NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
588736 | 2ruy | 11478 | cing | 2-parsed | STAR | distance | general distance | simple |
data_2ruy_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_2ruy _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_2ruy 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_2ruy _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 2ruy "Master copy" parsed_2ruy stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_2ruy _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 2ruy.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2ruy 1 1 2ruy.mr . . AMBER 2 stereochemistry chirality "Not applicable" 0 parsed_2ruy 1 1 2ruy.mr . . AMBER 3 unknown "Not applicable" "Not applicable" 0 parsed_2ruy 1 1 2ruy.mr . . AMBER 4 distance NOE simple 0 parsed_2ruy 1 1 2ruy.mr . . AMBER 5 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2ruy 1 1 2ruy.mr . . XPLOR/CNS 6 distance "general distance" simple 0 parsed_2ruy 1 1 2ruy.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2ruy 1 stop_ save_ save_CNS/XPLOR_distance_constraints_6 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_2ruy _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "general distance" _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 6 _Distance_constraint_list.Details "Generated by Wattos" loop_ _Dist_constraint_parse_err.ID _Dist_constraint_parse_err.Content _Dist_constraint_parse_err.Begin_line _Dist_constraint_parse_err.Begin_column _Dist_constraint_parse_err.End_line _Dist_constraint_parse_err.End_column _Dist_constraint_parse_err.Entry_ID _Dist_constraint_parse_err.Distance_constraint_list_ID 1 ; # # 12 CYM SG 15 CYM SG 3.56 3.96 &rst ixpk= 0, nxpk= 0, iat= 153, 191, r1= 3.06, r2= 3.56, r3= 3.96, r4= 4.46, rk2=1000, rk3=1000, ir6=1, ialtd=0, &end # # 12 CYM SG 28 HID NE2 3.32 3.72 &rst ixpk= 0, nxpk= 0, iat= 153, 411, r1= 2.82, r2= 3.32, r3= 3.72, r4= 4.22, &end # # 12 CYM SG 33 HID NE2 3.32 3.72 &rst ixpk= 0, nxpk= 0, iat= 153, 502, r1= 2.82, r2= 3.32, r3= 3.72, r4= 4.22, &end # # 12 CYM CB 38 Zn Zn 3.25 3.51 &rst ixpk= 0, nxpk= 0, iat= 150, 571, r1= 2.75, r2= 3.25, r3= 3.51, r4= 4.01, &end # # 12 CYM SG 38 Zn Zn 2.19 2.39 &rst ixpk= 0, nxpk= 0, iat= 153, 571, r1= 1.69, r2= 2.19, r3= 2.39, r4= 2.89, &end # # 15 CYM SG 28 HID NE2 3.32 3.72 &rst ixpk= 0, nxpk= 0, iat= 191, 411, r1= 2.82, r2= 3.32, r3= 3.72, r4= 4.22, &end # # 15 CYM SG 33 HID NE2 3.32 3.72 &rst ixpk= 0, nxpk= 0, iat= 191, 502, r1= 2.82, r2= 3.32, r3= 3.72, r4= 4.22, &end # # 15 CYM CB 38 Zn Zn 3.25 3.51 &rst ixpk= 0, nxpk= 0, iat= 188, 571, r1= 2.75, r2= 3.25, r3= 3.51, r4= 4.01, &end # # 15 CYM SG 38 Zn Zn 2.19 2.39 &rst ixpk= 0, nxpk= 0, iat= 191, 571, r1= 1.69, r2= 2.19, r3= 2.39, r4= 2.89, &end # # 28 HID NE2 33 HID NE2 3.00 3.60 &rst ixpk= 0, nxpk= 0, iat= 411, 502, r1= 2.50, r2= 3.00, r3= 3.60, r4= 4.10, &end # # 28 HID NE2 38 Zn Zn 1.90 2.10 &rst ixpk= 0, nxpk= 0, iat= 411, 571, r1= 1.40, r2= 1.90, r3= 2.10, r4= 2.60, &end # # 33 HID NE2 38 Zn Zn 1.90 2.10 &rst ixpk= 0, nxpk= 0, iat= 502, 571, r1= 1.40, r2= 1.90, r3= 2.10, r4= 2.60, &end ; 1 1 50 80 parsed_2ruy 1 stop_ save_
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