NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
652962 | 6tub | 26715 | cing | 2-parsed | STAR | distance | hydrogen bond | simple |
data_6tub_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_6tub _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_6tub 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_6tub _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 6tub "Master copy" parsed_6tub stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_6tub _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 6tub.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6tub 1 1 6tub.mr . . DYANA/DIANA 2 distance "hydrogen bond" simple 0 parsed_6tub 1 1 6tub.mr . . DYANA/DIANA 3 distance NOE simple 0 parsed_6tub 1 1 6tub.mr . . DYANA/DIANA 4 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_6tub 1 1 6tub.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6tub 1 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_6tub _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 2 _Distance_constraint_list.Details "Generated by Wattos" loop_ _Dist_constraint_comment_org.ID _Dist_constraint_comment_org.Comment_text _Dist_constraint_comment_org.Comment_begin_line _Dist_constraint_comment_org.Comment_begin_column _Dist_constraint_comment_org.Comment_end_line _Dist_constraint_comment_org.Comment_end_column _Dist_constraint_comment_org.Entry_ID _Dist_constraint_comment_org.Distance_constraint_list_ID 1 "Restraints file 1: hbonds.lol" 1 1 1 31 parsed_6tub 1 stop_ 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 ; A21 ALA O B22 ILE H 1.80 1.00E+01 A21 ALA O B22 ILE N 2.70 1.00E+01 A23 ILE H B22 ILE O 1.80 1.00E+01 A23 ILE N B22 ILE O 2.70 1.00E+01 A23 ILE O B24 LYS H 1.80 1.00E+01 A23 ILE O B24 LYS N 2.70 1.00E+01 B21 ALA O C22 ILE H 1.80 1.00E+01 B21 ALA O C22 ILE N 2.70 1.00E+01 B23 ILE H C22 ILE O 1.80 1.00E+01 B23 ILE N C22 ILE O 2.70 1.00E+01 B23 ILE O C24 LYS H 1.80 1.00E+01 B23 ILE O C24 LYS N 2.70 1.00E+01 C21 ALA O D22 ILE H 1.80 1.00E+01 C21 ALA O D22 ILE N 2.70 1.00E+01 C23 ILE H D22 ILE O 1.80 1.00E+01 C23 ILE N D22 ILE O 2.70 1.00E+01 C23 ILE O D24 LYS H 1.80 1.00E+01 C23 ILE O D24 LYS N 2.70 1.00E+01 D21 ALA O E22 ILE H 1.80 1.00E+01 D21 ALA O E22 ILE N 2.70 1.00E+01 D23 ILE H E22 ILE O 1.80 1.00E+01 D23 ILE N E22 ILE O 2.70 1.00E+01 D23 ILE O E24 LYS H 1.80 1.00E+01 D23 ILE O E24 LYS N 2.70 1.00E+01 E21 ALA O F22 ILE H 1.80 1.00E+01 E21 ALA O F22 ILE N 2.70 1.00E+01 E23 ILE H F22 ILE O 1.80 1.00E+01 E23 ILE N F22 ILE O 2.70 1.00E+01 E23 ILE O F24 LYS H 1.80 1.00E+01 E23 ILE O F24 LYS N 2.70 1.00E+01 # Restraints file 2: hbonds.upl # hydrogen bond restraints (upper distance bounds) A21 ALA O B22 ILE H 2.00 1.00E+01 A21 ALA O B22 ILE N 3.00 1.00E+01 A23 ILE H B22 ILE O 2.00 1.00E+01 A23 ILE N B22 ILE O 3.00 1.00E+01 A23 ILE O B24 LYS H 2.00 1.00E+01 A23 ILE O B24 LYS N 3.00 1.00E+01 B21 ALA O C22 ILE H 2.00 1.00E+01 B21 ALA O C22 ILE N 3.00 1.00E+01 B23 ILE H C22 ILE O 2.00 1.00E+01 B23 ILE N C22 ILE O 3.00 1.00E+01 B23 ILE O C24 LYS H 2.00 1.00E+01 B23 ILE O C24 LYS N 3.00 1.00E+01 C21 ALA O D22 ILE H 2.00 1.00E+01 C21 ALA O D22 ILE N 3.00 1.00E+01 C23 ILE H D22 ILE O 2.00 1.00E+01 C23 ILE N D22 ILE O 3.00 1.00E+01 C23 ILE O D24 LYS H 2.00 1.00E+01 C23 ILE O D24 LYS N 3.00 1.00E+01 D21 ALA O E22 ILE H 2.00 1.00E+01 D21 ALA O E22 ILE N 3.00 1.00E+01 D23 ILE H E22 ILE O 2.00 1.00E+01 D23 ILE N E22 ILE O 3.00 1.00E+01 D23 ILE O E24 LYS H 2.00 1.00E+01 D23 ILE O E24 LYS N 3.00 1.00E+01 E21 ALA O F22 ILE H 2.00 1.00E+01 E21 ALA O F22 ILE N 3.00 1.00E+01 E23 ILE H F22 ILE O 2.00 1.00E+01 E23 ILE N F22 ILE O 3.00 1.00E+01 E23 ILE O F24 LYS H 2.00 1.00E+01 E23 ILE O F24 LYS N 3.00 1.00E+01 ; 2 1 63 47 parsed_6tub 1 stop_ save_
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