NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
456351 | 2kh9 | 16246 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 43 |
data_2kh9_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_2kh9 _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_2kh9 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_2kh9 _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 2kh9 "Master copy" parsed_2kh9 stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_2kh9 _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 2kh9.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2kh9 1 1 2kh9.mr . . XPLOR/CNS 2 distance "hydrogen bond" simple 43 parsed_2kh9 1 1 2kh9.mr . . HADDOCK 3 distance NOE ambi 0 parsed_2kh9 1 1 2kh9.mr . . XPLOR/CNS 4 distance NOE simple 0 parsed_2kh9 1 1 2kh9.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2kh9 1 1 2kh9.mr . . XPLOR/CNS 6 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2kh9 1 1 2kh9.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2kh9 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_2kh9 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 2 _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_2kh9 1 2 1 . . . parsed_2kh9 1 3 1 . . . parsed_2kh9 1 4 1 . . . parsed_2kh9 1 5 1 . . . parsed_2kh9 1 6 1 . . . parsed_2kh9 1 7 1 . . . parsed_2kh9 1 8 1 . . . parsed_2kh9 1 9 1 . . . parsed_2kh9 1 10 1 . . . parsed_2kh9 1 11 1 . . . parsed_2kh9 1 12 1 . . . parsed_2kh9 1 13 1 . . . parsed_2kh9 1 14 1 . . . parsed_2kh9 1 15 1 . . . parsed_2kh9 1 16 1 . . . parsed_2kh9 1 17 1 . . . parsed_2kh9 1 18 1 . . . parsed_2kh9 1 19 1 . . . parsed_2kh9 1 20 1 . . . parsed_2kh9 1 21 1 . . . parsed_2kh9 1 22 1 . . . parsed_2kh9 1 23 1 . . . parsed_2kh9 1 24 1 . . . parsed_2kh9 1 25 1 . . . parsed_2kh9 1 26 1 . . . parsed_2kh9 1 27 1 . . . parsed_2kh9 1 28 1 . . . parsed_2kh9 1 29 1 . . . parsed_2kh9 1 30 1 . . . parsed_2kh9 1 31 1 . . . parsed_2kh9 1 32 1 . . . parsed_2kh9 1 33 1 . . . parsed_2kh9 1 34 1 . . . parsed_2kh9 1 35 1 . . . parsed_2kh9 1 36 1 . . . parsed_2kh9 1 37 1 . . . parsed_2kh9 1 38 1 . . . parsed_2kh9 1 39 1 . . . parsed_2kh9 1 40 1 . . . parsed_2kh9 1 41 1 . . . parsed_2kh9 1 42 1 . . . parsed_2kh9 1 43 1 . . . parsed_2kh9 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 . . . . . . . . A 118 . OG1 parsed_2kh9 1 1 1 2 . . . . . . . . . 3 . H6# parsed_2kh9 1 2 1 1 . . . . . . . . A 162 . HH parsed_2kh9 1 2 1 2 . . . . . . . . . 3 . O3' parsed_2kh9 1 2 1 2 . . . . . . . . . 3 . O4' parsed_2kh9 1 3 1 1 . . . . . . . . A 191 . HZ# parsed_2kh9 1 3 1 2 . . . . . . . . B 2 . O6 parsed_2kh9 1 4 1 1 . . . . . . . . A 194 . OD1 parsed_2kh9 1 4 1 2 . . . . . . . . B 2 . H2# parsed_2kh9 1 5 1 1 . . . . . . . . A 158 . HH# parsed_2kh9 1 5 1 2 . . . . . . . . B . . O1P parsed_2kh9 1 5 1 2 . . . . . . . . B . . O2P parsed_2kh9 1 6 1 1 . . . . . . . . A 117 . O parsed_2kh9 1 6 1 2 . . . . . . . . A 165 . HN parsed_2kh9 1 7 1 1 . . . . . . . . A 119 . O parsed_2kh9 1 7 1 2 . . . . . . . . A 163 . HN parsed_2kh9 1 8 1 1 . . . . . . . . A 119 . HN parsed_2kh9 1 8 1 2 . . . . . . . . A 163 . O parsed_2kh9 1 9 1 1 . . . . . . . . A 121 . O parsed_2kh9 1 9 1 2 . . . . . . . . A 161 . HN parsed_2kh9 1 10 1 1 . . . . . . . . A 121 . HN parsed_2kh9 1 10 1 2 . . . . . . . . A 161 . O parsed_2kh9 1 11 1 1 . . . . . . . . A 120 . O parsed_2kh9 1 11 1 2 . . . . . . . . A 191 . HN parsed_2kh9 1 12 1 1 . . . . . . . . A 120 . HN parsed_2kh9 1 12 1 2 . . . . . . . . A 191 . O parsed_2kh9 1 13 1 1 . . . . . . . . A 122 . O parsed_2kh9 1 13 1 2 . . . . . . . . A 189 . HN parsed_2kh9 1 14 1 1 . . . . . . . . A 122 . HN parsed_2kh9 1 14 1 2 . . . . . . . . A 189 . O parsed_2kh9 1 15 1 1 . . . . . . . . A 162 . O parsed_2kh9 1 15 1 2 . . . . . . . . A 148 . HN parsed_2kh9 1 16 1 1 . . . . . . . . A 164 . HN parsed_2kh9 1 16 1 2 . . . . . . . . A 146 . O parsed_2kh9 1 17 1 1 . . . . . . . . A 117 . O parsed_2kh9 1 17 1 2 . . . . . . . . A 165 . N parsed_2kh9 1 18 1 1 . . . . . . . . A 119 . O parsed_2kh9 1 18 1 2 . . . . . . . . A 163 . N parsed_2kh9 1 19 1 1 . . . . . . . . A 119 . N parsed_2kh9 1 19 1 2 . . . . . . . . A 163 . O parsed_2kh9 1 20 1 1 . . . . . . . . A 121 . O parsed_2kh9 1 20 1 2 . . . . . . . . A 161 . N parsed_2kh9 1 21 1 1 . . . . . . . . A 121 . N parsed_2kh9 1 21 1 2 . . . . . . . . A 161 . O parsed_2kh9 1 22 1 1 . . . . . . . . A 120 . O parsed_2kh9 1 22 1 2 . . . . . . . . A 191 . N parsed_2kh9 1 23 1 1 . . . . . . . . A 120 . N parsed_2kh9 1 23 1 2 . . . . . . . . A 191 . O parsed_2kh9 1 24 1 1 . . . . . . . . A 122 . O parsed_2kh9 1 24 1 2 . . . . . . . . A 189 . N parsed_2kh9 1 25 1 1 . . . . . . . . A 122 . N parsed_2kh9 1 25 1 2 . . . . . . . . A 189 . O parsed_2kh9 1 26 1 1 . . . . . . . . A 162 . O parsed_2kh9 1 26 1 2 . . . . . . . . A 148 . N parsed_2kh9 1 27 1 1 . . . . . . . . A 162 . N parsed_2kh9 1 27 1 2 . . . . . . . . A 148 . O parsed_2kh9 1 28 1 1 . . . . . . . . A 164 . N parsed_2kh9 1 28 1 2 . . . . . . . . A 146 . O parsed_2kh9 1 29 1 1 . . . . . . . . A 168 . O parsed_2kh9 1 29 1 2 . . . . . . . . A 172 . HN parsed_2kh9 1 30 1 1 . . . . . . . . A 169 . O parsed_2kh9 1 30 1 2 . . . . . . . . A 173 . HN parsed_2kh9 1 31 1 1 . . . . . . . . A 170 . O parsed_2kh9 1 31 1 2 . . . . . . . . A 174 . HN parsed_2kh9 1 32 1 1 . . . . . . . . A 171 . O parsed_2kh9 1 32 1 2 . . . . . . . . A 175 . HN parsed_2kh9 1 33 1 1 . . . . . . . . A 172 . O parsed_2kh9 1 33 1 2 . . . . . . . . A 176 . HN parsed_2kh9 1 34 1 1 . . . . . . . . A 173 . O parsed_2kh9 1 34 1 2 . . . . . . . . A 177 . HN parsed_2kh9 1 35 1 1 . . . . . . . . A 174 . O parsed_2kh9 1 35 1 2 . . . . . . . . A 178 . HN parsed_2kh9 1 36 1 1 . . . . . . . . A 175 . O parsed_2kh9 1 36 1 2 . . . . . . . . A 179 . HN parsed_2kh9 1 37 1 1 . . . . . . . . A 130 . O parsed_2kh9 1 37 1 2 . . . . . . . . A 134 . HN parsed_2kh9 1 38 1 1 . . . . . . . . A 131 . O parsed_2kh9 1 38 1 2 . . . . . . . . A 135 . HN parsed_2kh9 1 39 1 1 . . . . . . . . A 132 . O parsed_2kh9 1 39 1 2 . . . . . . . . A 136 . HN parsed_2kh9 1 40 1 1 . . . . . . . . A 133 . O parsed_2kh9 1 40 1 2 . . . . . . . . A 137 . HN parsed_2kh9 1 41 1 1 . . . . . . . . A 134 . O parsed_2kh9 1 41 1 2 . . . . . . . . A 138 . HN parsed_2kh9 1 42 1 1 . . . . . . . . A 135 . O parsed_2kh9 1 42 1 2 . . . . . . . . A 139 . HN parsed_2kh9 1 43 1 1 . . . . . . . . A 136 . O parsed_2kh9 1 43 1 2 . . . . . . . . A 140 . HN parsed_2kh9 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 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 2 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 3 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 4 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 5 1 . . . . . 2 1.6 2.6 parsed_2kh9 1 6 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 7 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 8 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 9 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 10 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 11 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 12 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 13 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 14 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 15 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 16 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 17 1 . . . . . 2.9 2.4 3.6 parsed_2kh9 1 18 1 . . . . . 2.9 2.4 3.6 parsed_2kh9 1 19 1 . . . . . 2.9 2.4 3.6 parsed_2kh9 1 20 1 . . . . . 2.9 2.4 3.6 parsed_2kh9 1 21 1 . . . . . 2.9 2.4 3.6 parsed_2kh9 1 22 1 . . . . . 2.9 2.4 3.6 parsed_2kh9 1 23 1 . . . . . 2.9 2.4 3.6 parsed_2kh9 1 24 1 . . . . . 2.9 2.4 3.6 parsed_2kh9 1 25 1 . . . . . 2.9 2.4 3.6 parsed_2kh9 1 26 1 . . . . . 2.9 2.4 3.6 parsed_2kh9 1 27 1 . . . . . 2.9 2.4 3.6 parsed_2kh9 1 28 1 . . . . . 2.9 2.4 3.6 parsed_2kh9 1 29 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 30 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 31 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 32 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 33 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 34 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 35 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 36 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 37 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 38 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 39 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 40 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 41 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 42 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 1 43 1 . . . . . 1.9 1.5 2.5 parsed_2kh9 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 "H Bond Restraints (based on HADDOCK)" 1 1 1 55 parsed_2kh9 1 2 "Electrostatics of R158" 7 1 7 24 parsed_2kh9 1 3 "Beta Sheet" 10 1 10 33 parsed_2kh9 1 4 "Alpha Helix" 36 1 36 31 parsed_2kh9 1 stop_ save_
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