NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
531536 | 2lp6 | 6173 | cing | 2-parsed | STAR | dihedral angle | 28 |
data_2lp6_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_2lp6 _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_2lp6 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_2lp6 _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 2lp6 "Master copy" parsed_2lp6 stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_2lp6 _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 2lp6.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2lp6 1 1 2lp6.mr . . XPLOR/CNS 2 distance NOE simple 1493 parsed_2lp6 1 1 2lp6.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 125 parsed_2lp6 1 1 2lp6.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 28 parsed_2lp6 1 1 2lp6.mr . . XPLOR/CNS 5 distance "hydrogen bond" simple 0 parsed_2lp6 1 1 2lp6.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2lp6 1 stop_ save_ save_CNS/XPLOR_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_2lp6 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 4 _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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -40.00 . . 8 . N . 8 . CA . 8 . CB . 8 . CG parsed_2lp6 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.00 200.00 . . 8 . CA . 8 . CB . 8 . CG . 8 . CD1 parsed_2lp6 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -40.00 . . 27 . N . 27 . CA . 27 . CB . 27 . CG parsed_2lp6 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.00 200.00 . . 27 . CA . 27 . CB . 27 . CG . 27 . CD1 parsed_2lp6 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -40.00 . . 38 . N . 38 . CA . 38 . CB . 38 . CG parsed_2lp6 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.00 200.00 . . 38 . CA . 38 . CB . 38 . CG . 38 . CD1 parsed_2lp6 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -40.00 . . 53 . N . 53 . CA . 53 . CB . 53 . CG parsed_2lp6 1 8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.00 200.00 . . 53 . CA . 53 . CB . 53 . CG . 53 . CD1 parsed_2lp6 1 9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -40.00 . . 75 . N . 75 . CA . 75 . CB . 75 . CG parsed_2lp6 1 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.00 200.00 . . 75 . CA . 75 . CB . 75 . CG . 75 . CD1 parsed_2lp6 1 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -40.00 . . 80 . N . 80 . CA . 80 . CB . 80 . CG parsed_2lp6 1 12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.00 200.00 . . 80 . CA . 80 . CB . 80 . CG . 80 . CD1 parsed_2lp6 1 13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.00 200.00 . . 42 . N . 42 . CA . 42 . CB . 42 . CG parsed_2lp6 1 14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.00 80.00 . . 42 . CA . 42 . CB . 42 . CG . 42 . CD1 parsed_2lp6 1 15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -40.00 . . 57 . N . 57 . CA . 57 . CB . 57 . CG1 parsed_2lp6 1 16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.00 200.00 . . 57 . CA . 57 . CB . 57 . CG1 . 57 . CD1 parsed_2lp6 1 17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -40.00 . . 24 . N . 24 . CA . 24 . CB . 24 . CG1 parsed_2lp6 1 18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.00 200.00 . . 24 . CA . 24 . CB . 24 . CG1 . 24 . CD1 parsed_2lp6 1 19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -40.00 . . 52 . N . 52 . CA . 52 . CB . 52 . CG1 parsed_2lp6 1 20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.00 200.00 . . 52 . CA . 52 . CB . 52 . CG1 . 52 . CD1 parsed_2lp6 1 21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -40.00 . . 3 . N . 3 . CA . 3 . CB . 3 . CG1 parsed_2lp6 1 22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.00 200.00 . . 3 . CA . 3 . CB . 3 . CG1 . 3 . CD1 parsed_2lp6 1 23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -40.00 . . 86 . N . 86 . CA . 86 . CB . 86 . CG1 parsed_2lp6 1 24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.00 200.00 . . 86 . CA . 86 . CB . 86 . CG1 . 86 . CD1 parsed_2lp6 1 25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -40.00 . . 10 . N . 10 . CA . 10 . CB . 10 . CG parsed_2lp6 1 26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -40.00 . . 71 . N . 71 . CA . 71 . CB . 71 . CG parsed_2lp6 1 27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.00 100.00 . . 71 . CA . 71 . CB . 71 . CG . 71 . CD1 parsed_2lp6 1 28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.00 200.00 . . 22 . CA . 22 . CB . 22 . CG . 22 . SD parsed_2lp6 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 ; additional chi1/chi2 favourable rotamer constraints for selected ordered residues base on MolProbity and Procheck analyses and Leu CD1/CD2 chemical shifts applied at final stage of structure refinement ; 1 1 5 2 parsed_2lp6 1 stop_ save_
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