NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
36533 | 1npq | 5738 | cing | 2-parsed | STAR | dihedral angle | 6 |
data_1npq_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_1npq _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_1npq 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_1npq _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 1npq "Master copy" parsed_1npq stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_1npq _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 1npq.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1npq 1 1 1npq.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1npq 1 1 1npq.mr . . XPLOR/CNS 3 distance NOE simple 590 parsed_1npq 1 1 1npq.mr . . XPLOR/CNS 4 distance NOE ambi 448 parsed_1npq 1 1 1npq.mr . . XPLOR/CNS 5 distance NOE ambi 126 parsed_1npq 1 1 1npq.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 58 parsed_1npq 1 1 1npq.mr . . XPLOR/CNS 7 "dihedral angle" "Not applicable" "Not applicable" 62 parsed_1npq 1 1 1npq.mr . . XPLOR/CNS 8 "dihedral angle" "Not applicable" "Not applicable" 6 parsed_1npq 1 1 1npq.mr . . XPLOR/CNS 9 "dihedral angle" "Not applicable" "Not applicable" 6 parsed_1npq 1 1 1npq.mr . . "MR format" 10 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1npq 1 stop_ save_ save_CNS/XPLOR_dihedral_9 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_1npq _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 9 _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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140 80 . . 119 . N . 119 . CA . 119 . C . 120 . N parsed_1npq 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140 80 . . 120 . N . 120 . CA . 120 . C . 121 . N parsed_1npq 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140 80 . . 121 . N . 121 . CA . 121 . C . 122 . N parsed_1npq 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140 80 . . 122 . N . 122 . CA . 122 . C . 123 . N parsed_1npq 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140 80 . . 123 . N . 123 . CA . 123 . C . 124 . N parsed_1npq 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140 80 . . 124 . N . 124 . CA . 124 . C . 125 . N parsed_1npq 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 and psi dihedral restraint file generated by Talos2Aria.py TALOS filename: /export/home/coffey/pmercier/aria/tools/final.tab settings: min phiError=None, min psiError=30, errorFactor=2.0 Talos derived psi restraint: ; 1 1 9 31 parsed_1npq 1 2 "Talos derived psi restraint:" 16 1 16 31 parsed_1npq 1 3 "Talos derived psi restraint:" 23 1 23 31 parsed_1npq 1 4 "Talos derived psi restraint:" 30 1 30 31 parsed_1npq 1 5 "Talos derived psi restraint:" 37 1 37 31 parsed_1npq 1 6 "Talos derived psi restraint:" 44 1 44 31 parsed_1npq 1 stop_ save_
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