NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
644202 | 6l8m | cing | 2-parsed | STAR | dihedral angle | 38 |
data_6l8m_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_6l8m _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_6l8m 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_6l8m _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 6l8m "Master copy" parsed_6l8m stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_6l8m _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 6l8m.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6l8m 1 1 6l8m.mr . . XPLOR/CNS 2 distance NOE simple 54 parsed_6l8m 1 1 6l8m.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 38 parsed_6l8m 1 1 6l8m.mr . . XPLOR/CNS 4 distance NOE simple 0 parsed_6l8m 1 1 6l8m.mr . . XPLOR/CNS 5 planarity "Not applicable" "Not applicable" 0 parsed_6l8m 1 1 6l8m.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6l8m 1 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_6l8m _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 3 _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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.00 100.00 . . 1 . O4' . 1 . C1' . 1 . N9 . 1 . C4 parsed_6l8m 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.00 100.00 . . 2 . O4' . 2 . C1' . 2 . N9 . 2 . C4 parsed_6l8m 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 180.0 300.0 . . 3 . O4' . 3 . C1' . 3 . N9 . 3 . C4 parsed_6l8m 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 180.0 300.0 . . 9 . O4' . 9 . C1' . 9 . N9 . 9 . C4 parsed_6l8m 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 180.0 300.0 . . 10 . O4' . 10 . C1' . 10 . N9 . 10 . C4 parsed_6l8m 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 180.0 300.0 . . 11 . O4' . 11 . C1' . 11 . N9 . 11 . C4 parsed_6l8m 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.00 100.00 . . 14 . O4' . 14 . C1' . 14 . N9 . 14 . C4 parsed_6l8m 1 8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 170.00 310.00 . . 16 . O4' . 16 . C1' . 16 . N9 . 16 . C4 parsed_6l8m 1 9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 180.0 300.0 . . 17 . O4' . 17 . C1' . 17 . N9 . 17 . C4 parsed_6l8m 1 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 180.0 300.0 . . 18 . O4' . 18 . C1' . 18 . N9 . 18 . C4 parsed_6l8m 1 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 180.0 300.0 . . 20 . O4' . 20 . C1' . 20 . N9 . 20 . C4 parsed_6l8m 1 12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 180.0 300.0 . . 21 . O4' . 21 . C1' . 21 . N9 . 21 . C4 parsed_6l8m 1 13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 180.0 300.0 . . 22 . O4' . 22 . C1' . 22 . N9 . 22 . C4 parsed_6l8m 1 14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . . 1 . H1' . 1 . C1' . 1 . N9 . 1 . C4 parsed_6l8m 1 15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . . 2 . H1' . 2 . C1' . 2 . N9 . 2 . C4 parsed_6l8m 1 16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 60.0 . . 3 . H1' . 3 . C1' . 3 . N9 . 3 . C4 parsed_6l8m 1 17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 60.0 . . 9 . H1' . 9 . C1' . 9 . N9 . 9 . C4 parsed_6l8m 1 18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 60.0 . . 10 . H1' . 10 . C1' . 10 . N9 . 10 . C4 parsed_6l8m 1 19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 60.0 . . 11 . H1' . 11 . C1' . 11 . N9 . 11 . C4 parsed_6l8m 1 20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . . 14 . H1' . 14 . C1' . 14 . N9 . 14 . C4 parsed_6l8m 1 21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 60.0 . . 16 . H1' . 16 . C1' . 16 . N9 . 16 . C4 parsed_6l8m 1 22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 60.0 . . 17 . H1' . 17 . C1' . 17 . N9 . 17 . C4 parsed_6l8m 1 23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 60.0 . . 18 . H1' . 18 . C1' . 18 . N9 . 18 . C4 parsed_6l8m 1 24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 60.0 . . 20 . H1' . 20 . C1' . 20 . N9 . 20 . C4 parsed_6l8m 1 25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 60.0 . . 21 . H1' . 21 . C1' . 21 . N9 . 21 . C4 parsed_6l8m 1 26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 60.0 . . 22 . H1' . 22 . C1' . 22 . N9 . 22 . C4 parsed_6l8m 1 27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 300.0 . . 1 . C4' . 1 . C3' . 1 . O3' . 2 . P parsed_6l8m 1 28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 300.0 . . 2 . C4' . 2 . C3' . 2 . O3' . 3 . P parsed_6l8m 1 29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 300.0 . . 3 . C4' . 3 . C3' . 3 . O3' . 4 . P parsed_6l8m 1 30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 300.0 . . 10 . C4' . 10 . C3' . 10 . O3' . 11 . P parsed_6l8m 1 31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 300.0 . . 9 . C4' . 9 . C3' . 9 . O3' . 10 . P parsed_6l8m 1 32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 300.0 . . 11 . C4' . 11 . C3' . 11 . O3' . 12 . P parsed_6l8m 1 33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 300.0 . . 14 . C4' . 14 . C3' . 14 . O3' . 15 . P parsed_6l8m 1 34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 300.0 . . 16 . C4' . 16 . C3' . 16 . O3' . 17 . P parsed_6l8m 1 35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 300.0 . . 17 . C4' . 17 . C3' . 17 . O3' . 18 . P parsed_6l8m 1 36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 300.0 . . 18 . C4' . 18 . C3' . 18 . O3' . 19 . P parsed_6l8m 1 37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 300.0 . . 20 . C4' . 20 . C3' . 20 . O3' . 21 . P parsed_6l8m 1 38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 300.0 . . 21 . C4' . 21 . C3' . 21 . O3' . 22 . P parsed_6l8m 1 stop_ loop_ _TA_constraint_parse_err.ID _TA_constraint_parse_err.Content _TA_constraint_parse_err.Begin_line _TA_constraint_parse_err.Begin_column _TA_constraint_parse_err.End_line _TA_constraint_parse_err.End_column _TA_constraint_parse_err.Entry_ID _TA_constraint_parse_err.Torsion_angle_constraint_list_ID 1 ; # Restraints file 3: D_1300014324_mr_P4.xplor-nih.V1 restraints dihedral ; 1 1 2 19 parsed_6l8m 1 2 end 202 1 202 3 parsed_6l8m 1 stop_ save_
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