NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
29906 | 1bjh | cing | 2-parsed | STAR | dihedral angle | 49 |
data_1bjh_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_1bjh _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_1bjh 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_1bjh _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 1bjh "Master copy" parsed_1bjh stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_1bjh _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 1bjh.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1bjh 1 1 1bjh.mr . . DISCOVER 2 distance "hydrogen bond" simple 11 parsed_1bjh 1 1 1bjh.mr . . DISCOVER 3 distance NOE simple 159 parsed_1bjh 1 1 1bjh.mr . . DISCOVER 4 distance "general distance" simple 13 parsed_1bjh 1 1 1bjh.mr . . DISCOVER 5 "dihedral angle" "Not applicable" "Not applicable" 49 parsed_1bjh 1 1 1bjh.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1bjh 1 stop_ save_ save_Discover_dihedral_5 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_1bjh _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 5 _Torsion_angle_constraint_list.Details "Generated by Wattos" loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Assembly_atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Seq_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Resonance_ID_1 _Torsion_angle_constraint.Assembly_atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Seq_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Resonance_ID_2 _Torsion_angle_constraint.Assembly_atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Seq_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Resonance_ID_3 _Torsion_angle_constraint.Assembly_atom_ID_4 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Seq_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Resonance_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Source_experiment_ID _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 6 A O3' 1 7 A P 1 7 A O5' 1 7 A C5' parsed_1bjh 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 7 A O5' 1 7 A C5' 1 7 A C4' 1 7 A C3' parsed_1bjh 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 7 A C4' 1 7 A C3' 1 7 A O3' 1 8 G P parsed_1bjh 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 7 A C3' 1 7 A O3' 1 8 G P 1 8 G O5' parsed_1bjh 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 5 A O3' 1 6 A P 1 6 A O5' 1 6 A C5' parsed_1bjh 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 -150.0 . 1 6 A P 1 6 A O5' 1 6 A C5' 1 6 A C4' parsed_1bjh 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 6 A O5' 1 6 A C5' 1 6 A C4' 1 6 A C3' parsed_1bjh 1 8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 6 A C4' 1 6 A C3' 1 6 A O3' 1 7 A P parsed_1bjh 1 9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 6 A C3' 1 6 A O3' 1 7 A P 1 7 A O5' parsed_1bjh 1 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 4 C O3' 1 5 A P 1 5 A O5' 1 5 A C5' parsed_1bjh 1 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -150.0 . 1 5 A P 1 5 A O5' 1 5 A C5' 1 5 A C4' parsed_1bjh 1 12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 5 A O5' 1 5 A C5' 1 5 A C4' 1 5 A C3' parsed_1bjh 1 13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 5 A C4' 1 5 A C3' 1 5 A O3' 1 6 A P parsed_1bjh 1 14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 5 A C3' 1 5 A O3' 1 6 A P 1 6 A O5' parsed_1bjh 1 15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 3 A O3' 1 4 C P 1 4 C O5' 1 4 C C5' parsed_1bjh 1 16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -150.0 . 1 4 C P 1 4 C O5' 1 4 C C5' 1 4 C C4' parsed_1bjh 1 17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 4 C O5' 1 4 C C5' 1 4 C C4' 1 4 C C3' parsed_1bjh 1 18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 4 C C4' 1 4 C C3' 1 4 C O3' 1 5 A P parsed_1bjh 1 19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 4 C C3' 1 4 C O3' 1 5 A P 1 5 A O5' parsed_1bjh 1 20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 2 T O3' 1 3 A P 1 3 A O5' 1 3 A C5' parsed_1bjh 1 21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -150.0 . 1 3 A P 1 3 A O5' 1 3 A C5' 1 3 A C4' parsed_1bjh 1 22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 3 A O5' 1 3 A C5' 1 3 A C4' 1 3 A C3' parsed_1bjh 1 23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 3 A C4' 1 3 A C3' 1 3 A O3' 1 4 C P parsed_1bjh 1 24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 3 A C3' 1 3 A O3' 1 4 C P 1 4 C O5' parsed_1bjh 1 25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 1 G5' O3' 1 2 T P 1 2 T O5' 1 2 T C5' parsed_1bjh 1 26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -150.0 . 1 2 T P 1 2 T O5' 1 2 T C5' 1 2 T C4' parsed_1bjh 1 27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 2 T O5' 1 2 T C5' 1 2 T C4' 1 2 T C3' parsed_1bjh 1 28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 2 T C4' 1 2 T C3' 1 2 T O3' 1 3 A P parsed_1bjh 1 29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 2 T C3' 1 2 T O3' 1 3 A P 1 3 A O5' parsed_1bjh 1 30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.0 -110.0 . 1 1 G5' C4' 1 1 G5' C3' 1 1 G5' O3' 1 2 T P parsed_1bjh 1 31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 1 G5' C3' 1 1 G5' O3' 1 2 T P 1 2 T O5' parsed_1bjh 1 32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 7 A O3' 1 8 G P 1 8 G O5' 1 8 G C5' parsed_1bjh 1 33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -150.0 . 1 8 G P 1 8 G O5' 1 8 G C5' 1 8 G C4' parsed_1bjh 1 34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 8 G O5' 1 8 G C5' 1 8 G C4' 1 8 G C3' parsed_1bjh 1 35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 8 G C4' 1 8 G C3' 1 8 G O3' 1 9 T P parsed_1bjh 1 36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 8 G C3' 1 8 G O3' 1 9 T P 1 9 T O5' parsed_1bjh 1 37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 8 G O3' 1 9 T P 1 9 T O5' 1 9 T C5' parsed_1bjh 1 38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -150.0 . 1 9 T P 1 9 T O5' 1 9 T C5' 1 9 T C4' parsed_1bjh 1 39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 9 T O5' 1 9 T C5' 1 9 T C4' 1 9 T C3' parsed_1bjh 1 40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 9 T C4' 1 9 T C3' 1 9 T O3' 1 10 A P parsed_1bjh 1 41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 9 T C3' 1 9 T O3' 1 10 A P 1 10 A O5' parsed_1bjh 1 42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 9 T O3' 1 10 A P 1 10 A O5' 1 10 A C5' parsed_1bjh 1 43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -150.0 . 1 10 A P 1 10 A O5' 1 10 A C5' 1 10 A C4' parsed_1bjh 1 44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 10 A O5' 1 10 A C5' 1 10 A C4' 1 10 A C3' parsed_1bjh 1 45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 -160.0 . 1 10 A C4' 1 10 A C3' 1 10 A O3' 1 11 C3' P parsed_1bjh 1 46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 10 A C3' 1 10 A O3' 1 11 C3' P 1 11 C3' O5' parsed_1bjh 1 47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . 1 10 A O3' 1 11 C3' P 1 11 C3' O5' 1 11 C3' C5' parsed_1bjh 1 48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.0 -100.0 . 1 11 C3' P 1 11 C3' O5' 1 11 C3' C5' 1 11 C3' C4' parsed_1bjh 1 49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 10.0 110.0 . 1 11 C3' O5' 1 11 C3' C5' 1 11 C3' C4' 1 11 C3' C3' parsed_1bjh 1 stop_ loop_ _TA_constraint_comment_org.ID _TA_constraint_comment_org.Comment_text _TA_constraint_comment_org.Comment_begin_line _TA_constraint_comment_org.Comment_begin_column _TA_constraint_comment_org.Comment_end_line _TA_constraint_comment_org.Comment_end_column _TA_constraint_comment_org.Entry_ID _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 1 ; NMR_dihedral 7A alpha ; 1 1 3 6 parsed_1bjh 1 2 ; beta temp 1:A_7:P 1:A_7:O5' 1:A_7:C5' 1:A_7:C4' 30.0 90.0 10.00 10.00 100.00 gamma ; 5 1 7 6 parsed_1bjh 1 3 epsilo 9 1 9 7 parsed_1bjh 1 4 zeta 11 1 11 5 parsed_1bjh 1 5 ; ! ! 6A Alpha ; 13 1 16 6 parsed_1bjh 1 6 "beta temp" 18 1 18 10 parsed_1bjh 1 7 gamma 20 1 20 6 parsed_1bjh 1 8 epsilo 22 1 22 7 parsed_1bjh 1 9 zeta 24 1 24 5 parsed_1bjh 1 10 ; ! ! 5A alpha ; 26 1 29 6 parsed_1bjh 1 11 "beta temp" 31 1 31 10 parsed_1bjh 1 12 gamma 33 1 33 6 parsed_1bjh 1 13 epsilo 35 1 35 7 parsed_1bjh 1 14 zeta 37 1 37 5 parsed_1bjh 1 15 ; ! ! 4C alpha ; 39 1 42 6 parsed_1bjh 1 16 "beta temp" 44 1 44 10 parsed_1bjh 1 17 gamma 46 1 46 6 parsed_1bjh 1 18 epsilo 48 1 48 7 parsed_1bjh 1 19 zeta 50 1 50 5 parsed_1bjh 1 20 ; ! ! 3A alpha ; 52 1 55 6 parsed_1bjh 1 21 "beta temp" 57 1 57 10 parsed_1bjh 1 22 gamma 59 1 59 6 parsed_1bjh 1 23 epsilo 61 1 61 7 parsed_1bjh 1 24 zeta 63 1 63 5 parsed_1bjh 1 25 ; ! ! 2T alpha ; 65 1 68 6 parsed_1bjh 1 26 "beta temp" 70 1 70 10 parsed_1bjh 1 27 gamma 72 1 72 6 parsed_1bjh 1 28 epsilo 74 1 74 7 parsed_1bjh 1 29 zeta 76 1 76 5 parsed_1bjh 1 30 ; ! ! 1G epsilo ; 78 1 81 7 parsed_1bjh 1 31 zeta 83 1 83 5 parsed_1bjh 1 32 ; ! ! 8G alpha ; 85 1 88 6 parsed_1bjh 1 33 "beta temp" 90 1 90 10 parsed_1bjh 1 34 gamma 92 1 92 6 parsed_1bjh 1 35 epsilo 94 1 94 7 parsed_1bjh 1 36 zeta 96 1 96 5 parsed_1bjh 1 37 ; ! ! 9T alpha ; 98 1 101 6 parsed_1bjh 1 38 "beta temp" 103 1 103 10 parsed_1bjh 1 39 gamma 105 1 105 6 parsed_1bjh 1 40 epsilo 107 1 107 7 parsed_1bjh 1 41 zeta 109 1 109 5 parsed_1bjh 1 42 ; ! ! 10A alpha ; 111 1 114 6 parsed_1bjh 1 43 "beta temp" 116 1 116 10 parsed_1bjh 1 44 gamma 118 1 118 6 parsed_1bjh 1 45 epsilo 120 1 120 7 parsed_1bjh 1 46 zeta 122 1 122 5 parsed_1bjh 1 47 ; ! ! 11C alpha ; 124 1 127 6 parsed_1bjh 1 48 "beta temp" 129 1 129 10 parsed_1bjh 1 49 gamma 131 1 131 6 parsed_1bjh 1 stop_ save_
Contact the webmaster for help, if required. Thursday, May 23, 2024 4:33:43 PM GMT (wattos1)