NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
619501 | 5o1t | 34140 | cing | 2-parsed | STAR | distance | hydrogen bond | simple |
data_5o1t_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_5o1t _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_5o1t 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_5o1t _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 5o1t "Master copy" parsed_5o1t stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_5o1t _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 5o1t.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5o1t 1 1 5o1t.mr . . DYANA/DIANA 2 distance NOE simple 2739 parsed_5o1t 1 1 5o1t.mr . . DYANA/DIANA 3 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_5o1t 1 1 5o1t.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 0 parsed_5o1t 1 1 5o1t.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5o1t 1 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_5o1t _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 4 _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 ; # Restraints file 3: 8col_hbonds.lol 16 LEU H 77 GLN O 1.80 2.00 16 LEU N 77 GLN O 2.70 3.00 22 ASN H 153 GLN OE1 1.80 2.00 22 ASN N 153 GLN OE1 2.70 3.00 21 LEU O 23 VAL H 1.80 2.00 21 LEU O 23 VAL N 2.70 3.00 23 VAL O 26 ASN H 1.80 2.00 23 VAL O 26 ASN N 2.70 3.00 26 ASN OD1 28 HIE H 1.80 2.00 26 ASN OD1 28 HIE N 2.70 3.00 26 ASN O 29 TYR H 1.80 2.00 26 ASN O 29 TYR N 2.70 3.00 22 ASN OD1 30 ARG H 1.80 2.00 22 ASN OD1 30 ARG N 2.70 3.00 35 SER H 167 VAL O 1.80 2.00 35 SER N 167 VAL O 2.70 3.00 37 ASP H 165 GLY O 1.80 2.00 37 ASP N 165 GLY O 2.70 3.00 37 ASP OD1 39 THR H 1.80 2.00 37 ASP OD1 39 THR N 2.70 3.00 37 ASP O 40 LEU H 1.80 2.00 37 ASP O 40 LEU N 2.70 3.00 43 ASP H 164 THR OG1 1.80 2.00 43 ASP N 164 THR OG1 2.70 3.00 45 ILE H 136 ILE O 1.80 2.00 45 ILE N 136 ILE O 2.70 3.00 46 LYS H 166 ILE O 1.80 2.00 46 LYS N 166 ILE O 2.70 3.00 47 VAL H 134 SER O 1.80 2.00 47 VAL N 134 SER O 2.70 3.00 48 TYR H 168 PHE O 1.80 2.00 48 TYR N 168 PHE O 2.70 3.00 49 SER H 132 GLY O 1.80 2.00 49 SER N 132 GLY O 2.70 3.00 50 ARG H 170 GLU OE1 1.80 2.00 50 ARG N 170 GLU OE1 2.70 3.00 52 LEU H 90 VAL O 1.80 2.00 52 LEU N 90 VAL O 2.70 3.00 53 PHE H 116 ARG O 1.80 2.00 53 PHE N 116 ARG O 2.70 3.00 54 ILE H 88 ALA O 1.80 2.00 54 ILE N 88 ALA O 2.70 3.00 55 GLY H 114 ARG O 1.80 2.00 55 GLY N 114 ARG O 2.70 3.00 57 VAL H 86 LYS O 1.80 2.00 57 VAL N 86 LYS O 2.70 3.00 58 PRO O 61 MET H 1.80 2.00 58 PRO O 61 MET N 2.70 3.00 62 LYS H 65 ASP OD2 1.80 2.00 62 LYS N 65 ASP OD2 2.70 3.00 63 GLU H 63 GLU OE1 1.80 2.00 63 GLU N 63 GLU OE1 2.70 3.00 62 LYS O 66 LEU H 1.80 2.00 62 LYS O 66 LEU N 2.70 3.00 63 GLU O 67 ALA H 1.80 2.00 63 GLU O 67 ALA N 2.70 3.00 64 TRP O 68 ASN H 1.80 2.00 64 TRP O 68 ASN N 2.70 3.00 65 ASP O 69 VAL H 1.80 2.00 65 ASP O 69 VAL N 2.70 3.00 66 LEU O 70 LEU H 1.80 2.00 66 LEU O 70 LEU N 2.70 3.00 70 LEU O 73 PHE H 1.80 2.00 70 LEU O 73 PHE N 2.70 3.00 70 LEU O 74 ALA H 1.80 2.00 70 LEU O 74 ALA N 2.70 3.00 75 GLU H 97 GLU OE2 1.80 2.00 75 GLU N 97 GLU OE2 2.70 3.00 77 GLN H 91 LYS O 1.80 2.00 77 GLN N 91 LYS O 2.70 3.00 78 SER H 91 LYS O 1.80 2.00 78 SER N 91 LYS O 2.70 3.00 14 HIE O 79 VAL H 1.80 2.00 14 HIE O 79 VAL N 2.70 3.00 80 ILE H 89 PHE O 1.80 2.00 80 ILE N 89 PHE O 2.70 3.00 82 ASN H 87 HIE O 1.80 2.00 82 ASN N 87 HIE O 2.70 3.00 82 ASN O 85 ARG H 1.80 2.00 82 ASN O 85 ARG N 2.70 3.00 83 ASN O 86 LYS H 1.80 2.00 83 ASN O 86 LYS N 2.70 3.00 82 ASN O 87 HIE H 1.80 2.00 82 ASN O 87 HIE N 2.70 3.00 54 ILE O 88 ALA H 1.80 2.00 54 ILE O 88 ALA N 2.70 3.00 80 ILE O 89 PHE H 1.80 2.00 80 ILE O 89 PHE N 2.70 3.00 52 LEU O 90 VAL H 1.80 2.00 52 LEU O 90 VAL N 2.70 3.00 78 SER O 91 LYS H 1.80 2.00 78 SER O 91 LYS N 2.70 3.00 50 ARG O 92 VAL H 1.80 2.00 50 ARG O 92 VAL N 2.70 3.00 95 ARG H 169 GLU OE1 1.80 2.00 95 ARG N 169 GLU OE1 2.70 3.00 94 SER OG 97 GLU H 1.80 2.00 94 SER OG 97 GLU N 2.70 3.00 94 SER O 98 ALA H 1.80 2.00 94 SER O 98 ALA N 2.70 3.00 95 ARG O 99 GLU H 1.80 2.00 95 ARG O 99 GLU N 2.70 3.00 96 HIE O 100 ASN H 1.80 2.00 96 HIE O 100 ASN N 2.70 3.00 97 GLU O 101 VAL H 1.80 2.00 97 GLU O 101 VAL N 2.70 3.00 98 ALA O 102 LEU H 1.80 2.00 98 ALA O 102 LEU N 2.70 3.00 99 GLU O 103 GLN H 1.80 2.00 99 GLU O 103 GLN N 2.70 3.00 101 VAL O 105 PHE H 1.80 2.00 101 VAL O 105 PHE N 2.70 3.00 108 ASP H 108 ASP OD1 1.80 2.00 108 ASP N 108 ASP OD1 2.70 3.00 106 ASN OD1 111 LEU H 1.80 2.00 106 ASN OD1 111 LEU N 2.70 3.00 55 GLY O 114 ARG H 1.80 2.00 55 GLY O 114 ARG N 2.70 3.00 53 PHE O 116 ARG H 1.80 2.00 53 PHE O 116 ARG N 2.70 3.00 51 THR O 118 GLY H 1.80 2.00 51 THR O 118 GLY N 2.70 3.00 123 PRO O 126 CYS H 1.80 2.00 123 PRO O 126 CYS N 2.70 3.00 124 ARG O 127 CYS H 1.80 2.00 124 ARG O 127 CYS N 2.70 3.00 128 ASP H 133 TYR O 1.80 2.00 128 ASP N 133 TYR O 2.70 3.00 128 ASP OD2 131 HIE H 1.80 2.00 128 ASP OD2 131 HIE N 2.70 3.00 128 ASP O 132 GLY H 1.80 2.00 128 ASP O 132 GLY N 2.70 3.00 47 VAL O 134 SER H 1.80 2.00 47 VAL O 134 SER N 2.70 3.00 126 CYS O 135 ILE H 1.80 2.00 126 CYS O 135 ILE N 2.70 3.00 45 ILE O 136 ILE H 1.80 2.00 45 ILE O 136 ILE N 2.70 3.00 43 ASP O 138 MET H 1.80 2.00 43 ASP O 138 MET N 2.70 3.00 137 PRO O 140 ARG H 1.80 2.00 137 PRO O 140 ARG N 2.70 3.00 138 MET O 141 LEU H 1.80 2.00 138 MET O 141 LEU N 2.70 3.00 142 THR H 145 ASP OD2 1.80 2.00 142 THR N 145 ASP OD2 2.70 3.00 142 THR OG1 145 ASP H 1.80 2.00 142 THR OG1 145 ASP N 2.70 3.00 142 THR O 146 LYS H 1.80 2.00 142 THR O 146 LYS N 2.70 3.00 143 ASP O 147 LYS H 1.80 2.00 143 ASP O 147 LYS N 2.70 3.00 144 ALA O 148 TRP H 1.80 2.00 144 ALA O 148 TRP N 2.70 3.00 145 ASP O 149 SER H 1.80 2.00 145 ASP O 149 SER N 2.70 3.00 147 LYS O 151 SER H 1.80 2.00 147 LYS O 151 SER N 2.70 3.00 148 TRP O 152 ALA H 1.80 2.00 148 TRP O 152 ALA N 2.70 3.00 154 TRP H 172 ASP OD2 1.80 2.00 154 TRP N 172 ASP OD2 2.70 3.00 156 GLY H 169 GLU O 1.80 2.00 156 GLY N 169 GLU O 2.70 3.00 149 SER O 157 THR H 1.80 2.00 149 SER O 157 THR N 2.70 3.00 150 VAL O 159 GLY H 1.80 2.00 150 VAL O 159 GLY N 2.70 3.00 157 THR O 160 GLN H 1.80 2.00 157 THR O 160 GLN N 2.70 3.00 44 HIE O 165 GLY H 1.80 2.00 44 HIE O 165 GLY N 2.70 3.00 163 VAL O 166 ILE H 1.80 2.00 163 VAL O 166 ILE N 2.70 3.00 35 SER O 167 VAL H 1.80 2.00 35 SER O 167 VAL N 2.70 3.00 46 LYS O 168 PHE H 1.80 2.00 46 LYS O 168 PHE N 2.70 3.00 48 TYR O 170 GLU H 1.80 2.00 48 TYR O 170 GLU N 2.70 3.00 154 TRP O 172 ASP H 1.80 2.00 154 TRP O 172 ASP N 2.70 3.00 22 ASN HD21 153 GLN O 1.80 2.00 22 ASN ND2 153 GLN O 2.70 3.00 22 ASN HD22 30 ARG O 1.80 2.00 22 ASN ND2 30 ARG O 2.70 3.00 21 LEU O 26 ASN HD21 1.80 2.00 21 LEU O 26 ASN ND2 2.70 3.00 20 GLU OE1 26 ASN HD22 1.80 2.00 20 GLU OE1 26 ASN ND2 2.70 3.00 30 ARG HE 97 GLU OE1 1.80 2.00 30 ARG NE 97 GLU OE1 2.70 3.00 27 PRO O 30 ARG HH12 1.80 2.00 27 PRO O 30 ARG NH1 2.70 3.00 29 TYR O 30 ARG HH11 1.80 2.00 29 TYR O 30 ARG NH1 2.70 3.00 30 ARG HH21 97 GLU OE2 1.80 2.00 30 ARG NH2 97 GLU OE2 2.70 3.00 42 PRO O 44 HIE HD1 1.80 2.00 42 PRO O 44 HIE ND1 2.70 3.00 49 SER HG 118 GLY O 1.80 2.00 49 SER OG 118 GLY O 2.70 3.00 51 THR HG1 170 GLU OE2 1.80 2.00 51 THR OG1 170 GLU OE2 2.70 3.00 50 ARG HE 170 GLU O 1.80 2.00 50 ARG NE 170 GLU O 2.70 3.00 50 ARG HH12 77 GLN OE1 1.80 2.00 50 ARG NH1 77 GLN OE1 2.70 3.00 50 ARG HH11 92 VAL O 1.80 2.00 50 ARG NH1 92 VAL O 2.70 3.00 50 ARG HH22 172 ASP OD1 1.80 2.00 50 ARG NH2 172 ASP OD1 2.70 3.00 50 ARG HH21 170 GLU O 1.80 2.00 50 ARG NH2 170 GLU O 2.70 3.00 77 GLN HE22 172 ASP OD1 1.80 2.00 77 GLN NE2 172 ASP OD1 2.70 3.00 95 ARG HE 99 GLU OE2 1.80 2.00 95 ARG NE 99 GLU OE2 2.70 3.00 95 ARG HH12 132 GLY O 1.80 2.00 95 ARG NH1 132 GLY O 2.70 3.00 49 SER O 95 ARG HH11 1.80 2.00 49 SER O 95 ARG NH1 2.70 3.00 95 ARG HH22 131 HIE O 1.80 2.00 95 ARG NH2 131 HIE O 2.70 3.00 73 PHE O 100 ASN HD21 1.80 2.00 73 PHE O 100 ASN ND2 2.70 3.00 106 ASN HD22 111 LEU O 1.80 2.00 106 ASN ND2 111 LEU O 2.70 3.00 128 ASP OD1 131 HIE HD1 1.80 2.00 128 ASP OD1 131 HIE ND1 2.70 3.00 125 ASP OD1 140 ARG HH12 1.80 2.00 125 ASP OD1 140 ARG NH1 2.70 3.00 125 ASP OD2 140 ARG HH22 1.80 2.00 125 ASP OD2 140 ARG NH2 2.70 3.00 28 HIE O 154 TRP HE1 1.80 2.00 28 HIE O 154 TRP NE1 2.70 3.00 157 THR HG1 160 GLN O 1.80 2.00 157 THR OG1 160 GLN O 2.70 3.00 36 TYR OH 160 GLN HE21 1.80 2.00 36 TYR OH 160 GLN NE2 2.70 3.00 ; 1 1 241 31 parsed_5o1t 1 stop_ save_
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