NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
38067 | 1qrj | 4311 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 18 |
data_1qrj_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_1qrj _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_1qrj 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_1qrj _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 1qrj "Master copy" parsed_1qrj stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_1qrj _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 1qrj.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 2 distance NOE simple 62 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 3 distance "hydrogen bond" simple 16 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 4 distance NOE simple 158 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 5 distance "hydrogen bond" simple 18 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 6 distance NOE simple 0 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 7 distance "hydrogen bond" simple 0 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 8 distance NOE simple 0 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 9 distance "hydrogen bond" simple 0 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 10 distance NOE simple 0 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 11 distance "hydrogen bond" simple 0 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 12 distance NOE simple 0 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 13 distance "hydrogen bond" simple 0 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 14 distance NOE simple 0 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 15 distance "hydrogen bond" simple 0 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 16 distance NOE simple 0 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 17 distance "hydrogen bond" simple 0 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 18 distance NOE simple 0 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 19 distance "hydrogen bond" simple 0 parsed_1qrj 1 1 1qrj.mr . . DYANA/DIANA 20 distance NOE simple 0 parsed_1qrj 1 1 1qrj.mr . . "MR format" 21 comment "Not applicable" "Not applicable" 0 parsed_1qrj 1 1 1qrj.mr . . "MR format" 22 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1qrj 1 stop_ save_ save_DYANA/DIANA_distance_constraints_5 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_1qrj _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 5 _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_1qrj 1 2 1 . . . parsed_1qrj 1 3 1 . . . parsed_1qrj 1 4 1 . . . parsed_1qrj 1 5 1 . . . parsed_1qrj 1 6 1 . . . parsed_1qrj 1 7 1 . . . parsed_1qrj 1 8 1 . . . parsed_1qrj 1 9 1 . . . parsed_1qrj 1 10 1 . . . parsed_1qrj 1 11 1 . . . parsed_1qrj 1 12 1 . . . parsed_1qrj 1 13 1 . . . parsed_1qrj 1 14 1 . . . parsed_1qrj 1 15 1 . . . parsed_1qrj 1 16 1 . . . parsed_1qrj 1 17 1 . . . parsed_1qrj 1 18 1 . . . parsed_1qrj 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 . . . . . . . . . 36 GLN O parsed_1qrj 1 1 1 2 . . . . . . . . . 40 THR HN parsed_1qrj 1 2 1 1 . . . . . . . . . 36 GLN O parsed_1qrj 1 2 1 2 . . . . . . . . . 40 THR N parsed_1qrj 1 3 1 1 . . . . . . . . . 37 PHE O parsed_1qrj 1 3 1 2 . . . . . . . . . 41 ILE HN parsed_1qrj 1 4 1 1 . . . . . . . . . 37 PHE O parsed_1qrj 1 4 1 2 . . . . . . . . . 41 ILE N parsed_1qrj 1 5 1 1 . . . . . . . . . 38 MET O parsed_1qrj 1 5 1 2 . . . . . . . . . 42 ARG+ HN parsed_1qrj 1 6 1 1 . . . . . . . . . 38 MET O parsed_1qrj 1 6 1 2 . . . . . . . . . 42 ARG+ N parsed_1qrj 1 7 1 1 . . . . . . . . . 39 GLN O parsed_1qrj 1 7 1 2 . . . . . . . . . 43 LEU HN parsed_1qrj 1 8 1 1 . . . . . . . . . 39 GLN O parsed_1qrj 1 8 1 2 . . . . . . . . . 43 LEU N parsed_1qrj 1 9 1 1 . . . . . . . . . 40 THR O parsed_1qrj 1 9 1 2 . . . . . . . . . 44 ALA HN parsed_1qrj 1 10 1 1 . . . . . . . . . 40 THR O parsed_1qrj 1 10 1 2 . . . . . . . . . 44 ALA N parsed_1qrj 1 11 1 1 . . . . . . . . . 41 ILE O parsed_1qrj 1 11 1 2 . . . . . . . . . 45 VAL HN parsed_1qrj 1 12 1 1 . . . . . . . . . 41 ILE O parsed_1qrj 1 12 1 2 . . . . . . . . . 45 VAL N parsed_1qrj 1 13 1 1 . . . . . . . . . 42 ARG+ O parsed_1qrj 1 13 1 2 . . . . . . . . . 46 GLN HN parsed_1qrj 1 14 1 1 . . . . . . . . . 42 ARG+ O parsed_1qrj 1 14 1 2 . . . . . . . . . 46 GLN N parsed_1qrj 1 15 1 1 . . . . . . . . . 43 LEU O parsed_1qrj 1 15 1 2 . . . . . . . . . 47 GLN HN parsed_1qrj 1 16 1 1 . . . . . . . . . 43 LEU O parsed_1qrj 1 16 1 2 . . . . . . . . . 47 GLN N parsed_1qrj 1 17 1 1 . . . . . . . . . 44 ALA O parsed_1qrj 1 17 1 2 . . . . . . . . . 48 PHE HN parsed_1qrj 1 18 1 1 . . . . . . . . . 44 ALA O parsed_1qrj 1 18 1 2 . . . . . . . . . 48 PHE N parsed_1qrj 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 . . . . . . . 2.4 parsed_1qrj 1 2 1 . . . . . . . 3.2 parsed_1qrj 1 3 1 . . . . . . . 2.4 parsed_1qrj 1 4 1 . . . . . . . 3.2 parsed_1qrj 1 5 1 . . . . . . . 2.4 parsed_1qrj 1 6 1 . . . . . . . 3.2 parsed_1qrj 1 7 1 . . . . . . . 2.4 parsed_1qrj 1 8 1 . . . . . . . 3.2 parsed_1qrj 1 9 1 . . . . . . . 2.4 parsed_1qrj 1 10 1 . . . . . . . 3.2 parsed_1qrj 1 11 1 . . . . . . . 2.4 parsed_1qrj 1 12 1 . . . . . . . 3.2 parsed_1qrj 1 13 1 . . . . . . . 2.4 parsed_1qrj 1 14 1 . . . . . . . 3.2 parsed_1qrj 1 15 1 . . . . . . . 2.4 parsed_1qrj 1 16 1 . . . . . . . 3.2 parsed_1qrj 1 17 1 . . . . . . . 2.4 parsed_1qrj 1 18 1 . . . . . . . 3.2 parsed_1qrj 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 2&2-2&2-2&2-2&2-2&2-2&2-2&2-2&2-2&2-2&2-2&2-2&2-2&2% 1 1 1 53 parsed_1qrj 1 2 "~~~~~~~HELIX-II (36-48)~~~~~~~~~~" 2 1 2 34 parsed_1qrj 1 3 "##############################################" 3 1 3 48 parsed_1qrj 1 4 "No clear N-cap by CS, but OHS34 may Hbond to NH 37." 4 1 4 52 parsed_1qrj 1 5 "Maybe 49 NH H-bonds with 45 and PHI 49 is >0" 5 1 5 45 parsed_1qrj 1 6 "------------ H-bonds ------------------" 6 1 6 40 parsed_1qrj 1 7 "33 GLY O 37 PHE HN 2.4" 7 1 7 34 parsed_1qrj 1 8 "33 GLY O 37 PHE N 3.2" 8 1 8 32 parsed_1qrj 1 9 "34 SER O 38 MET HN 2.4" 9 1 9 33 parsed_1qrj 1 10 "34 SER O 38 MET N 3.2" 10 1 10 32 parsed_1qrj 1 11 "35 PRO O 39 GLN HN 2.4 #" 11 1 11 35 parsed_1qrj 1 12 "35 PRO O 39 GLN N 3.2 #" 12 1 12 34 parsed_1qrj 1 13 "45 VAL O 49 ASP- HN 2.4" 31 1 31 34 parsed_1qrj 1 14 "45 VAL O 49 ASP- N 3.2" 32 1 32 33 parsed_1qrj 1 stop_ save_
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