NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
32173 | 1fh3 | 4853 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 24 |
data_1fh3_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_1fh3 _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_1fh3 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_1fh3 _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 1fh3 "Master copy" parsed_1fh3 stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_1fh3 _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 1fh3.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1fh3 1 1 1fh3.mr . . XPLOR/CNS 2 distance NOE simple 528 parsed_1fh3 1 1 1fh3.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 24 parsed_1fh3 1 1 1fh3.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1fh3 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_1fh3 _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_1fh3 1 2 1 . . . parsed_1fh3 1 3 1 . . . parsed_1fh3 1 4 1 . . . parsed_1fh3 1 5 1 . . . parsed_1fh3 1 6 1 . . . parsed_1fh3 1 7 1 . . . parsed_1fh3 1 8 1 . . . parsed_1fh3 1 9 1 . . . parsed_1fh3 1 10 1 . . . parsed_1fh3 1 11 1 . . . parsed_1fh3 1 12 1 . . . parsed_1fh3 1 13 1 . . . parsed_1fh3 1 14 1 . . . parsed_1fh3 1 15 1 . . . parsed_1fh3 1 16 1 . . . parsed_1fh3 1 17 1 . . . parsed_1fh3 1 18 1 . . . parsed_1fh3 1 19 1 . . . parsed_1fh3 1 20 1 . . . parsed_1fh3 1 21 1 . . . parsed_1fh3 1 22 1 . . . parsed_1fh3 1 23 1 . . . parsed_1fh3 1 24 1 . . . parsed_1fh3 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 . . . . . . . . . 6 . hn parsed_1fh3 1 1 1 2 . . . . . . . . . 47 . o parsed_1fh3 1 2 1 1 . . . . . . . . . 6 . n parsed_1fh3 1 2 1 2 . . . . . . . . . 47 . o parsed_1fh3 1 3 1 1 . . . . . . . . . 24 . hn parsed_1fh3 1 3 1 2 . . . . . . . . . 20 . o parsed_1fh3 1 4 1 1 . . . . . . . . . 24 . n parsed_1fh3 1 4 1 2 . . . . . . . . . 20 . o parsed_1fh3 1 5 1 1 . . . . . . . . . 26 . hn parsed_1fh3 1 5 1 2 . . . . . . . . . 22 . o parsed_1fh3 1 6 1 1 . . . . . . . . . 26 . n parsed_1fh3 1 6 1 2 . . . . . . . . . 22 . o parsed_1fh3 1 7 1 1 . . . . . . . . . 27 . hn parsed_1fh3 1 7 1 2 . . . . . . . . . 23 . o parsed_1fh3 1 8 1 1 . . . . . . . . . 27 . n parsed_1fh3 1 8 1 2 . . . . . . . . . 23 . o parsed_1fh3 1 9 1 1 . . . . . . . . . 28 . hn parsed_1fh3 1 9 1 2 . . . . . . . . . 24 . o parsed_1fh3 1 10 1 1 . . . . . . . . . 28 . n parsed_1fh3 1 10 1 2 . . . . . . . . . 24 . o parsed_1fh3 1 11 1 1 . . . . . . . . . 29 . hn parsed_1fh3 1 11 1 2 . . . . . . . . . 25 . o parsed_1fh3 1 12 1 1 . . . . . . . . . 29 . n parsed_1fh3 1 12 1 2 . . . . . . . . . 25 . o parsed_1fh3 1 13 1 1 . . . . . . . . . 47 . hn parsed_1fh3 1 13 1 2 . . . . . . . . . 6 . o parsed_1fh3 1 14 1 1 . . . . . . . . . 47 . n parsed_1fh3 1 14 1 2 . . . . . . . . . 6 . o parsed_1fh3 1 15 1 1 . . . . . . . . . 48 . hn parsed_1fh3 1 15 1 2 . . . . . . . . . 36 . o parsed_1fh3 1 16 1 1 . . . . . . . . . 48 . n parsed_1fh3 1 16 1 2 . . . . . . . . . 36 . o parsed_1fh3 1 17 1 1 . . . . . . . . . 49 . hn parsed_1fh3 1 17 1 2 . . . . . . . . . 4 . o parsed_1fh3 1 18 1 1 . . . . . . . . . 49 . n parsed_1fh3 1 18 1 2 . . . . . . . . . 4 . o parsed_1fh3 1 19 1 1 . . . . . . . . . 50 . hn parsed_1fh3 1 19 1 2 . . . . . . . . . 34 . o parsed_1fh3 1 20 1 1 . . . . . . . . . 50 . n parsed_1fh3 1 20 1 2 . . . . . . . . . 34 . o parsed_1fh3 1 21 1 1 . . . . . . . . . 56 . hn parsed_1fh3 1 21 1 2 . . . . . . . . . 53 . o parsed_1fh3 1 22 1 1 . . . . . . . . . 56 . n parsed_1fh3 1 22 1 2 . . . . . . . . . 53 . o parsed_1fh3 1 23 1 1 . . . . . . . . . 48 . he1 parsed_1fh3 1 23 1 2 . . . . . . . . . 50 . od1 parsed_1fh3 1 24 1 1 . . . . . . . . . 48 . ne1 parsed_1fh3 1 24 1 2 . . . . . . . . . 50 . od1 parsed_1fh3 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 . . . . . 1.5 1.5 2.3 parsed_1fh3 1 2 1 . . . . . 2.5 2.5 3.3 parsed_1fh3 1 3 1 . . . . . 1.5 1.5 2.3 parsed_1fh3 1 4 1 . . . . . 2.5 2.5 3.3 parsed_1fh3 1 5 1 . . . . . 1.5 1.5 2.3 parsed_1fh3 1 6 1 . . . . . 2.5 2.5 3.3 parsed_1fh3 1 7 1 . . . . . 1.5 1.5 2.3 parsed_1fh3 1 8 1 . . . . . 2.5 2.5 3.3 parsed_1fh3 1 9 1 . . . . . 1.5 1.5 2.3 parsed_1fh3 1 10 1 . . . . . 2.5 2.5 3.3 parsed_1fh3 1 11 1 . . . . . 1.5 1.5 2.3 parsed_1fh3 1 12 1 . . . . . 2.5 2.5 3.3 parsed_1fh3 1 13 1 . . . . . 1.5 1.5 2.3 parsed_1fh3 1 14 1 . . . . . 2.5 2.5 3.3 parsed_1fh3 1 15 1 . . . . . 1.5 1.5 2.3 parsed_1fh3 1 16 1 . . . . . 2.5 2.5 3.3 parsed_1fh3 1 17 1 . . . . . 1.5 1.5 2.3 parsed_1fh3 1 18 1 . . . . . 2.5 2.5 3.3 parsed_1fh3 1 19 1 . . . . . 1.5 1.5 2.3 parsed_1fh3 1 20 1 . . . . . 2.5 2.5 3.3 parsed_1fh3 1 21 1 . . . . . 1.5 1.5 2.3 parsed_1fh3 1 22 1 . . . . . 2.5 2.5 3.3 parsed_1fh3 1 23 1 . . . . . 1.5 1.5 2.3 parsed_1fh3 1 24 1 . . . . . 2.5 2.5 3.3 parsed_1fh3 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 "NOE restraints for Hydrogen bonds" 1 1 1 42 parsed_1fh3 1 2 ; assign (resid 2 and name hh21) (resid 54 and name od2) 1.5 0.0 0.8 assign (resid 2 and name nh2 ) (resid 54 and name od2) 2.5 0.0 0.8 ; 2 1 3 73 parsed_1fh3 1 stop_ save_
Contact the webmaster for help, if required. Monday, April 29, 2024 12:12:37 AM GMT (wattos1)