NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
39305 | 1sxe | 5399 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 28 |
data_1sxe_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_1sxe _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_1sxe 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_1sxe _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 1sxe "Master copy" parsed_1sxe stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_1sxe _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 1sxe.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1sxe 1 1 1sxe.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 8 parsed_1sxe 1 1 1sxe.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 105 parsed_1sxe 1 1 1sxe.mr . . XPLOR/CNS 4 peak "Not applicable" "Not applicable" 0 parsed_1sxe 1 1 1sxe.mr . . XPLOR/CNS 5 distance "hydrogen bond" simple 28 parsed_1sxe 1 1 1sxe.mr . . XPLOR/CNS 6 distance NOE simple 0 parsed_1sxe 1 1 1sxe.mr . . XPLOR/CNS 7 peak "Not applicable" "Not applicable" 0 parsed_1sxe 1 1 1sxe.mr . . XPLOR/CNS 8 peak "Not applicable" "Not applicable" 0 parsed_1sxe 1 1 1sxe.mr . . "MR format" 9 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1sxe 1 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_1sxe _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 5 _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_1sxe 1 2 1 . . . parsed_1sxe 1 3 1 . . . parsed_1sxe 1 4 1 . . . parsed_1sxe 1 5 1 . . . parsed_1sxe 1 6 1 . . . parsed_1sxe 1 7 1 . . . parsed_1sxe 1 8 1 . . . parsed_1sxe 1 9 1 . . . parsed_1sxe 1 10 1 . . . parsed_1sxe 1 11 1 . . . parsed_1sxe 1 12 1 . . . parsed_1sxe 1 13 1 . . . parsed_1sxe 1 14 1 . . . parsed_1sxe 1 15 1 . . . parsed_1sxe 1 16 1 . . . parsed_1sxe 1 17 1 . . . parsed_1sxe 1 18 1 . . . parsed_1sxe 1 19 1 . . . parsed_1sxe 1 20 1 . . . parsed_1sxe 1 21 1 . . . parsed_1sxe 1 22 1 . . . parsed_1sxe 1 23 1 . . . parsed_1sxe 1 24 1 . . . parsed_1sxe 1 25 1 . . . parsed_1sxe 1 26 1 . . . parsed_1sxe 1 27 1 . . . parsed_1sxe 1 28 1 . . . parsed_1sxe 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 . . . . . . . . . 31 . O parsed_1sxe 1 1 1 2 . . . . . . . . . 35 . HN parsed_1sxe 1 2 1 1 . . . . . . . . . 31 . O parsed_1sxe 1 2 1 2 . . . . . . . . . 35 . N parsed_1sxe 1 3 1 1 . . . . . . . . . 32 . O parsed_1sxe 1 3 1 2 . . . . . . . . . 36 . HN parsed_1sxe 1 4 1 1 . . . . . . . . . 32 . O parsed_1sxe 1 4 1 2 . . . . . . . . . 36 . N parsed_1sxe 1 5 1 1 . . . . . . . . . 33 . O parsed_1sxe 1 5 1 2 . . . . . . . . . 37 . HN parsed_1sxe 1 6 1 1 . . . . . . . . . 33 . O parsed_1sxe 1 6 1 2 . . . . . . . . . 37 . N parsed_1sxe 1 7 1 1 . . . . . . . . . 40 . O parsed_1sxe 1 7 1 2 . . . . . . . . . 44 . HN parsed_1sxe 1 8 1 1 . . . . . . . . . 40 . O parsed_1sxe 1 8 1 2 . . . . . . . . . 44 . N parsed_1sxe 1 9 1 1 . . . . . . . . . 41 . O parsed_1sxe 1 9 1 2 . . . . . . . . . 45 . HN parsed_1sxe 1 10 1 1 . . . . . . . . . 41 . O parsed_1sxe 1 10 1 2 . . . . . . . . . 45 . N parsed_1sxe 1 11 1 1 . . . . . . . . . 42 . O parsed_1sxe 1 11 1 2 . . . . . . . . . 46 . HN parsed_1sxe 1 12 1 1 . . . . . . . . . 42 . O parsed_1sxe 1 12 1 2 . . . . . . . . . 46 . N parsed_1sxe 1 13 1 1 . . . . . . . . . 68 . O parsed_1sxe 1 13 1 2 . . . . . . . . . 72 . HN parsed_1sxe 1 14 1 1 . . . . . . . . . 68 . O parsed_1sxe 1 14 1 2 . . . . . . . . . 72 . N parsed_1sxe 1 15 1 1 . . . . . . . . . 34 . O parsed_1sxe 1 15 1 2 . . . . . . . . . 38 . HN parsed_1sxe 1 16 1 1 . . . . . . . . . 34 . O parsed_1sxe 1 16 1 2 . . . . . . . . . 38 . N parsed_1sxe 1 17 1 1 . . . . . . . . . 35 . O parsed_1sxe 1 17 1 2 . . . . . . . . . 39 . HN parsed_1sxe 1 18 1 1 . . . . . . . . . 35 . O parsed_1sxe 1 18 1 2 . . . . . . . . . 39 . N parsed_1sxe 1 19 1 1 . . . . . . . . . 36 . O parsed_1sxe 1 19 1 2 . . . . . . . . . 40 . HN parsed_1sxe 1 20 1 1 . . . . . . . . . 36 . O parsed_1sxe 1 20 1 2 . . . . . . . . . 40 . N parsed_1sxe 1 21 1 1 . . . . . . . . . 37 . O parsed_1sxe 1 21 1 2 . . . . . . . . . 41 . HN parsed_1sxe 1 22 1 1 . . . . . . . . . 37 . O parsed_1sxe 1 22 1 2 . . . . . . . . . 41 . N parsed_1sxe 1 23 1 1 . . . . . . . . . 38 . O parsed_1sxe 1 23 1 2 . . . . . . . . . 42 . HN parsed_1sxe 1 24 1 1 . . . . . . . . . 38 . O parsed_1sxe 1 24 1 2 . . . . . . . . . 42 . N parsed_1sxe 1 25 1 1 . . . . . . . . . 39 . O parsed_1sxe 1 25 1 2 . . . . . . . . . 43 . HN parsed_1sxe 1 26 1 1 . . . . . . . . . 39 . O parsed_1sxe 1 26 1 2 . . . . . . . . . 43 . N parsed_1sxe 1 27 1 1 . . . . . . . . . 81 . O parsed_1sxe 1 27 1 2 . . . . . . . . . 85 . HN parsed_1sxe 1 28 1 1 . . . . . . . . . 81 . O parsed_1sxe 1 28 1 2 . . . . . . . . . 85 . N parsed_1sxe 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 . . . . . 1.8 1.5 2.5 parsed_1sxe 1 2 1 . . . . . 2.8 2.5 3.5 parsed_1sxe 1 3 1 . . . . . 1.8 1.5 2.5 parsed_1sxe 1 4 1 . . . . . 2.8 2.5 3.5 parsed_1sxe 1 5 1 . . . . . 1.8 1.5 2.5 parsed_1sxe 1 6 1 . . . . . 2.8 2.5 3.5 parsed_1sxe 1 7 1 . . . . . 1.8 1.5 2.5 parsed_1sxe 1 8 1 . . . . . 2.8 2.5 3.5 parsed_1sxe 1 9 1 . . . . . 1.8 1.5 2.5 parsed_1sxe 1 10 1 . . . . . 2.8 2.5 3.5 parsed_1sxe 1 11 1 . . . . . 1.8 1.5 2.5 parsed_1sxe 1 12 1 . . . . . 2.8 2.5 3.5 parsed_1sxe 1 13 1 . . . . . 1.8 1.5 2.5 parsed_1sxe 1 14 1 . . . . . 2.8 2.5 3.5 parsed_1sxe 1 15 1 . . . . . 1.8 1.5 2.5 parsed_1sxe 1 16 1 . . . . . 2.8 2.5 3.5 parsed_1sxe 1 17 1 . . . . . 1.8 1.5 2.5 parsed_1sxe 1 18 1 . . . . . 2.8 2.5 3.5 parsed_1sxe 1 19 1 . . . . . 1.8 1.5 2.5 parsed_1sxe 1 20 1 . . . . . 2.8 2.5 3.5 parsed_1sxe 1 21 1 . . . . . 1.8 1.5 2.5 parsed_1sxe 1 22 1 . . . . . 2.8 2.5 3.5 parsed_1sxe 1 23 1 . . . . . 1.8 1.5 2.5 parsed_1sxe 1 24 1 . . . . . 2.8 2.5 3.5 parsed_1sxe 1 25 1 . . . . . 1.8 1.5 2.5 parsed_1sxe 1 26 1 . . . . . 2.8 2.5 3.5 parsed_1sxe 1 27 1 . . . . . 1.8 1.5 2.5 parsed_1sxe 1 28 1 . . . . . 2.8 2.5 3.5 parsed_1sxe 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 ; All these residues have HN-HN noe and their amide proton slowly exchanges in D2O -- the following remain after 30min. ; 1 1 3 2 parsed_1sxe 1 2 "these remain through to 2h" 18 1 18 28 parsed_1sxe 1 3 ; unknown partners assign ( resid 42 and name O ) ( resid 48 and name HN ) 1.8 0.3 0.7 assign ( resid 42 and name O ) ( resid 48 and name N ) 2.8 0.3 0.7 ; 31 1 33 68 parsed_1sxe 1 4 ; 3_10 helix? hbonds assign ( resid 52 and name O ) ( resid 55 and name HN ) 1.8 0.3 0.7 assign ( resid 52 and name O ) ( resid 55 and name N ) 2.8 0.3 0.7 assign ( resid 53 and name O ) ( resid 57 and name HN ) 1.8 0.3 0.7 assign ( resid 53 and name O ) ( resid 57 and name N ) 2.8 0.3 0.7 assign ( resid 54 and name O ) ( resid 58 and name HN ) 1.8 0.3 0.7 assign ( resid 54 and name O ) ( resid 58 and name N ) 2.8 0.3 0.7 assign ( resid 54 and name O ) ( resid 57 and name HN ) 1.8 0.3 0.7 assign ( resid 54 and name O ) ( resid 57 and name N ) 2.8 0.3 0.7 assign ( resid 55 and name O ) ( resid 58 and name HN ) 1.8 0.3 0.7 assign ( resid 55 and name O ) ( resid 58 and name N ) 2.8 0.3 0.7 ; 36 1 46 68 parsed_1sxe 1 stop_ save_
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