NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | in_recoord | stage | program | type | subtype | subsubtype | item_count |
29979 | 1bnb | cing | recoord | 2-parsed | STAR | distance | hydrogen bond | simple | 24 |
data_1bnb_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_1bnb _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_1bnb 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_1bnb _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 1bnb "Master copy" parsed_1bnb stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_1bnb _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 1bnb.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1bnb 1 1 1bnb.mr . . XPLOR/CNS 2 distance NOE simple 126 parsed_1bnb 1 1 1bnb.mr . . n/a 3 comment "Not applicable" "Not applicable" 0 parsed_1bnb 1 1 1bnb.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 24 parsed_1bnb 1 1 1bnb.mr . . n/a 5 comment "Not applicable" "Not applicable" 0 parsed_1bnb 1 1 1bnb.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1bnb 1 1 1bnb.mr . . n/a 7 comment "Not applicable" "Not applicable" 0 parsed_1bnb 1 1 1bnb.mr . . "MR format" 8 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1bnb 1 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_1bnb _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 4 _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_1bnb 1 2 1 . . . parsed_1bnb 1 3 1 . . . parsed_1bnb 1 4 1 . . . parsed_1bnb 1 5 1 . . . parsed_1bnb 1 6 1 . . . parsed_1bnb 1 7 1 . . . parsed_1bnb 1 8 1 . . . parsed_1bnb 1 9 1 . . . parsed_1bnb 1 10 1 . . . parsed_1bnb 1 11 1 . . . parsed_1bnb 1 12 1 . . . parsed_1bnb 1 13 1 . . . parsed_1bnb 1 14 1 . . . parsed_1bnb 1 15 1 . . . parsed_1bnb 1 16 1 . . . parsed_1bnb 1 17 1 . . . parsed_1bnb 1 18 1 . . . parsed_1bnb 1 19 1 . . . parsed_1bnb 1 20 1 . . . parsed_1bnb 1 21 1 . . . parsed_1bnb 1 22 1 . . . parsed_1bnb 1 23 1 . . . parsed_1bnb 1 24 1 . . . parsed_1bnb 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 . . . . . . . . . 10 . HN parsed_1bnb 1 1 1 2 . . . . . . . . . 5 . O parsed_1bnb 1 2 1 1 . . . . . . . . . 10 . N parsed_1bnb 1 2 1 2 . . . . . . . . . 5 . O parsed_1bnb 1 3 1 1 . . . . . . . . . 11 . HN parsed_1bnb 1 3 1 2 . . . . . . . . . 35 . O parsed_1bnb 1 4 1 1 . . . . . . . . . 11 . N parsed_1bnb 1 4 1 2 . . . . . . . . . 35 . O parsed_1bnb 1 5 1 1 . . . . . . . . . 13 . HN parsed_1bnb 1 5 1 2 . . . . . . . . . 33 . O parsed_1bnb 1 6 1 1 . . . . . . . . . 13 . N parsed_1bnb 1 6 1 2 . . . . . . . . . 33 . O parsed_1bnb 1 7 1 1 . . . . . . . . . 21 . HN parsed_1bnb 1 7 1 2 . . . . . . . . . 18 . O parsed_1bnb 1 8 1 1 . . . . . . . . . 21 . N parsed_1bnb 1 8 1 2 . . . . . . . . . 18 . O parsed_1bnb 1 9 1 1 . . . . . . . . . 22 . HN parsed_1bnb 1 9 1 2 . . . . . . . . . 36 . O parsed_1bnb 1 10 1 1 . . . . . . . . . 22 . N parsed_1bnb 1 10 1 2 . . . . . . . . . 36 . O parsed_1bnb 1 11 1 1 . . . . . . . . . 24 . HN parsed_1bnb 1 11 1 2 . . . . . . . . . 34 . O parsed_1bnb 1 12 1 1 . . . . . . . . . 24 . N parsed_1bnb 1 12 1 2 . . . . . . . . . 34 . O parsed_1bnb 1 13 1 1 . . . . . . . . . 27 . HN parsed_1bnb 1 13 1 2 . . . . . . . . . 32 . O parsed_1bnb 1 14 1 1 . . . . . . . . . 27 . N parsed_1bnb 1 14 1 2 . . . . . . . . . 32 . O parsed_1bnb 1 15 1 1 . . . . . . . . . 32 . HN parsed_1bnb 1 15 1 2 . . . . . . . . . 27 . O parsed_1bnb 1 16 1 1 . . . . . . . . . 32 . N parsed_1bnb 1 16 1 2 . . . . . . . . . 27 . O parsed_1bnb 1 17 1 1 . . . . . . . . . 33 . HN parsed_1bnb 1 17 1 2 . . . . . . . . . 13 . O parsed_1bnb 1 18 1 1 . . . . . . . . . 33 . N parsed_1bnb 1 18 1 2 . . . . . . . . . 13 . O parsed_1bnb 1 19 1 1 . . . . . . . . . 34 . HN parsed_1bnb 1 19 1 2 . . . . . . . . . 25 . O parsed_1bnb 1 20 1 1 . . . . . . . . . 34 . N parsed_1bnb 1 20 1 2 . . . . . . . . . 25 . O parsed_1bnb 1 21 1 1 . . . . . . . . . 35 . HN parsed_1bnb 1 21 1 2 . . . . . . . . . 11 . O parsed_1bnb 1 22 1 1 . . . . . . . . . 35 . N parsed_1bnb 1 22 1 2 . . . . . . . . . 11 . O parsed_1bnb 1 23 1 1 . . . . . . . . . 36 . HN parsed_1bnb 1 23 1 2 . . . . . . . . . 22 . O parsed_1bnb 1 24 1 1 . . . . . . . . . 36 . N parsed_1bnb 1 24 1 2 . . . . . . . . . 22 . O parsed_1bnb 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 1.6 2.4 parsed_1bnb 1 2 1 . . . . . 3.0 2.6 3.4 parsed_1bnb 1 3 1 . . . . . 2.0 1.6 2.4 parsed_1bnb 1 4 1 . . . . . 3.0 2.6 3.4 parsed_1bnb 1 5 1 . . . . . 2.0 1.6 2.4 parsed_1bnb 1 6 1 . . . . . 3.0 2.6 3.4 parsed_1bnb 1 7 1 . . . . . 2.0 1.6 2.4 parsed_1bnb 1 8 1 . . . . . 3.0 2.6 3.4 parsed_1bnb 1 9 1 . . . . . 2.0 1.6 2.4 parsed_1bnb 1 10 1 . . . . . 3.0 2.6 3.4 parsed_1bnb 1 11 1 . . . . . 2.0 1.6 2.4 parsed_1bnb 1 12 1 . . . . . 3.0 2.6 3.4 parsed_1bnb 1 13 1 . . . . . 2.0 1.6 2.4 parsed_1bnb 1 14 1 . . . . . 3.0 2.6 3.4 parsed_1bnb 1 15 1 . . . . . 2.0 1.6 2.4 parsed_1bnb 1 16 1 . . . . . 3.0 2.6 3.4 parsed_1bnb 1 17 1 . . . . . 2.0 1.6 2.4 parsed_1bnb 1 18 1 . . . . . 3.0 2.6 3.4 parsed_1bnb 1 19 1 . . . . . 2.0 1.6 2.4 parsed_1bnb 1 20 1 . . . . . 3.0 2.6 3.4 parsed_1bnb 1 21 1 . . . . . 2.0 1.6 2.4 parsed_1bnb 1 22 1 . . . . . 3.0 2.6 3.4 parsed_1bnb 1 23 1 . . . . . 2.0 1.6 2.4 parsed_1bnb 1 24 1 . . . . . 3.0 2.6 3.4 parsed_1bnb 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 Bond Distance Constraints for BNBD-12 ------------------------------------------------------------- Gly 10 ; 1 1 5 10 parsed_1bnb 1 2 "Val 11" 8 1 8 10 parsed_1bnb 1 3 "Ile 13" 11 1 11 10 parsed_1bnb 1 4 "Met 21" 14 1 14 10 parsed_1bnb 1 5 "Arg 22" 17 1 17 10 parsed_1bnb 1 6 "Ile 24" 20 1 20 10 parsed_1bnb 1 7 "Cys 27" 23 1 23 10 parsed_1bnb 1 8 "Val 32" 26 1 26 10 parsed_1bnb 1 9 "Lys 33" 29 1 29 10 parsed_1bnb 1 10 "Cys 34" 32 1 32 10 parsed_1bnb 1 11 "Cys 35" 35 1 35 10 parsed_1bnb 1 12 "Arg 36" 38 1 38 10 parsed_1bnb 1 stop_ save_
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