NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
617931 | 5tbr | 30179 | cing | 2-parsed | STAR | dihedral angle | 29 |
data_5tbr_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_5tbr _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_5tbr 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_5tbr _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 5tbr "Master copy" parsed_5tbr stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_5tbr _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 5tbr.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5tbr 1 1 5tbr.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 29 parsed_5tbr 1 1 5tbr.mr . . XPLOR/CNS 3 distance NOE simple 0 parsed_5tbr 1 1 5tbr.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5tbr 1 stop_ save_ save_CNS/XPLOR_dihedral_2 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_5tbr _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 2 _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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.4 -47.4 . . 3 . C . 4 . N . 4 . CA . 4 . C parsed_5tbr 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.7 -18.7 . . 4 . N . 4 . CA . 4 . C . 5 . N parsed_5tbr 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.7 -47.7 . . 4 . C . 5 . N . 5 . CA . 5 . C parsed_5tbr 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.8 -16.8 . . 5 . N . 5 . CA . 5 . C . 6 . N parsed_5tbr 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.8 -45.8 . . 5 . C . 6 . N . 6 . CA . 6 . C parsed_5tbr 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.6 -16.6 . . 6 . N . 6 . CA . 6 . C . 7 . N parsed_5tbr 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.9 -46.9 . . 6 . C . 7 . N . 7 . CA . 7 . C parsed_5tbr 1 8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.6 -17.6 . . 7 . N . 7 . CA . 7 . C . 8 . N parsed_5tbr 1 9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.7 -48.7 . . 7 . C . 8 . N . 8 . CA . 8 . C parsed_5tbr 1 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.9 -17.9 . . 8 . N . 8 . CA . 8 . C . 9 . N parsed_5tbr 1 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.6 -47.6 . . 8 . C . 9 . N . 9 . CA . 9 . C parsed_5tbr 1 12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.4 -19.4 . . 9 . N . 9 . CA . 9 . C . 10 . N parsed_5tbr 1 13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.9 -46.9 . . 9 . C . 10 . N . 10 . CA . 10 . C parsed_5tbr 1 14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.0 -16.0 . . 10 . N . 10 . CA . 10 . C . 11 . N parsed_5tbr 1 15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.2 -47.2 . . 10 . C . 11 . N . 11 . CA . 11 . C parsed_5tbr 1 16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.5 -18.5 . . 11 . N . 11 . CA . 11 . C . 12 . N parsed_5tbr 1 17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.2 -45.2 . . 11 . C . 12 . N . 12 . CA . 12 . C parsed_5tbr 1 18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.0 -23.0 . . 12 . N . 12 . CA . 12 . C . 13 . N parsed_5tbr 1 19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.1 -45.1 . . 12 . C . 13 . N . 13 . CA . 13 . C parsed_5tbr 1 20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.9 -15.9 . . 13 . N . 13 . CA . 13 . C . 14 . N parsed_5tbr 1 21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.3 -47.3 . . 13 . C . 14 . N . 14 . CA . 14 . C parsed_5tbr 1 22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 -20.0 . . 14 . N . 14 . CA . 14 . C . 15 . N parsed_5tbr 1 23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.9 -47.9 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_5tbr 1 24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.5 -19.5 . . 15 . N . 15 . CA . 15 . C . 16 . N parsed_5tbr 1 25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.9 -46.9 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_5tbr 1 26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.4 -14.4 . . 16 . N . 16 . CA . 16 . C . 17 . N parsed_5tbr 1 27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.7 -46.7 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_5tbr 1 28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41.8 -1.8 . . 17 . N . 17 . CA . 17 . C . 18 . N parsed_5tbr 1 29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.8 -65.8 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_5tbr 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 ; Phi/Psi Angles From 'Strong' TALOS-N Predictions: error margins are set to conservative default values of double the standard deviation observed in TALOS-N capped at a minimum of +/-20 degree. ; 1 1 3 81 parsed_5tbr 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 ; assign (resid 18 and name N ) (resid 18 and name CA ) (resid 18 and name C ) (resid 19 and name N ) 1.0 -4.3 20.0 2# Restraints file 2: ConRlBKAA_noe_deposit.tbl ; 62 1 63 131 parsed_5tbr 1 stop_ save_
Contact the webmaster for help, if required. Saturday, June 15, 2024 8:25:47 AM GMT (wattos1)