NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
545643 | 1ud7 | 4493 | cing | 2-parsed | STAR | dihedral angle | 45 |
data_1ud7_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_1ud7 _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_1ud7 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_1ud7 _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 1ud7 "Master copy" parsed_1ud7 stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_1ud7 _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 1ud7.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1ud7 1 1 1ud7.mr . . XPLOR/CNS 2 "dipolar coupling" "Not applicable" "Not applicable" 63 parsed_1ud7 1 1 1ud7.mr . . n/a 3 comment "Not applicable" "Not applicable" 0 parsed_1ud7 1 1 1ud7.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 48 parsed_1ud7 1 1 1ud7.mr . . n/a 5 comment "Not applicable" "Not applicable" 0 parsed_1ud7 1 1 1ud7.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 45 parsed_1ud7 1 1 1ud7.mr . . XPLOR/CNS 7 distance "hydrogen bond" ambi 0 parsed_1ud7 1 1 1ud7.mr . . XPLOR/CNS 8 distance NOE ambi 0 parsed_1ud7 1 1 1ud7.mr . . "MR format" 9 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1ud7 1 stop_ save_ save_CNS/XPLOR_dihedral_6 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_1ud7 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 6 _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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 3 . HA . 3 . CA . 3 . CB . 3 . HB parsed_1ud7 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 320.0 . . 13 . HA . 13 . CA . 13 . CB . 13 . HB parsed_1ud7 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 17 . HA . 17 . CA . 17 . CB . 17 . HB parsed_1ud7 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 23 . HA . 23 . CA . 23 . CB . 23 . HB parsed_1ud7 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 9 . N . 9 . CA . 9 . CB . 9 . OG1 parsed_1ud7 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -40.0 . . 12 . N . 12 . CA . 12 . CB . 12 . OG1 parsed_1ud7 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 22 . N . 22 . CA . 22 . CB . 22 . OG1 parsed_1ud7 1 8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 55 . N . 55 . CA . 55 . CB . 55 . OG1 parsed_1ud7 1 9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -40.0 . . 15 . N . 15 . CA . 15 . CB . 15 . CG1 parsed_1ud7 1 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 30 . N . 30 . CA . 30 . CB . 30 . CG1 parsed_1ud7 1 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 36 . N . 36 . CA . 36 . CB . 36 . CG1 parsed_1ud7 1 12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -40.0 . . 44 . N . 44 . CA . 44 . CB . 44 . CG1 parsed_1ud7 1 13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 61 . N . 61 . CA . 61 . CB . 61 . CG1 parsed_1ud7 1 14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 67 . N . 67 . CA . 67 . CB . 67 . CG1 parsed_1ud7 1 15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 4 . N . 4 . CA . 4 . CB . 4 . CG parsed_1ud7 1 16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 5 . N . 5 . CA . 5 . CB . 5 . CG parsed_1ud7 1 17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 8 . N . 8 . CA . 8 . CB . 8 . CG parsed_1ud7 1 18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 18 . N . 18 . CA . 18 . CB . 18 . CG parsed_1ud7 1 19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 20 . N . 20 . CA . 20 . CB . 20 . OG parsed_1ud7 1 20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 21 . N . 21 . CA . 21 . CB . 21 . CG parsed_1ud7 1 21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 26 . N . 26 . CA . 26 . CB . 26 . CG parsed_1ud7 1 22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 27 . N . 27 . CA . 27 . CB . 27 . CG parsed_1ud7 1 23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 29 . N . 29 . CA . 29 . CB . 29 . CG parsed_1ud7 1 24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 31 . N . 31 . CA . 31 . CB . 31 . CG parsed_1ud7 1 25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 33 . N . 33 . CA . 33 . CB . 33 . CG parsed_1ud7 1 26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 34 . N . 34 . CA . 34 . CB . 34 . CG parsed_1ud7 1 27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 41 . N . 41 . CA . 41 . CB . 41 . CG parsed_1ud7 1 28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 43 . N . 43 . CA . 43 . CB . 43 . CG parsed_1ud7 1 29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 50 . N . 50 . CA . 50 . CB . 50 . CG parsed_1ud7 1 30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 51 . N . 51 . CA . 51 . CB . 51 . CG parsed_1ud7 1 31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 52 . N . 52 . CA . 52 . CB . 52 . CG parsed_1ud7 1 32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 56 . N . 56 . CA . 56 . CB . 56 . CG parsed_1ud7 1 33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 57 . N . 57 . CA . 57 . CB . 57 . OG parsed_1ud7 1 34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 58 . N . 58 . CA . 58 . CB . 58 . CG parsed_1ud7 1 35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 59 . N . 59 . CA . 59 . CB . 59 . CG parsed_1ud7 1 36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 62 . N . 62 . CA . 62 . CB . 62 . CG parsed_1ud7 1 37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 64 . N . 64 . CA . 64 . CB . 64 . CG parsed_1ud7 1 38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 65 . N . 65 . CA . 65 . CB . 65 . OG parsed_1ud7 1 39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 69 . N . 69 . CA . 69 . CB . 69 . CG parsed_1ud7 1 40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 5 . CA . 5 . CB . 5 . CG . 5 . HG parsed_1ud7 1 41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 8 . CA . 8 . CB . 8 . CG . 8 . HG parsed_1ud7 1 42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 43 . CA . 43 . CB . 43 . CG . 43 . HG parsed_1ud7 1 43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 69 . CA . 69 . CB . 69 . CG . 69 . HG parsed_1ud7 1 44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . . 30 . CA . 30 . CB . 30 . CG1 . 30 . CD1 parsed_1ud7 1 45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . . 61 . CA . 61 . CB . 61 . CG1 . 61 . CD1 parsed_1ud7 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 Valines 1 1 1 1 parsed_1ud7 1 2 Threonines 17 1 17 1 parsed_1ud7 1 3 Isoleucines 32 1 32 1 parsed_1ud7 1 4 "OTHER chi1's" 52 1 52 1 parsed_1ud7 1 5 "chi 2's" 129 1 129 1 parsed_1ud7 1 6 ; 9/16/97 - I'm changing the chi1 definition for Val to be between HA and HB, and the chi2 definition for Leu to be between CA and HG, so I can try swapping the methyls and not screw up the dihedral data. The new chi1's are the same value as before, but the Leu chi2's are the old values minus 120. ; 130 1 130 1 parsed_1ud7 1 7 Leu's 135 1 135 1 parsed_1ud7 1 8 Ile's 148 1 148 1 parsed_1ud7 1 9 hbonds_103097.tbl 154 1 154 19 parsed_1ud7 1 stop_ save_
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