NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype | item_count |
42434 | 1yui | cing | 2-parsed | STAR | distance | hydrogen bond | ambi | 10 |
data_1yui_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_1yui _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_1yui 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_1yui _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 1yui "Master copy" parsed_1yui stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_1yui _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 1yui.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1yui 1 1 1yui.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1yui 1 1 1yui.mr . . XPLOR/CNS 3 distance NOE simple 1016 parsed_1yui 1 1 1yui.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_1yui 1 1 1yui.mr . . XPLOR/CNS 5 distance "hydrogen bond" simple 82 parsed_1yui 1 1 1yui.mr . . XPLOR/CNS 6 distance "hydrogen bond" ambi 10 parsed_1yui 1 1 1yui.mr . . XPLOR/CNS 7 distance "general distance" simple 0 parsed_1yui 1 1 1yui.mr . . n/a 8 comment "Not applicable" "Not applicable" 0 parsed_1yui 1 1 1yui.mr . . XPLOR/CNS 9 "coupling constant" "Not applicable" "Not applicable" 0 parsed_1yui 1 1 1yui.mr . . n/a 10 comment "Not applicable" "Not applicable" 0 parsed_1yui 1 1 1yui.mr . . XPLOR/CNS 11 "chemical shift" "Not applicable" "Not applicable" 0 parsed_1yui 1 1 1yui.mr . . n/a 12 comment "Not applicable" "Not applicable" 0 parsed_1yui 1 1 1yui.mr . . XPLOR/CNS 13 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1yui 1 1 1yui.mr . . "MR format" 14 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1yui 1 stop_ save_ save_CNS/XPLOR_distance_constraints_6 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_1yui _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 6 _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_1yui 1 2 1 . . . parsed_1yui 1 3 1 . . . parsed_1yui 1 4 1 . . . parsed_1yui 1 5 1 . . . parsed_1yui 1 6 1 . . . parsed_1yui 1 7 1 . . . parsed_1yui 1 8 1 . . . parsed_1yui 1 9 1 . . . parsed_1yui 1 10 1 . . . parsed_1yui 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 . . . . . . . . . 51 . nh1 parsed_1yui 1 1 1 2 . . . . . . . . . 104 . n7 parsed_1yui 1 1 1 2 . . . . . . . . . 104 . o6 parsed_1yui 1 1 1 2 . . . . . . . . . 105 . n7 parsed_1yui 1 1 1 2 . . . . . . . . . 118 . o4 parsed_1yui 1 1 1 2 . . . . . . . . . 120 . n7 parsed_1yui 1 1 1 2 . . . . . . . . . 120 . o6 parsed_1yui 1 2 1 1 . . . . . . . . . 51 . nh2 parsed_1yui 1 2 1 2 . . . . . . . . . 104 . n7 parsed_1yui 1 2 1 2 . . . . . . . . . 104 . o6 parsed_1yui 1 2 1 2 . . . . . . . . . 105 . n7 parsed_1yui 1 2 1 2 . . . . . . . . . 118 . o4 parsed_1yui 1 2 1 2 . . . . . . . . . 120 . n7 parsed_1yui 1 2 1 2 . . . . . . . . . 120 . o6 parsed_1yui 1 3 1 1 . . . . . . . . . 47 . nh1 parsed_1yui 1 3 1 2 . . . . . . . . . 105 . n7 parsed_1yui 1 3 1 2 . . . . . . . . . 106 . n7 parsed_1yui 1 3 1 2 . . . . . . . . . 106 . o6 parsed_1yui 1 3 1 2 . . . . . . . . . 107 . n7 parsed_1yui 1 3 1 2 . . . . . . . . . 116 . o4 parsed_1yui 1 3 1 2 . . . . . . . . . 118 . o4 parsed_1yui 1 4 1 1 . . . . . . . . . 47 . nh2 parsed_1yui 1 4 1 2 . . . . . . . . . 105 . n7 parsed_1yui 1 4 1 2 . . . . . . . . . 106 . n7 parsed_1yui 1 4 1 2 . . . . . . . . . 106 . o6 parsed_1yui 1 4 1 2 . . . . . . . . . 107 . n7 parsed_1yui 1 4 1 2 . . . . . . . . . 116 . o4 parsed_1yui 1 4 1 2 . . . . . . . . . 118 . o4 parsed_1yui 1 5 1 1 . . . . . . . . . 27 . nh1 parsed_1yui 1 5 1 2 . . . . . . . . . 107 . n7 parsed_1yui 1 5 1 2 . . . . . . . . . 108 . n7 parsed_1yui 1 5 1 2 . . . . . . . . . 108 . o6 parsed_1yui 1 5 1 2 . . . . . . . . . 109 . o4 parsed_1yui 1 5 1 2 . . . . . . . . . 114 . n7 parsed_1yui 1 5 1 2 . . . . . . . . . 116 . o4 parsed_1yui 1 6 1 1 . . . . . . . . . 27 . nh2 parsed_1yui 1 6 1 2 . . . . . . . . . 107 . n7 parsed_1yui 1 6 1 2 . . . . . . . . . 108 . n7 parsed_1yui 1 6 1 2 . . . . . . . . . 108 . o6 parsed_1yui 1 6 1 2 . . . . . . . . . 109 . o4 parsed_1yui 1 6 1 2 . . . . . . . . . 114 . n7 parsed_1yui 1 6 1 2 . . . . . . . . . 116 . o4 parsed_1yui 1 7 1 1 . . . . . . . . . 14 . nh1 parsed_1yui 1 7 1 2 . . . . . . . . . 106 . n3 parsed_1yui 1 7 1 2 . . . . . . . . . 107 . n3 parsed_1yui 1 7 1 2 . . . . . . . . . 108 . n3 parsed_1yui 1 7 1 2 . . . . . . . . . 115 . o2 parsed_1yui 1 7 1 2 . . . . . . . . . 116 . o2 parsed_1yui 1 7 1 2 . . . . . . . . . 117 . o2 parsed_1yui 1 8 1 1 . . . . . . . . . 14 . nh2 parsed_1yui 1 8 1 2 . . . . . . . . . 106 . n3 parsed_1yui 1 8 1 2 . . . . . . . . . 107 . n3 parsed_1yui 1 8 1 2 . . . . . . . . . 108 . n3 parsed_1yui 1 8 1 2 . . . . . . . . . 115 . o2 parsed_1yui 1 8 1 2 . . . . . . . . . 116 . o2 parsed_1yui 1 8 1 2 . . . . . . . . . 117 . o2 parsed_1yui 1 9 1 1 . . . . . . . . . 48 . nd2 parsed_1yui 1 9 1 2 . . . . . . . . . 104 . n7 parsed_1yui 1 9 1 2 . . . . . . . . . 104 . o6 parsed_1yui 1 9 1 2 . . . . . . . . . 105 . n7 parsed_1yui 1 9 1 2 . . . . . . . . . 106 . n7 parsed_1yui 1 9 1 2 . . . . . . . . . 106 . o6 parsed_1yui 1 9 1 2 . . . . . . . . . 118 . o4 parsed_1yui 1 10 1 1 . . . . . . . . . 48 . od1 parsed_1yui 1 10 1 2 . . . . . . . . . 105 . n6 parsed_1yui 1 10 1 2 . . . . . . . . . 117 . n4 parsed_1yui 1 10 1 2 . . . . . . . . . 119 . n4 parsed_1yui 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 . . . . . 2.8 2.4 3.3 parsed_1yui 1 2 1 . . . . . 2.8 2.4 3.3 parsed_1yui 1 3 1 . . . . . 2.8 2.4 3.3 parsed_1yui 1 4 1 . . . . . 2.8 2.4 3.3 parsed_1yui 1 5 1 . . . . . 2.8 2.4 3.3 parsed_1yui 1 6 1 . . . . . 2.8 2.4 3.3 parsed_1yui 1 7 1 . . . . . 2.8 2.4 3.3 parsed_1yui 1 8 1 . . . . . 2.8 2.4 3.3 parsed_1yui 1 9 1 . . . . . 2.8 2.4 3.3 parsed_1yui 1 10 1 . . . . . 2.8 2.4 3.3 parsed_1yui 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 "attractive component" 2 1 2 22 parsed_1yui 1 2 "h distances" 72 1 72 13 parsed_1yui 1 3 ; assign (resid 48 and name od1) ((name hn' or name hn'') and (resid 105 or resid 117 or resid 119)) 1.8 0.4 0.3 assign (resid 51 and name hh1#) ( (name o6 and (resid 104 or resid 120)) or (name n7 and (resid 104 or resid 105 or resid 120)) or (name o4 and resid 118) ) 1.8 0.4 0.4 assign (resid 51 and name hh2#) ( (name o6 and (resid 104 or resid 120)) or (name n7 and (resid 104 or resid 105 or resid 120)) or (name o4 and resid 118) ) 1.8 0.4 0.4 assign (resid 47 and name hh1#) ( (name o6 and (resid 106)) or (name n7 and (resid 106 or resid 107 or resid 105)) or (name o4 and (resid 118 or resid 116) )) 1.8 0.4 0.4 assign (resid 47 and name hh2#) ( (name o6 and (resid 106)) or (name n7 and (resid 106 or resid 107 or resid 105)) or (name o4 and (resid 118 or resid 116) )) 1.8 0.4 0.4 assign (resid 27 and name hh1#) ( (name o6 and (resid 108)) or (name n7 and (resid 108 or resid 107 or resid 114)) or (name o4 and (resid 109 or resid 116) )) 1.8 0.4 0.4 assign (resid 27 and name hh2#) ( (name o6 and (resid 108)) or (name n7 and (resid 108 or resid 107 or resid 114)) or (name o4 and (resid 109 or resid 116) )) 1.8 0.4 0.4 assign (resid 14 and name hh1#) ( (name n3 and ( resid 107 or resid 106 or resid 108)) or (name o2 and (resid 115 or resid 116 or resid 117)) ) 1.8 0.4 0.4 assign (resid 14 and name hh2#) ( (name n3 and (resid 107 or resid 106 or resid 108)) or (name o2 and (resid 115 or resid 116 or resid 117)) ) 1.8 0.4 0.4 assign (resid 48 and name hd2#) ( (name n7 and (resid 104 or resid 105 or resid 106)) or (name o6 and (resid 104 or resid 106)) or (name o4 and resid 118) ) 1.8 0.4 0.4 ; 74 1 74 1 parsed_1yui 1 stop_ save_
Contact the webmaster for help, if required. Tuesday, May 21, 2024 3:17:53 PM GMT (wattos1)