NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
49368 | 2jss | 15393 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 20 |
data_2jss_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_2jss _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_2jss 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_2jss _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 2jss "Master copy" parsed_2jss stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_2jss _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 2jss.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2jss 1 1 2jss.mr . . XPLOR/CNS 2 distance NOE simple 1162 parsed_2jss 1 1 2jss.mr . . XPLOR/CNS 3 distance NOE simple 343 parsed_2jss 1 1 2jss.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 22 parsed_2jss 1 1 2jss.mr . . XPLOR/CNS 5 "coupling constant" "Not applicable" "Not applicable" 0 parsed_2jss 1 1 2jss.mr . . XPLOR/CNS 6 distance "hydrogen bond" simple 20 parsed_2jss 1 1 2jss.mr . . XPLOR/CNS 7 distance NOE simple 0 parsed_2jss 1 1 2jss.mr . . XPLOR/CNS 8 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2jss 1 1 2jss.mr . . XPLOR/CNS 9 "coupling constant" "Not applicable" "Not applicable" 0 parsed_2jss 1 1 2jss.mr . . XPLOR/CNS 10 distance NOE simple 0 parsed_2jss 1 1 2jss.mr . . XPLOR/CNS 11 distance NOE simple 0 parsed_2jss 1 1 2jss.mr . . XPLOR/CNS 12 unknown "Not applicable" "Not applicable" 0 parsed_2jss 1 1 2jss.mr . . XPLOR/CNS 13 distance "hydrogen bond" simple 0 parsed_2jss 1 1 2jss.mr . . "MR format" 14 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2jss 1 stop_ save_ save_CNS/XPLOR_distance_constraints_6 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_2jss _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_2jss 1 2 1 . . . parsed_2jss 1 3 1 . . . parsed_2jss 1 4 1 . . . parsed_2jss 1 5 1 . . . parsed_2jss 1 6 1 . . . parsed_2jss 1 7 1 . . . parsed_2jss 1 8 1 . . . parsed_2jss 1 9 1 . . . parsed_2jss 1 10 1 . . . parsed_2jss 1 11 1 . . . parsed_2jss 1 12 1 . . . parsed_2jss 1 13 1 . . . parsed_2jss 1 14 1 . . . parsed_2jss 1 15 1 . . . parsed_2jss 1 16 1 . . . parsed_2jss 1 17 1 . . . parsed_2jss 1 18 1 . . . parsed_2jss 1 19 1 . . . parsed_2jss 1 20 1 . . . parsed_2jss 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 . . . . . . . . B 11 . o parsed_2jss 1 1 1 2 . . . . . . . . B 15 . hn parsed_2jss 1 2 1 1 . . . . . . . . B 11 . o parsed_2jss 1 2 1 2 . . . . . . . . B 15 . n parsed_2jss 1 3 1 1 . . . . . . . . B 12 . o parsed_2jss 1 3 1 2 . . . . . . . . B 16 . hn parsed_2jss 1 4 1 1 . . . . . . . . B 12 . o parsed_2jss 1 4 1 2 . . . . . . . . B 16 . n parsed_2jss 1 5 1 1 . . . . . . . . B 13 . o parsed_2jss 1 5 1 2 . . . . . . . . B 17 . hn parsed_2jss 1 6 1 1 . . . . . . . . B 13 . o parsed_2jss 1 6 1 2 . . . . . . . . B 17 . n parsed_2jss 1 7 1 1 . . . . . . . . B 34 . o parsed_2jss 1 7 1 2 . . . . . . . . B 38 . hn parsed_2jss 1 8 1 1 . . . . . . . . B 34 . o parsed_2jss 1 8 1 2 . . . . . . . . B 38 . n parsed_2jss 1 9 1 1 . . . . . . . . B 52 . o parsed_2jss 1 9 1 2 . . . . . . . . B 56 . hn parsed_2jss 1 10 1 1 . . . . . . . . B 52 . o parsed_2jss 1 10 1 2 . . . . . . . . B 56 . n parsed_2jss 1 11 1 1 . . . . . . . . B 53 . o parsed_2jss 1 11 1 2 . . . . . . . . B 57 . hn parsed_2jss 1 12 1 1 . . . . . . . . B 53 . o parsed_2jss 1 12 1 2 . . . . . . . . B 57 . n parsed_2jss 1 13 1 1 . . . . . . . . B 54 . o parsed_2jss 1 13 1 2 . . . . . . . . B 58 . hn parsed_2jss 1 14 1 1 . . . . . . . . B 54 . o parsed_2jss 1 14 1 2 . . . . . . . . B 58 . n parsed_2jss 1 15 1 1 . . . . . . . . B 55 . o parsed_2jss 1 15 1 2 . . . . . . . . B 59 . hn parsed_2jss 1 16 1 1 . . . . . . . . B 55 . o parsed_2jss 1 16 1 2 . . . . . . . . B 59 . n parsed_2jss 1 17 1 1 . . . . . . . . B 56 . o parsed_2jss 1 17 1 2 . . . . . . . . B 60 . hn parsed_2jss 1 18 1 1 . . . . . . . . B 56 . o parsed_2jss 1 18 1 2 . . . . . . . . B 60 . n parsed_2jss 1 19 1 1 . . . . . . . . B 57 . o parsed_2jss 1 19 1 2 . . . . . . . . B 61 . hn parsed_2jss 1 20 1 1 . . . . . . . . B 57 . o parsed_2jss 1 20 1 2 . . . . . . . . B 61 . n parsed_2jss 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 . . . . . 2.0 1.5 2.3 parsed_2jss 1 2 1 . . . . . 2.8 2.3 3.1 parsed_2jss 1 3 1 . . . . . 2.0 1.5 2.3 parsed_2jss 1 4 1 . . . . . 2.8 2.3 3.1 parsed_2jss 1 5 1 . . . . . 2.0 1.5 2.3 parsed_2jss 1 6 1 . . . . . 2.8 2.3 3.1 parsed_2jss 1 7 1 . . . . . 2.4 1.9 2.7 parsed_2jss 1 8 1 . . . . . 2.8 2.3 3.2 parsed_2jss 1 9 1 . . . . . 2.0 1.5 2.3 parsed_2jss 1 10 1 . . . . . 2.8 2.3 3.1 parsed_2jss 1 11 1 . . . . . 2.0 1.5 2.3 parsed_2jss 1 12 1 . . . . . 2.8 2.3 3.1 parsed_2jss 1 13 1 . . . . . 2.0 1.5 2.3 parsed_2jss 1 14 1 . . . . . 2.8 2.3 3.1 parsed_2jss 1 15 1 . . . . . 2.0 1.5 2.3 parsed_2jss 1 16 1 . . . . . 2.8 2.3 3.1 parsed_2jss 1 17 1 . . . . . 2.0 1.5 2.3 parsed_2jss 1 18 1 . . . . . 2.8 2.3 3.1 parsed_2jss 1 19 1 . . . . . 2.0 1.5 2.3 parsed_2jss 1 20 1 . . . . . 2.8 2.3 3.1 parsed_2jss 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 ; make_hbonds.nawk Table ! Date: Fri Oct 20 14:02:30 EDT 2006 Path: /home/fengh/My_xplor/h2btz_trim alpha helices H-BOND constraints @assign (segid B and resid 10 and name o ) @ (segid B and resid 14 and name hn ) 2.0 0.5 0.3 @assign (segid B and resid 10 and name o ) @ (segid B and resid 14 and name n ) 2.8 0.5 0.3 ; 1 1 8 58 parsed_2jss 1 2 ; assign (segid B and resid 14 and name o ) (segid B and resid 18 and name hn ) 2.0 0.5 0.3 assign (segid B and resid 14 and name o ) (segid B and resid 18 and name n ) 2.8 0.5 0.3 assign (segid B and resid 29 and name o ) (segid B and resid 33 and name hn ) 2.0 0.5 0.3 assign (segid B and resid 29 and name o ) (segid B and resid 33 and name n ) 2.8 0.5 0.3 assign (segid B and resid 30 and name o ) (segid B and resid 34 and name hn ) 2.0 0.5 0.3 assign (segid B and resid 30 and name o ) (segid B and resid 34 and name n ) 2.8 0.5 0.3 assign (segid B and resid 31 and name o ) (segid B and resid 35 and name hn ) 2.0 0.5 0.3 assign (segid B and resid 31 and name o ) (segid B and resid 35 and name n ) 2.8 0.5 0.3 assign (segid B and resid 32 and name o ) (segid B and resid 36 and name hn ) 2.0 0.5 0.3 assign (segid B and resid 32 and name o ) (segid B and resid 36 and name n ) 2.8 0.5 0.3 assign (segid B and resid 33 and name o ) (segid B and resid 37 and name hn ) 2.0 0.5 0.3 assign (segid B and resid 33 and name o ) (segid B and resid 37 and name n ) 2.8 0.5 0.3 ; 21 1 44 57 parsed_2jss 1 3 ; assign (segid B and resid 44 and name o ) (segid B and resid 48 and name hn ) 2.6 0.5 0.6 assign (segid B and resid 44 and name o ) (segid B and resid 48 and name n ) 3.2 0.5 0.8 assign (segid B and resid 45 and name o ) (segid B and resid 49 and name hn ) 2.4 0.5 0.4 assign (segid B and resid 45 and name o ) (segid B and resid 49 and name n ) 3.0 0.5 0.6 assign (segid B and resid 46 and name o ) (segid B and resid 50 and name hn ) 2.4 0.5 0.4 assign (segid B and resid 46 and name o ) (segid B and resid 50 and name n ) 3.0 0.5 0.6 assign (segid B and resid 47 and name o ) (segid B and resid 51 and name hn ) 2.4 0.5 0.4 assign (segid B and resid 47 and name o ) (segid B and resid 51 and name n ) 3.0 0.5 0.6 ; 49 1 64 57 parsed_2jss 1 stop_ save_
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