NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
617628 | 5uzz | 30258 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 33 |
data_5uzz_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_5uzz _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_5uzz 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_5uzz _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 5uzz "Master copy" parsed_5uzz stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_5uzz _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 5uzz.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5uzz 1 1 5uzz.mr . . XPLOR/CNS 2 distance NOE simple 35 parsed_5uzz 1 1 5uzz.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 12 parsed_5uzz 1 1 5uzz.mr . . XPLOR/CNS 4 distance NOE simple 236 parsed_5uzz 1 1 5uzz.mr . . XPLOR/CNS 5 distance "hydrogen bond" simple 33 parsed_5uzz 1 1 5uzz.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_5uzz 1 1 5uzz.mr . . XPLOR/CNS 7 distance NOE simple 0 parsed_5uzz 1 1 5uzz.mr . . XPLOR/CNS 8 planarity "Not applicable" "Not applicable" 0 parsed_5uzz 1 1 5uzz.mr . . "MR format" 9 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5uzz 1 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_5uzz _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_5uzz 1 2 1 . . . parsed_5uzz 1 3 1 . . . parsed_5uzz 1 4 1 . . . parsed_5uzz 1 5 1 . . . parsed_5uzz 1 6 1 . . . parsed_5uzz 1 7 1 . . . parsed_5uzz 1 8 1 . . . parsed_5uzz 1 9 1 . . . parsed_5uzz 1 10 1 . . . parsed_5uzz 1 11 1 . . . parsed_5uzz 1 12 1 . . . parsed_5uzz 1 13 1 . . . parsed_5uzz 1 14 1 . . . parsed_5uzz 1 15 1 . . . parsed_5uzz 1 16 1 . . . parsed_5uzz 1 17 1 . . . parsed_5uzz 1 18 1 . . . parsed_5uzz 1 19 1 . . . parsed_5uzz 1 20 1 . . . parsed_5uzz 1 21 1 . . . parsed_5uzz 1 22 1 . . . parsed_5uzz 1 23 1 . . . parsed_5uzz 1 24 1 . . . parsed_5uzz 1 25 1 . . . parsed_5uzz 1 26 1 . . . parsed_5uzz 1 27 1 . . . parsed_5uzz 1 28 1 . . . parsed_5uzz 1 29 1 . . . parsed_5uzz 1 30 1 . . . parsed_5uzz 1 31 1 . . . parsed_5uzz 1 32 1 . . . parsed_5uzz 1 33 1 . . . parsed_5uzz 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 . . . . . . . . . 22 . N1 parsed_5uzz 1 1 1 2 . . . . . . . . . 52 . N3 parsed_5uzz 1 2 1 1 . . . . . . . . . 22 . H1 parsed_5uzz 1 2 1 2 . . . . . . . . . 52 . N3 parsed_5uzz 1 3 1 1 . . . . . . . . . 22 . O6 parsed_5uzz 1 3 1 2 . . . . . . . . . 52 . N4 parsed_5uzz 1 4 1 1 . . . . . . . . . 22 . N2 parsed_5uzz 1 4 1 2 . . . . . . . . . 52 . O2 parsed_5uzz 1 5 1 1 . . . . . . . . . 22 . N2 parsed_5uzz 1 5 1 2 . . . . . . . . . 52 . N3 parsed_5uzz 1 6 1 1 . . . . . . . . . 22 . O6 parsed_5uzz 1 6 1 2 . . . . . . . . . 52 . N3 parsed_5uzz 1 7 1 1 . . . . . . . . . 23 . N1 parsed_5uzz 1 7 1 2 . . . . . . . . . 51 . N3 parsed_5uzz 1 8 1 1 . . . . . . . . . 23 . H1 parsed_5uzz 1 8 1 2 . . . . . . . . . 51 . N3 parsed_5uzz 1 9 1 1 . . . . . . . . . 23 . O6 parsed_5uzz 1 9 1 2 . . . . . . . . . 51 . N4 parsed_5uzz 1 10 1 1 . . . . . . . . . 23 . N2 parsed_5uzz 1 10 1 2 . . . . . . . . . 51 . O2 parsed_5uzz 1 11 1 1 . . . . . . . . . 23 . N2 parsed_5uzz 1 11 1 2 . . . . . . . . . 51 . N3 parsed_5uzz 1 12 1 1 . . . . . . . . . 23 . O6 parsed_5uzz 1 12 1 2 . . . . . . . . . 51 . N3 parsed_5uzz 1 13 1 1 . . . . . . . . . 24 . N3 parsed_5uzz 1 13 1 2 . . . . . . . . . 50 . N1 parsed_5uzz 1 14 1 1 . . . . . . . . . 24 . O4 parsed_5uzz 1 14 1 2 . . . . . . . . . 50 . N6 parsed_5uzz 1 15 1 1 . . . . . . . . . 24 . H3 parsed_5uzz 1 15 1 2 . . . . . . . . . 50 . N1 parsed_5uzz 1 16 1 1 . . . . . . . . . 25 . N1 parsed_5uzz 1 16 1 2 . . . . . . . . . 49 . N3 parsed_5uzz 1 17 1 1 . . . . . . . . . 25 . H1 parsed_5uzz 1 17 1 2 . . . . . . . . . 49 . N3 parsed_5uzz 1 18 1 1 . . . . . . . . . 25 . O6 parsed_5uzz 1 18 1 2 . . . . . . . . . 49 . N4 parsed_5uzz 1 19 1 1 . . . . . . . . . 25 . N2 parsed_5uzz 1 19 1 2 . . . . . . . . . 49 . O2 parsed_5uzz 1 20 1 1 . . . . . . . . . 25 . N2 parsed_5uzz 1 20 1 2 . . . . . . . . . 49 . N3 parsed_5uzz 1 21 1 1 . . . . . . . . . 25 . O6 parsed_5uzz 1 21 1 2 . . . . . . . . . 49 . N3 parsed_5uzz 1 22 1 1 . . . . . . . . . 26 . N3 parsed_5uzz 1 22 1 2 . . . . . . . . . 48 . N1 parsed_5uzz 1 23 1 1 . . . . . . . . . 26 . O4 parsed_5uzz 1 23 1 2 . . . . . . . . . 48 . N6 parsed_5uzz 1 24 1 1 . . . . . . . . . 26 . H3 parsed_5uzz 1 24 1 2 . . . . . . . . . 48 . N1 parsed_5uzz 1 25 1 1 . . . . . . . . . 27 . N3 parsed_5uzz 1 25 1 2 . . . . . . . . . 47 . N1 parsed_5uzz 1 26 1 1 . . . . . . . . . 27 . O4 parsed_5uzz 1 26 1 2 . . . . . . . . . 47 . N6 parsed_5uzz 1 27 1 1 . . . . . . . . . 27 . H3 parsed_5uzz 1 27 1 2 . . . . . . . . . 47 . N1 parsed_5uzz 1 28 1 1 . . . . . . . . . 28 . n1 parsed_5uzz 1 28 1 2 . . . . . . . . . 46 . n3 parsed_5uzz 1 29 1 1 . . . . . . . . . 28 . h1 parsed_5uzz 1 29 1 2 . . . . . . . . . 46 . n3 parsed_5uzz 1 30 1 1 . . . . . . . . . 28 . o6 parsed_5uzz 1 30 1 2 . . . . . . . . . 46 . n4 parsed_5uzz 1 31 1 1 . . . . . . . . . 28 . n2 parsed_5uzz 1 31 1 2 . . . . . . . . . 46 . o2 parsed_5uzz 1 32 1 1 . . . . . . . . . 28 . n2 parsed_5uzz 1 32 1 2 . . . . . . . . . 46 . n3 parsed_5uzz 1 33 1 1 . . . . . . . . . 28 . o6 parsed_5uzz 1 33 1 2 . . . . . . . . . 46 . n3 parsed_5uzz 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 . . . . . 2.87 2.67 3.07 parsed_5uzz 1 2 1 . . . . . 1.86 1.66 2.06 parsed_5uzz 1 3 1 . . . . . 2.81 2.61 3.01 parsed_5uzz 1 4 1 . . . . . 2.81 2.61 3.01 parsed_5uzz 1 5 1 . . . . . 3.58 3.38 3.78 parsed_5uzz 1 6 1 . . . . . 3.63 3.43 3.83 parsed_5uzz 1 7 1 . . . . . 2.87 2.67 3.07 parsed_5uzz 1 8 1 . . . . . 1.86 1.66 2.06 parsed_5uzz 1 9 1 . . . . . 2.81 2.61 3.01 parsed_5uzz 1 10 1 . . . . . 2.81 2.61 3.01 parsed_5uzz 1 11 1 . . . . . 3.58 3.38 3.78 parsed_5uzz 1 12 1 . . . . . 3.63 3.43 3.83 parsed_5uzz 1 13 1 . . . . . 2.73 2.53 2.93 parsed_5uzz 1 14 1 . . . . . 2.92 2.72 3.12 parsed_5uzz 1 15 1 . . . . . 1.73 1.53 1.93 parsed_5uzz 1 16 1 . . . . . 2.87 2.67 3.07 parsed_5uzz 1 17 1 . . . . . 1.86 1.66 2.06 parsed_5uzz 1 18 1 . . . . . 2.81 2.61 3.01 parsed_5uzz 1 19 1 . . . . . 2.81 2.61 3.01 parsed_5uzz 1 20 1 . . . . . 3.58 3.38 3.78 parsed_5uzz 1 21 1 . . . . . 3.63 3.43 3.83 parsed_5uzz 1 22 1 . . . . . 2.73 2.53 2.93 parsed_5uzz 1 23 1 . . . . . 2.92 2.72 3.12 parsed_5uzz 1 24 1 . . . . . 1.73 1.53 1.93 parsed_5uzz 1 25 1 . . . . . 2.73 2.53 2.93 parsed_5uzz 1 26 1 . . . . . 2.92 2.72 3.12 parsed_5uzz 1 27 1 . . . . . 1.73 1.53 1.93 parsed_5uzz 1 28 1 . . . . . 2.87 2.67 3.07 parsed_5uzz 1 29 1 . . . . . 1.86 1.66 2.06 parsed_5uzz 1 30 1 . . . . . 2.81 2.61 3.01 parsed_5uzz 1 31 1 . . . . . 2.81 2.61 3.01 parsed_5uzz 1 32 1 . . . . . 3.58 3.38 3.78 parsed_5uzz 1 33 1 . . . . . 3.63 3.43 3.83 parsed_5uzz 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 ; pre-miR21 RNA base-pair H-Bond restraints. ******** strong base-pairs in the lower-stem G22 - C52 ; 2 1 6 12 parsed_5uzz 1 2 "G23 - C51" 14 1 14 12 parsed_5uzz 1 3 "U24 - A50" 22 1 22 12 parsed_5uzz 1 4 "G25 - C49" 27 1 27 12 parsed_5uzz 1 5 "U26 - A48" 35 1 35 12 parsed_5uzz 1 6 "U27 - A47" 40 1 40 12 parsed_5uzz 1 7 "G28 - C46" 45 1 45 12 parsed_5uzz 1 8 ; A29 !!NOTE: The upper stem of miR21 appears to remain open with no base pairing based !! on both low temp water NOESY and 15N HSQC data. C30 - G45 assign (residue 30 and name N3) (residue 45 and name N1) 2.87 0.2 0.2 assign (residue 30 and name N3) (residue 45 and name N1) 1.86 0.2 0.2 assign (residue 30 and name N4) (residue 45 and name O6) 2.81 0.2 0.2 assign (residue 30 and name h41) (residue 45 and name O6) 1.86 0.2 0.2 assign (residue 30 and name O2) (residue 45 and name N2) 2.81 0.2 0.2 assign (residue 30 and name o2) (residue 45 and name h21) 1.86 0.2 0.2 U31 - G44 assign (residue 31 and name H3) (residue 44 and name O6) 1.9 0.1 0.30 assign (residue 31 and name N3) (residue 44 and name O6) 3.0 0.28 0.08 assign (residue 31 and name O2) (residue 44 and name H1) 1.9 0.1 0.30 assign (residue 31 and name O2) (residue 44 and name N1) 3.0 0.28 0.08 G32 - U43 assign (residue 32 and name O6) (residue 43 and name H3) 1.9 0.1 0.30 assign (residue 32 and name O6) (residue 43 and name N3) 3.0 0.28 0.08 assign (residue 32 and name H1) (residue 43 and name O2) 1.9 0.1 0.30 assign (residue 32 and name N1) (residue 43 and name O2) 3.0 0.28 0.08 U33 - A42 assign (residue 33 and name N3) (residue 42 and name N1) 2.73 0.2 0.2 assign (residue 33 and name O4) (residue 42 and name N6) 2.92 0.2 0.2 assign (residue 33 and name H3) (residue 42 and name N1) 1.73 0.2 0.2 assign (residue 33 and name O4) (residue 42 and name H61) 1.73 0.2 0.2 U34 G35 - C41 assign (residue 14 and name n1) (residue 20 and name n3) 2.87 .2 .2 assign (residue 14 and name h1) (residue 20 and name n3) 1.86 0.2 0.2 assign (residue 14 and name o6) (residue 20 and name n4) 2.81 .2 .2 assign (residue 14 and name n2) (residue 20 and name o2) 2.81 .2 .2 assign (residue 14 and name n2) (residue 20 and name n3) 3.58 0.2 0.2 assign (residue 14 and name o6) (residue 20 and name n3) 3.63 0.2 0.2 ; 53 1 92 71 parsed_5uzz 1 stop_ loop_ _Dist_constraint_parse_err.ID _Dist_constraint_parse_err.Content _Dist_constraint_parse_err.Begin_line _Dist_constraint_parse_err.Begin_column _Dist_constraint_parse_err.End_line _Dist_constraint_parse_err.End_column _Dist_constraint_parse_err.Entry_ID _Dist_constraint_parse_err.Distance_constraint_list_ID 1 "# Restraints file 2: miR21_hb_lower.tbl" 1 1 1 39 parsed_5uzz 1 stop_ save_
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