parsed_1j7r 1 42 1 . . . parsed_1j7r 1 43 1 . . . parsed_1j7r 1 44 1 . . . parsed_1j7r 1 45 1 . . . parsed_1j7r 1 46 1 . . . parsed_1j7r 1 47 1 . . . parsed_1j7r 1 48 1 . . . parsed_1j7r 1 49 1 . . . parsed_1j7r 1 50 1 . . . parsed_1j7r 1 51 1 . . . parsed_1j7r 1 52 1 . . . parsed_1j7r 1 53 1 . . . parsed_1j7r 1 54 1 . . . parsed_1j7r 1 55 1 . . . parsed_1j7r 1 56 1 . . . parsed_1j7r 1 57 1 . . . parsed_1j7r 1 58 1 . . . parsed_1j7r 1 59 1 . . . parsed_1j7r 1 60 1 . . . parsed_1j7r 1 61 1 . . . parsed_1j7r 1 62 1 . . . parsed_1j7r 1 63 1 . . . parsed_1j7r 1 64 1 . . . parsed_1j7r 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 . . . . . . . . 1 24 ASP- OD* parsed_1j7r 1 1 1 2 . . . . . . . . 1 29 ASN HN parsed_1j7r 1 2 1 1 . . . . . . . . 1 24 ASP- OD* parsed_1j7r 1 2 1 2 . . . . . . . . 1 29 ASN N parsed_1j7r 1 3 1 1 . . . . . . . . 1 31 ALA O parsed_1j7r 1 3 1 2 . . . . . . . . 1 69 ILE HN parsed_1j7r 1 4 1 1 . . . . . . . . 1 31 ALA O parsed_1j7r 1 4 1 2 . . . . . . . . 1 69 ILE N parsed_1j7r 1 5 1 1 . . . . . . . . 1 69 ILE O parsed_1j7r 1 5 1 2 . . . . . . . . 1 31 ALA HN parsed_1j7r 1 6 1 1 . . . . . . . . 1 69 ILE O parsed_1j7r 1 6 1 2 . . . . . . . . 1 31 ALA N parsed_1j7r 1 7 1 1 . . . . . . . . 1 11 GLU- O parsed_1j7r 1 7 1 2 . . . . . . . . 1 15 GLU- HN parsed_1j7r 1 8 1 1 . . . . . . . . 1 11 GLU- O parsed_1j7r 1 8 1 2 . . . . . . . . 1 15 GLU- N parsed_1j7r 1 9 1 1 . . . . . . . . 1 12 GLU- O parsed_1j7r 1 9 1 2 . . . . . . . . 1 16 CYSH HN parsed_1j7r 1 10 1 1 . . . . . . . . 1 12 GLU- O parsed_1j7r 1 10 1 2 . . . . . . . . 1 16 CYSH N parsed_1j7r 1 11 1 1 . . . . . . . . 1 13 LYS+ O parsed_1j7r 1 11 1 2 . . . . . . . . 1 17 MET HN parsed_1j7r 1 12 1 1 . . . . . . . . 1 13 LYS+ O parsed_1j7r 1 12 1 2 . . . . . . . . 1 17 MET N parsed_1j7r 1 13 1 1 . . . . . . . . 1 14 ASP- O parsed_1j7r 1 13 1 2 . . . . . . . . 1 18 LYS+ HN parsed_1j7r 1 14 1 1 . . . . . . . . 1 14 ASP- O parsed_1j7r 1 14 1 2 . . . . . . . . 1 18 LYS+ N parsed_1j7r 1 15 1 1 . . . . . . . . 1 15 GLU- O parsed_1j7r 1 15 1 2 . . . . . . . . 1 19 ILE HN parsed_1j7r 1 16 1 1 . . . . . . . . 1 15 GLU- O parsed_1j7r 1 16 1 2 . . . . . . . . 1 19 ILE N parsed_1j7r 1 17 1 1 . . . . . . . . 1 16 CYSH O parsed_1j7r 1 17 1 2 . . . . . . . . 1 20 PHE HN parsed_1j7r 1 18 1 1 . . . . . . . . 1 16 CYSH O parsed_1j7r 1 18 1 2 . . . . . . . . 1 20 PHE N parsed_1j7r 1 19 1 1 . . . . . . . . 1 17 MET O parsed_1j7r 1 19 1 2 . . . . . . . . 1 21 ASP- HN parsed_1j7r 1 20 1 1 . . . . . . . . 1 17 MET O parsed_1j7r 1 20 1 2 . . . . . . . . 1 21 ASP- N parsed_1j7r 1 21 1 1 . . . . . . . . 1 18 LYS+ O parsed_1j7r 1 21 1 2 . . . . . . . . 1 22 ILE HN parsed_1j7r 1 22 1 1 . . . . . . . . 1 18 LYS+ O parsed_1j7r 1 22 1 2 . . . . . . . . 1 22 ILE N parsed_1j7r 1 23 1 1 . . . . . . . . 1 19 ILE O parsed_1j7r 1 23 1 2 . . . . . . . . 1 23 PHE HN parsed_1j7r 1 24 1 1 . . . . . . . . 1 19 ILE O parsed_1j7r 1 24 1 2 . . . . . . . . 1 23 PHE N parsed_1j7r 1 25 1 1 . . . . . . . . 1 33 VAL O parsed_1j7r 1 25 1 2 . . . . . . . . 1 37 MET HN parsed_1j7r 1 26 1 1 . . . . . . . . 1 33 VAL O parsed_1j7r 1 26 1 2 . . . . . . . . 1 37 MET N parsed_1j7r 1 27 1 1 . . . . . . . . 1 34 SER O parsed_1j7r 1 27 1 2 . . . . . . . . 1 38 ASP- HN parsed_1j7r 1 28 1 1 . . . . . . . . 1 34 SER O parsed_1j7r 1 28 1 2 . . . . . . . . 1 38 ASP- N parsed_1j7r 1 29 1 1 . . . . . . . . 1 35 ASP- O parsed_1j7r 1 29 1 2 . . . . . . . . 1 39 MET HN parsed_1j7r 1 30 1 1 . . . . . . . . 1 35 ASP- O parsed_1j7r 1 30 1 2 . . . . . . . . 1 39 MET N parsed_1j7r 1 31 1 1 . . . . . . . . 1 36 THR O parsed_1j7r 1 31 1 2 . . . . . . . . 1 40 LEU HN parsed_1j7r 1 32 1 1 . . . . . . . . 1 36 THR O parsed_1j7r 1 32 1 2 . . . . . . . . 1 40 LEU N parsed_1j7r 1 33 1 1 . . . . . . . . 1 37 MET O parsed_1j7r 1 33 1 2 . . . . . . . . 1 41 THR HN parsed_1j7r 1 34 1 1 . . . . . . . . 1 37 MET O parsed_1j7r 1 34 1 2 . . . . . . . . 1 41 THR N parsed_1j7r 1 35 1 1 . . . . . . . . 1 38 ASP- O parsed_1j7r 1 35 1 2 . . . . . . . . 1 42 LYS+ HN parsed_1j7r 1 36 1 1 . . . . . . . . 1 38 ASP- O parsed_1j7r 1 36 1 2 . . . . . . . . 1 42 LYS+ N parsed_1j7r 1 37 1 1 . . . . . . . . 1 50 ARG+ O parsed_1j7r 1 37 1 2 . . . . . . . . 1 54 ALA HN parsed_1j7r 1 38 1 1 . . . . . . . . 1 50 ARG+ O parsed_1j7r 1 38 1 2 . . . . . . . . 1 54 ALA N parsed_1j7r 1 39 1 1 . . . . . . . . 1 51 GLU- O parsed_1j7r 1 39 1 2 . . . . . . . . 1 55 ILE HN parsed_1j7r 1 40 1 1 . . . . . . . . 1 51 GLU- O parsed_1j7r 1 40 1 2 . . . . . . . . 1 55 ILE N parsed_1j7r 1 41 1 1 . . . . . . . . 1 52 THR O parsed_1j7r 1 41 1 2 . . . . . . . . 1 56 MET HN parsed_1j7r 1 42 1 1 . . . . . . . . 1 52 THR O parsed_1j7r 1 42 1 2 . . . . . . . . 1 56 MET N parsed_1j7r 1 43 1 1 . . . . . . . . 1 53 GLU- O parsed_1j7r 1 43 1 2 . . . . . . . . 1 57 LYS+ HN parsed_1j7r 1 44 1 1 . . . . . . . . 1 53 GLU- O parsed_1j7r 1 44 1 2 . . . . . . . . 1 57 LYS+ N parsed_1j7r 1 45 1 1 . . . . . . . . 1 54 ALA O parsed_1j7r 1 45 1 2 . . . . . . . . 1 58 GLU- HN parsed_1j7r 1 46 1 1 . . . . . . . . 1 54 ALA O parsed_1j7r 1 46 1 2 . . . . . . . . 1 58 GLU- N parsed_1j7r 1 47 1 1 . . . . . . . . 1 55 ILE O parsed_1j7r 1 47 1 2 . . . . . . . . 1 59 ALA HN parsed_1j7r 1 48 1 1 . . . . . . . . 1 55 ILE O parsed_1j7r 1 48 1 2 . . . . . . . . 1 59 ALA N parsed_1j7r 1 49 1 1 . . . . . . . . 1 72 GLU- O parsed_1j7r 1 49 1 2 . . . . . . . . 1 76 THR HN parsed_1j7r 1 50 1 1 . . . . . . . . 1 72 GLU- O parsed_1j7r 1 50 1 2 . . . . . . . . 1 76 THR N parsed_1j7r 1 51 1 1 . . . . . . . . 1 73 GLU- O parsed_1j7r 1 51 1 2 . . . . . . . . 1 77 LEU HN parsed_1j7r 1 52 1 1 . . . . . . . . 1 73 GLU- O parsed_1j7r 1 52 1 2 . . . . . . . . 1 77 LEU N parsed_1j7r 1 53 1 1 . . . . . . . . 1 74 TRP O parsed_1j7r 1 53 1 2 . . . . . . . . 1 78 CYSH HN parsed_1j7r 1 54 1 1 . . . . . . . . 1 74 TRP O parsed_1j7r 1 54 1 2 . . . . . . . . 1 78 CYSH N parsed_1j7r 1 55 1 1 . . . . . . . . 1 75 LEU O parsed_1j7r 1 55 1 2 . . . . . . . . 1 79 SER HN parsed_1j7r 1 56 1 1 . . . . . . . . 1 75 LEU O parsed_1j7r 1 56 1 2 . . . . . . . . 1 79 SER N parsed_1j7r 1 57 1 1 . . . . . . . . 1 76 THR O parsed_1j7r 1 57 1 2 . . . . . . . . 1 80 LYS+ HN parsed_1j7r 1 58 1 1 . . . . . . . . 1 76 THR O parsed_1j7r 1 58 1 2 . . . . . . . . 1 80 LYS+ N parsed_1j7r 1 59 1 1 . . . . . . . . 1 77 LEU O parsed_1j7r 1 59 1 2 . . . . . . . . 1 81 TRP HN parsed_1j7r 1 60 1 1 . . . . . . . . 1 77 LEU O parsed_1j7r 1 60 1 2 . . . . . . . . 1 81 TRP N parsed_1j7r 1 61 1 1 . . . . . . . . 1 78 CYSH O parsed_1j7r 1 61 1 2 . . . . . . . . 1 82 VAL HN parsed_1j7r 1 62 1 1 . . . . . . . . 1 78 CYSH O parsed_1j7r 1 62 1 2 . . . . . . . . 1 82 VAL N parsed_1j7r 1 63 1 1 . . . . . . . . 1 79 SER O parsed_1j7r 1 63 1 2 . . . . . . . . 1 83 ARG+ HN parsed_1j7r 1 64 1 1 . . . . . . . . 1 79 SER O parsed_1j7r 1 64 1 2 . . . . . . . . 1 83 ARG+ N parsed_1j7r 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 . . . . . . 1.800 2.300 parsed_1j7r 1 2 1 . . . . . . 2.800 3.300 parsed_1j7r 1 3 1 . . . . . . 1.800 2.000 parsed_1j7r 1 4 1 . . . . . . 2.700 3.000 parsed_1j7r 1 5 1 . . . . . . 1.800 2.000 parsed_1j7r 1 6 1 . . . . . . 2.700 3.000 parsed_1j7r 1 7 1 . . . . . . 1.800 2.000 parsed_1j7r 1 8 1 . . . . . . 2.700 3.000 parsed_1j7r 1 9 1 . . . . . . 1.800 2.000 parsed_1j7r 1 10 1 . . . . . . 2.700 3.000 parsed_1j7r 1 11 1 . . . . . . 1.800 2.000 parsed_1j7r 1 12 1 . . . . . . 2.700 3.000 parsed_1j7r 1 13 1 . . . . . . 1.800 2.000 parsed_1j7r 1 14 1 . . . . . . 2.700 3.000 parsed_1j7r 1 15 1 . . . . . . 1.800 2.000 parsed_1j7r 1 16 1 . . . . . . 2.700 3.000 parsed_1j7r 1 17 1 . . . . . . 1.800 2.000 parsed_1j7r 1 18 1 . . . . . . 2.700 3.000 parsed_1j7r 1 19 1 . . . . . . 1.800 2.000 parsed_1j7r 1 20 1 . . . . . . 2.700 3.000 parsed_1j7r 1 21 1 . . . . . . 1.800 2.000 parsed_1j7r 1 22 1 . . . . . . 2.700 3.000 parsed_1j7r 1 23 1 . . . . . . 1.800 2.000 parsed_1j7r 1 24 1 . . . . . . 2.700 3.000 parsed_1j7r 1 25 1 . . . . . . 1.800 2.000 parsed_1j7r 1 26 1 . . . . . . 2.700 3.000 parsed_1j7r 1 27 1 . . . . . . 1.800 2.000 parsed_1j7r 1 28 1 . . . . . . 2.700 3.000 parsed_1j7r 1 29 1 . . . . . . 1.800 2.000 parsed_1j7r 1 30 1 . . . . . . 2.700 3.000 parsed_1j7r 1 31 1 . . . . . . 1.800 2.000 parsed_1j7r 1 32 1 . . . . . . 2.700 3.000 parsed_1j7r 1 33 1 . . . . . . 1.800 2.000 parsed_1j7r 1 34 1 . . . . . . 2.700 3.000 parsed_1j7r 1 35 1 . . . . . . 1.800 2.000 parsed_1j7r 1 36 1 . . . . . . 2.700 3.000 parsed_1j7r 1 37 1 . . . . . . 1.800 2.000 parsed_1j7r 1 38 1 . . . . . . 2.700 3.000 parsed_1j7r 1 39 1 . . . . . . 1.800 2.000 parsed_1j7r 1 40 1 . . . . . . 2.700 3.000 parsed_1j7r 1 41 1 . . . . . . 1.800 2.000 parsed_1j7r 1 42 1 . . . . . . 2.700 3.000 parsed_1j7r 1 43 1 . . . . . . 1.800 2.000 parsed_1j7r 1 44 1 . . . . . . 2.700 3.000 parsed_1j7r 1 45 1 . . . . . . 1.800 2.000 parsed_1j7r 1 46 1 . . . . . . 2.700 3.000 parsed_1j7r 1 47 1 . . . . . . 1.800 2.000 parsed_1j7r 1 48 1 . . . . . . 2.700 3.000 parsed_1j7r 1 49 1 . . . . . . 1.800 2.000 parsed_1j7r 1 50 1 . . . . . . 2.700 3.000 parsed_1j7r 1 51 1 . . . . . . 1.800 2.000 parsed_1j7r 1 52 1 . . . . . . 2.700 3.000 parsed_1j7r 1 53 1 . . . . . . 1.800 2.000 parsed_1j7r 1 54 1 . . . . . . 2.700 3.000 parsed_1j7r 1 55 1 . . . . . . 1.800 2.000 parsed_1j7r 1 56 1 . . . . . . 2.700 3.000 parsed_1j7r 1 57 1 . . . . . . 1.800 2.000 parsed_1j7r 1 58 1 . . . . . . 2.700 3.000 parsed_1j7r 1 59 1 . . . . . . 1.800 2.000 parsed_1j7r 1 60 1 . . . . . . 2.700 3.000 parsed_1j7r 1 61 1 . . . . . . 1.800 2.000 parsed_1j7r 1 62 1 . . . . . . 2.700 3.000 parsed_1j7r 1 63 1 . . . . . . 1.800 2.000 parsed_1j7r 1 64 1 . . . . . . 2.700 3.000 parsed_1j7r 1 stop_ loop_ _Dist_constraint_comment_org.ID _Dist_constraint_comment_org.Comment_text _Dist_constraint_comment_org.Comment_begin_line _Dist_constraint_comment_org.Comment_begin_column _Dist_constraint_comment_org.Comment_end_line _Dist_constraint_comment_org.Comment_end_column _Dist_constraint_comment_org.Entry_ID _Dist_constraint_comment_org.Distance_constraint_list_ID 1 distance 1 1 1 9 parsed_1j7r 1 stop_ save_
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