NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
535295 | 2led | 17708 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 47 |
data_2led_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_2led _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_2led 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_2led _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 2led "Master copy" parsed_2led stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_2led _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 2led.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2led 1 1 2led.mr . . AMBER 2 distance NOE simple 667 parsed_2led 1 1 2led.mr . . AMBER 3 distance "hydrogen bond" simple 47 parsed_2led 1 1 2led.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2led 1 stop_ save_ save_AMBER_distance_constraints_3 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_2led _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_2led 1 2 1 . . . parsed_2led 1 3 1 . . . parsed_2led 1 4 1 . . . parsed_2led 1 5 1 . . . parsed_2led 1 6 1 . . . parsed_2led 1 7 1 . . . parsed_2led 1 8 1 . . . parsed_2led 1 9 1 . . . parsed_2led 1 10 1 . . . parsed_2led 1 11 1 . . . parsed_2led 1 12 1 . . . parsed_2led 1 13 1 . . . parsed_2led 1 14 1 . . . parsed_2led 1 15 1 . . . parsed_2led 1 16 1 . . . parsed_2led 1 17 1 . . . parsed_2led 1 18 1 . . . parsed_2led 1 19 1 . . . parsed_2led 1 20 1 . . . parsed_2led 1 21 1 . . . parsed_2led 1 22 1 . . . parsed_2led 1 23 1 . . . parsed_2led 1 24 1 . . . parsed_2led 1 25 1 . . . parsed_2led 1 26 1 . . . parsed_2led 1 27 1 . . . parsed_2led 1 28 1 . . . parsed_2led 1 29 1 . . . parsed_2led 1 30 1 . . . parsed_2led 1 31 1 . . . parsed_2led 1 32 1 . . . parsed_2led 1 33 1 . . . parsed_2led 1 34 1 . . . parsed_2led 1 35 1 . . . parsed_2led 1 36 1 . . . parsed_2led 1 37 1 . . . parsed_2led 1 38 1 . . . parsed_2led 1 39 1 . . . parsed_2led 1 40 1 . . . parsed_2led 1 41 1 . . . parsed_2led 1 42 1 . . . parsed_2led 1 43 1 . . . parsed_2led 1 44 1 . . . parsed_2led 1 45 1 . . . parsed_2led 1 46 1 . . . parsed_2led 1 47 1 . . . parsed_2led 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 . . . . . . . . 2led_ambr001 3 DG O6 parsed_2led 1 1 1 2 . . . . . . . . 2led_ambr002 7 DG H1 parsed_2led 1 2 1 1 . . . . . . . . 2led_ambr001 3 DG N7 parsed_2led 1 2 1 2 . . . . . . . . 2led_ambr002 7 DG H21 parsed_2led 1 3 1 1 . . . . . . . . 2led_ambr001 7 DG O6 parsed_2led 1 3 1 2 . . . . . . . . 2led_ambr001 3 DG H1 parsed_2led 1 4 1 1 . . . . . . . . 2led_ambr001 7 DG N7 parsed_2led 1 4 1 2 . . . . . . . . 2led_ambr001 3 DG H21 parsed_2led 1 5 1 1 . . . . . . . . 2led_ambr002 3 DG O6 parsed_2led 1 5 1 2 . . . . . . . . 2led_ambr001 7 DG H1 parsed_2led 1 6 1 1 . . . . . . . . 2led_ambr002 3 DG N7 parsed_2led 1 6 1 2 . . . . . . . . 2led_ambr001 7 DG H21 parsed_2led 1 7 1 1 . . . . . . . . 2led_ambr002 7 DG O6 parsed_2led 1 7 1 2 . . . . . . . . 2led_ambr002 3 DG H1 parsed_2led 1 8 1 1 . . . . . . . . 2led_ambr002 7 DG N7 parsed_2led 1 8 1 2 . . . . . . . . 2led_ambr002 3 DG H21 parsed_2led 1 9 1 1 . . . . . . . . 2led_ambr001 4 DG O6 parsed_2led 1 9 1 2 . . . . . . . . 2led_ambr002 8 DG H1 parsed_2led 1 10 1 1 . . . . . . . . 2led_ambr001 4 DG N7 parsed_2led 1 10 1 2 . . . . . . . . 2led_ambr002 8 DG H21 parsed_2led 1 11 1 1 . . . . . . . . 2led_ambr001 8 DG O6 parsed_2led 1 11 1 2 . . . . . . . . 2led_ambr001 4 DG H1 parsed_2led 1 12 1 1 . . . . . . . . 2led_ambr001 8 DG N7 parsed_2led 1 12 1 2 . . . . . . . . 2led_ambr001 4 DG H21 parsed_2led 1 13 1 1 . . . . . . . . 2led_ambr002 4 DG O6 parsed_2led 1 13 1 2 . . . . . . . . 2led_ambr001 8 DG H1 parsed_2led 1 14 1 1 . . . . . . . . 2led_ambr002 4 DG N7 parsed_2led 1 14 1 2 . . . . . . . . 2led_ambr001 8 DG H21 parsed_2led 1 15 1 1 . . . . . . . . 2led_ambr002 8 DG O6 parsed_2led 1 15 1 2 . . . . . . . . 2led_ambr002 4 DG H1 parsed_2led 1 16 1 1 . . . . . . . . 2led_ambr002 8 DG N7 parsed_2led 1 16 1 2 . . . . . . . . 2led_ambr002 4 DG H21 parsed_2led 1 17 1 1 . . . . . . . . 2led_ambr001 5 DG O6 parsed_2led 1 17 1 2 . . . . . . . . 2led_ambr002 9 DG H1 parsed_2led 1 18 1 1 . . . . . . . . 2led_ambr001 5 DG N7 parsed_2led 1 18 1 2 . . . . . . . . 2led_ambr002 9 DG H21 parsed_2led 1 19 1 1 . . . . . . . . 2led_ambr001 9 DG O6 parsed_2led 1 19 1 2 . . . . . . . . 2led_ambr001 5 DG H1 parsed_2led 1 20 1 1 . . . . . . . . 2led_ambr001 9 DG N7 parsed_2led 1 20 1 2 . . . . . . . . 2led_ambr001 5 DG H21 parsed_2led 1 21 1 1 . . . . . . . . 2led_ambr002 5 DG O6 parsed_2led 1 21 1 2 . . . . . . . . 2led_ambr001 9 DG H1 parsed_2led 1 22 1 1 . . . . . . . . 2led_ambr002 5 DG N7 parsed_2led 1 22 1 2 . . . . . . . . 2led_ambr001 9 DG H21 parsed_2led 1 23 1 1 . . . . . . . . 2led_ambr002 9 DG O6 parsed_2led 1 23 1 2 . . . . . . . . 2led_ambr002 5 DG H1 parsed_2led 1 24 1 1 . . . . . . . . 2led_ambr002 9 DG N7 parsed_2led 1 24 1 2 . . . . . . . . 2led_ambr002 5 DG H21 parsed_2led 1 25 1 1 . . . . . . . . 2led_ambr002 15 DG O6 parsed_2led 1 25 1 2 . . . . . . . . 2led_ambr002 11 DG H1 parsed_2led 1 26 1 1 . . . . . . . . 2led_ambr002 15 DG N7 parsed_2led 1 26 1 2 . . . . . . . . 2led_ambr002 11 DG H21 parsed_2led 1 27 1 1 . . . . . . . . 2led_ambr001 11 DG O6 parsed_2led 1 27 1 2 . . . . . . . . 2led_ambr002 15 DG H1 parsed_2led 1 28 1 1 . . . . . . . . 2led_ambr001 11 DG N7 parsed_2led 1 28 1 2 . . . . . . . . 2led_ambr002 15 DG H21 parsed_2led 1 29 1 1 . . . . . . . . 2led_ambr001 15 DG O6 parsed_2led 1 29 1 2 . . . . . . . . 2led_ambr001 11 DG H1 parsed_2led 1 30 1 1 . . . . . . . . 2led_ambr001 15 DG N7 parsed_2led 1 30 1 2 . . . . . . . . 2led_ambr001 11 DG H21 parsed_2led 1 31 1 1 . . . . . . . . 2led_ambr002 11 DG O6 parsed_2led 1 31 1 2 . . . . . . . . 2led_ambr001 15 DG H1 parsed_2led 1 32 1 1 . . . . . . . . 2led_ambr002 11 DG N7 parsed_2led 1 32 1 2 . . . . . . . . 2led_ambr001 15 DG H21 parsed_2led 1 33 1 1 . . . . . . . . 2led_ambr002 16 DG O6 parsed_2led 1 33 1 2 . . . . . . . . 2led_ambr002 12 DG H1 parsed_2led 1 34 1 1 . . . . . . . . 2led_ambr002 16 DG N7 parsed_2led 1 34 1 2 . . . . . . . . 2led_ambr002 12 DG H21 parsed_2led 1 35 1 1 . . . . . . . . 2led_ambr001 12 DG O6 parsed_2led 1 35 1 2 . . . . . . . . 2led_ambr002 16 DG H1 parsed_2led 1 36 1 1 . . . . . . . . 2led_ambr001 12 DG N7 parsed_2led 1 36 1 2 . . . . . . . . 2led_ambr002 16 DG H21 parsed_2led 1 37 1 1 . . . . . . . . 2led_ambr001 16 DG N7 parsed_2led 1 37 1 2 . . . . . . . . 2led_ambr001 12 DG H21 parsed_2led 1 38 1 1 . . . . . . . . 2led_ambr002 12 DG O6 parsed_2led 1 38 1 2 . . . . . . . . 2led_ambr001 16 DG H1 parsed_2led 1 39 1 1 . . . . . . . . 2led_ambr002 12 DG N7 parsed_2led 1 39 1 2 . . . . . . . . 2led_ambr001 16 DG H21 parsed_2led 1 40 1 1 . . . . . . . . 2led_ambr002 17 DG O6 parsed_2led 1 40 1 2 . . . . . . . . 2led_ambr002 13 DG H1 parsed_2led 1 41 1 1 . . . . . . . . 2led_ambr002 17 DG N7 parsed_2led 1 41 1 2 . . . . . . . . 2led_ambr002 13 DG H21 parsed_2led 1 42 1 1 . . . . . . . . 2led_ambr001 13 DG O6 parsed_2led 1 42 1 2 . . . . . . . . 2led_ambr002 17 DG H1 parsed_2led 1 43 1 1 . . . . . . . . 2led_ambr001 13 DG N7 parsed_2led 1 43 1 2 . . . . . . . . 2led_ambr002 17 DG H21 parsed_2led 1 44 1 1 . . . . . . . . 2led_ambr001 17 DG O6 parsed_2led 1 44 1 2 . . . . . . . . 2led_ambr001 13 DG H1 parsed_2led 1 45 1 1 . . . . . . . . 2led_ambr001 17 DG N7 parsed_2led 1 45 1 2 . . . . . . . . 2led_ambr001 13 DG H21 parsed_2led 1 46 1 1 . . . . . . . . 2led_ambr002 13 DG O6 parsed_2led 1 46 1 2 . . . . . . . . 2led_ambr001 17 DG H1 parsed_2led 1 47 1 1 . . . . . . . . 2led_ambr002 13 DG N7 parsed_2led 1 47 1 2 . . . . . . . . 2led_ambr001 17 DG H21 parsed_2led 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 . . . . . 1.90 1.70 2.40 parsed_2led 1 2 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 3 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 4 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 5 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 6 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 7 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 8 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 9 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 10 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 11 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 12 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 13 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 14 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 15 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 16 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 17 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 18 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 19 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 20 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 21 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 22 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 23 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 24 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 25 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 26 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 27 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 28 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 29 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 30 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 31 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 32 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 33 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 34 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 35 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 36 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 37 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 38 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 39 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 40 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 41 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 42 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 43 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 44 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 45 1 . . . . . 2.10 1.90 2.60 parsed_2led 1 46 1 . . . . . 1.90 1.70 2.40 parsed_2led 1 47 1 . . . . . 2.10 1.90 2.60 parsed_2led 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 ; hydrogen bonding within G-quartets 3 DG O6 26 DG H1 1.7 1.9 ; 1 1 5 42 parsed_2led 1 2 "3 DG N7 26 DG H21 1.9 2.1" 8 1 9 42 parsed_2led 1 3 "7 DG O6 3 DG H1 1.7 1.9" 12 1 13 42 parsed_2led 1 4 "7 DG N7 3 DG H21 1.9 2.1" 16 1 17 42 parsed_2led 1 5 "22 DG O6 7 DG H1 1.7 1.9" 20 1 21 42 parsed_2led 1 6 "22 DG N7 7 DG H21 1.9 2.1" 24 1 25 42 parsed_2led 1 7 "26 DG O6 22 DG H1 1.7 1.9" 28 1 29 42 parsed_2led 1 8 "26 DG N7 22 DG H21 1.9 2.1" 32 1 33 42 parsed_2led 1 9 "4 DG O6 27 DG H1 1.7 1.9" 36 1 37 42 parsed_2led 1 10 "4 DG N7 27 DG H21 1.9 2.1" 40 1 41 42 parsed_2led 1 11 "8 DG O6 4 DG H1 1.7 1.9" 44 1 45 42 parsed_2led 1 12 "8 DG N7 4 DG H21 1.9 2.1" 48 1 49 42 parsed_2led 1 13 "23 DG O6 8 DG H1 1.7 1.9" 52 1 53 42 parsed_2led 1 14 "23 DG N7 8 DG H21 1.9 2.1" 56 1 57 42 parsed_2led 1 15 "27 DG O6 23 DG H1 1.7 1.9" 60 1 61 42 parsed_2led 1 16 "27 DG N7 23 DG H21 1.9 2.1" 64 1 65 42 parsed_2led 1 17 "5 DG O6 28 DG H1 1.7 1.9" 68 1 69 42 parsed_2led 1 18 "5 DG N7 28 DG H21 1.9 2.1" 72 1 73 42 parsed_2led 1 19 "9 DG O6 5 DG H1 1.7 1.9" 76 1 77 42 parsed_2led 1 20 "9 DG N7 5 DG H21 1.9 2.1" 80 1 81 42 parsed_2led 1 21 "24 DG O6 9 DG H1 1.7 1.9" 84 1 85 42 parsed_2led 1 22 "24 DG N7 9 DG H21 1.9 2.1" 88 1 89 42 parsed_2led 1 23 "28 DG O6 24 DG H1 1.7 1.9" 92 1 93 42 parsed_2led 1 24 "28 DG N7 24 DG H21 1.9 2.1" 96 1 97 42 parsed_2led 1 25 "34 DG O6 30 DG H1 1.7 1.9" 100 1 101 42 parsed_2led 1 26 "34 DG N7 30 DG H21 1.9 2.1" 104 1 105 42 parsed_2led 1 27 "11 DG O6 34 DG H1 1.7 1.9" 108 1 109 42 parsed_2led 1 28 "11 DG N7 34 DG H21 1.9 2.1" 112 1 113 42 parsed_2led 1 29 "15 DG O6 11 DG H1 1.7 1.9" 116 1 117 42 parsed_2led 1 30 "15 DG N7 11 DG H21 1.9 2.1" 120 1 121 42 parsed_2led 1 31 "30 DG O6 15 DG H1 1.7 1.9" 124 1 125 42 parsed_2led 1 32 "30 DG N7 15 DG H21 1.9 2.1" 128 1 129 42 parsed_2led 1 33 "35 DG O6 31 DG H1 1.7 1.9" 132 1 133 42 parsed_2led 1 34 "35 DG N7 31 DG H21 1.9 2.1" 136 1 137 42 parsed_2led 1 35 "12 DG O6 35 DG H1 1.7 1.9" 140 1 141 42 parsed_2led 1 36 "12 DG N7 35 DG H21 1.9 2.1" 144 1 145 42 parsed_2led 1 37 "16 DG O6 12" 148 1 149 20 parsed_2led 1 38 "16 DG N7 12 DG H21 1.9 2.1" 152 1 153 42 parsed_2led 1 39 "31 DG O6 16 DG H1 1.7 1.9" 156 1 157 42 parsed_2led 1 40 "31 DG N7 16 DG H21 1.9 2.1" 160 1 161 42 parsed_2led 1 41 "36 DG O6 32 DG H1 1.7 1.9" 164 1 165 42 parsed_2led 1 42 "36 DG N7 32 DG H21 1.9 2.1" 168 1 169 42 parsed_2led 1 43 "13 DG O6 36 DG H1 1.7 1.9" 172 1 173 42 parsed_2led 1 44 "13 DG N7 36 DG H21 1.9 2.1" 176 1 177 42 parsed_2led 1 45 "17 DG O6 13 DG H1 1.7 1.9" 180 1 181 42 parsed_2led 1 46 "17 DG N7 13 DG H21 1.9 2.1" 184 1 185 42 parsed_2led 1 47 "32 DG O6 17 DG H1 1.7 1.9" 188 1 189 42 parsed_2led 1 48 "32 DG N7 17 DG H21 1.9 2.1" 192 1 193 42 parsed_2led 1 stop_ loop_ _Dist_constraint_parse_err.ID _Dist_constraint_parse_err.Content _Dist_constraint_parse_err.Begin_line _Dist_constraint_parse_err.Begin_column _Dist_constraint_parse_err.End_line _Dist_constraint_parse_err.End_column _Dist_constraint_parse_err.Entry_ID _Dist_constraint_parse_err.Distance_constraint_list_ID 1 "ixpk= 0, nxpk= 0, iat= 505, 376, r1= 1.20, r2= 1.70, r3= 1.90, r4= 2.40, &end" 151 3 151 80 parsed_2led 1 stop_ save_
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