NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
35444 | 1lkq | 1344 | cing | 2-parsed | STAR | dihedral angle | 31 |
data_1lkq_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_1lkq _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_1lkq 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_1lkq _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 1lkq "Master copy" parsed_1lkq stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_1lkq _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 1lkq.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1lkq 1 1 1lkq.mr . . DISCOVER 2 stereochemistry prochirality "Not applicable" 0 parsed_1lkq 1 1 1lkq.mr . . DISCOVER 3 stereochemistry chirality "Not applicable" 0 parsed_1lkq 1 1 1lkq.mr . . DISCOVER 4 distance "general distance" simple 47 parsed_1lkq 1 1 1lkq.mr . . DISCOVER 5 distance "hydrogen bond" simple 34 parsed_1lkq 1 1 1lkq.mr . . DISCOVER 6 distance NOE simple 329 parsed_1lkq 1 1 1lkq.mr . . n/a 7 comment "Not applicable" "Not applicable" 0 parsed_1lkq 1 1 1lkq.mr . . DISCOVER 8 "dihedral angle" "Not applicable" "Not applicable" 31 parsed_1lkq 1 1 1lkq.mr . . "MR format" 9 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1lkq 1 stop_ save_ save_Discover_dihedral_8 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_1lkq _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 8 _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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.000 -40.000 . 1 12 SER C 1 13 LEU N 1 13 LEU CA 1 13 LEU C parsed_1lkq 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.000 -40.000 . 1 13 LEU C 1 14 TYR N 1 14 TYR CA 1 14 TYR C parsed_1lkq 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.000 -40.000 . 1 14 TYR C 1 15 GLN N 1 15 GLN CA 1 15 GLN C parsed_1lkq 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.000 -40.000 . 1 15 GLN C 1 16 LEU N 1 16 LEU CA 1 16 LEU C parsed_1lkq 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.000 -40.000 . 1 16 LEU C 1 17 GLU- N 1 17 GLU- CA 1 17 GLU- C parsed_1lkq 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.000 -40.000 . 1 17 GLU- C 1 18 ASN N 1 18 ASN CA 1 18 ASN C parsed_1lkq 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.000 -40.000 . 1 18 ASN C 1 19 TYR N 1 19 TYR CA 1 19 TYR C parsed_1lkq 1 8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.000 -40.000 . 1 31 ASP- C 1 32 LEU N 1 32 LEU CA 1 32 LEU C parsed_1lkq 1 9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.000 -40.000 . 1 32 LEU C 1 33 VAL N 1 33 VAL CA 1 33 VAL C parsed_1lkq 1 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.000 -40.000 . 1 33 VAL C 1 34 GLU- N 1 34 GLU- CA 1 34 GLU- C parsed_1lkq 1 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.000 -40.000 . 1 34 GLU- C 1 35 ALA N 1 35 ALA CA 1 35 ALA C parsed_1lkq 1 12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.000 -40.000 . 1 35 ALA C 1 36 LEU N 1 36 LEU CA 1 36 LEU C parsed_1lkq 1 13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.000 -40.000 . 1 36 LEU C 1 37 TYR N 1 37 TYR CA 1 37 TYR C parsed_1lkq 1 14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.000 -40.000 . 1 37 TYR C 1 38 LEU N 1 38 LEU CA 1 38 LEU C parsed_1lkq 1 15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.000 -40.000 . 1 38 LEU C 1 39 VAL N 1 39 VAL CA 1 39 VAL C parsed_1lkq 1 16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.000 -40.000 . 1 39 VAL C 1 40 CYS N 1 40 CYS CA 1 40 CYS C parsed_1lkq 1 17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.000 -80.000 . 1 9 SER C 1 10 ILE N 1 10 ILE CA 1 10 ILE C parsed_1lkq 1 18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.000 -80.000 . 1 11 CYS C 1 12 SER N 1 12 SER CA 1 12 SER C parsed_1lkq 1 19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.000 -80.000 . 1 22 PHEN C 1 23 VAL N 1 23 VAL CA 1 23 VAL C parsed_1lkq 1 20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.000 -80.000 . 1 24 ASN C 1 25 GLN N 1 25 GLN CA 1 25 GLN C parsed_1lkq 1 21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.000 -80.000 . 1 26 HIS C 1 27 LEU N 1 27 LEU CA 1 27 LEU C parsed_1lkq 1 22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.000 -80.000 . 1 45 PHE C 1 46 PHE N 1 46 PHE CA 1 46 PHE C parsed_1lkq 1 23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.000 -80.000 . 1 47 TYR C 1 48 THR N 1 48 THR CA 1 48 THR C parsed_1lkq 1 24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.000 -20.000 . 1 6 CYS N 1 6 CYS CA 1 6 CYS CB 1 6 CYS SG parsed_1lkq 1 25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.000 -20.000 . 1 40 CYS N 1 40 CYS CA 1 40 CYS CB 1 40 CYS SG parsed_1lkq 1 26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.000 -140.000 . 1 7 CYS N 1 7 CYS CA 1 7 CYS CB 1 7 CYS SG parsed_1lkq 1 27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.000 -140.000 . 1 45 PHE N 1 45 PHE CA 1 45 PHE CB 1 45 PHE CG parsed_1lkq 1 28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.000 -140.000 . 1 34 GLU- N 1 34 GLU- CA 1 34 GLU- CB 1 34 GLU- CG parsed_1lkq 1 29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.000 -140.000 . 1 42 GLU- N 1 42 GLU- CA 1 42 GLU- CB 1 42 GLU- CG parsed_1lkq 1 30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.000 -140.000 . 1 9 SER N 1 9 SER CA 1 9 SER CB 1 9 SER OG parsed_1lkq 1 31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.000 -140.000 . 1 12 SER N 1 12 SER CA 1 12 SER CB 1 12 SER OG parsed_1lkq 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 1 1 1 13 parsed_1lkq 1 stop_ save_
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