NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
458049 |
2khb   |
16235 | cing | 2-parsed | STAR | distance | NOE | simple |
data_2khb_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2khb
_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_2khb 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2khb
_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 2khb "Master copy" parsed_2khb
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2khb
_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 2khb.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2khb 1
1 2khb.mr . . XPLOR/CNS 2 distance NOE simple 0 parsed_2khb 1
1 2khb.mr . . XPLOR/CNS 3 distance NOE simple 0 parsed_2khb 1
1 2khb.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2khb 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2khb
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_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
;
# 5 CYSS HN 5 CYSS HA 2.90 #peak 2
# 5 CYSS HA 6 GLY HN 3.39 #peak 3
# 5 CYSS HB1 6 GLY HN 3.33 #peak 5
# 5 CYSS HB2 6 GLY HN 3.33 #peak 6
# 6 GLY HN 7 GLU HN 4.14 #peak 13
# 7 GLU HA 8 THR HN 2.90 #peak 15
# 7 GLU HN 7 GLU HB1 3.98 #peak 16
# 7 GLU HB1 8 THR HN 3.89 #peak 17
# 7 GLU HN 7 GLU HB2 3.98 #peak 18
# 7 GLU HB2 8 THR HN 3.89 #peak 19
# 8 THR HA 9 CYSS HN 2.68 #peak 22
# 8 THR HA 26 CYSS HN 3.42 #peak 24
# 8 THR HN 8 THR HB 3.33 #peak 25
# 8 THR HN 8 THR HB 3.46 #peak 25 #291207
# 8 THR HB 9 CYSS HN 3.17 #peak 27
# 8 THR HB 9 CYSS HN 3.24 #peak 27 #291207
# 9 CYSS HA 9 CYSS HB1 2.77 #peak 30
# 9 CYSS HA 9 CYSS HB2 2.77 #peak 31
# 9 CYSS HA 10 VAL HN 3.05 #peak 33
# 9 CYSS HN 10 VAL HN 3.76 #peak 40
# 10 VAL HA 11 GLY HN 2.99 #peak 44
# 10 VAL HA 11 GLY HN 3.40 #peak 44 181207
# 10 VAL HN 10 VAL HB 3.33 #peak 47
# 10 VAL HN 11 GLY HN 4.01 #peak 48
# 11 GLY HN 12 GLY HN 3.48 #peak 66
# 13 THR HA 13 THR HB 2.62 #peak 67
# 13 THR HA 14 CYSS HN 3.02 #peak 68
# 13 THR HN 13 THR HB 3.27 #peak 69
# 13 THR HB 14 CYSS HN 3.39 #peak 71
# 13 THR HB 14 CYSS HN 3.76 #peak 71 171207
# 12 GLY HN 13 THR HN 3.27 #peak 72
# 14 CYSS HA 15 ASN HN 3.21 #peak 77
# 16 THR HN 16 THR HB 3.08 #peak 89
# 16 THR HN 16 THR HB 3.25 #peak 89 241207
# 15 ASN HN 16 THR HN 3.42 #peak 92
# 17 PRO HA 18 GLY HN 2.59 #peak 95
# 17 PRO HA 19 CYSS HN 3.30 #peak 96
# 19 CYSS HA 20 THR HN 2.59 #peak 109
# 19 CYSS HA 29 ASN HN 4.26 #peak 110
# 18 GLY HN 19 CYSS HN 3.08 #peak 115
# 20 THR HA 21 CYSS HN 2.74 #peak 118
# 20 THR HN 20 THR HB 3.36 #peak 119
# 20 THR HB 21 CYSS HN 3.52 #peak 120
# 20 THR HB 21 CYSS HN 3.64 #peak 120 #161207
# 20 THR HN 27 THR HN 3.48 #peak 121
# 21 CYSS HA 22 SER HN 2.52 #peak 127
# 21 CYSS HN 21 CYSS HB1 3.05 #peak 129
# 21 CYSS HN 21 CYSS HB2 3.05 #peak 130
# 22 SER HA 23 TRP HN 2.93 #peak 132
# 23 TRP HA 24 PRO HA 2.46 #peak 138
# 23 TRP HA 25 VAL HN 3.55 #peak 139
# 22 SER HN 23 TRP HN 3.08 #peak 142
# 23 TRP HN 23 TRP QB 3.81 #peak 147
# 23 TRP QB 25 VAL HN 4.30 #peak 148
# 25 VAL HA 25 VAL HB 2.74 #peak 163
# 25 VAL HA 26 CYSS HN 2.52 #peak 166
# 25 VAL HN 25 VAL HB 4.04 #peak 167
# 25 VAL HB 26 CYSS HN 3.55 #peak 168
# 25 VAL HB 26 CYSS HN 3.00 #peak 168 201207
# 22 SER HN 26 CYSS HA 3.52 #peak 173
# 26 CYSS HA 27 THR HN 2.56 #peak 176
# 26 CYSS HN 26 CYSS HB1 3.70 #peak 178
# 26 CYSS HN 26 CYSS HB2 3.70 #peak 179
# 27 THR HA 28 ARG HN 2.77 #peak 182
# 27 THR HB 28 ARG HN 2.87 #peak 183
# 27 THR HB 28 ARG HN 3.68 #peak 183 201207
# 20 THR HN 28 ARG HA 4.57 #peak 186
# 28 ARG HA 29 ASN HN 2.71 #peak 190
# 28 ARG QB 29 ASN HN 5.29 #peak 192
# 28 ARG HN 29 ASN HA 4.76 #peak 198
# 28 ARG HN 29 ASN HA 4.94 #peak 198 211207
# 3 PRO HA 4 VAL HN 2.74 #peak 212
# 4 VAL HA 5 CYSS HN 3.08 #peak 216
# 4 VAL HA 5 CYSS HN 3.38 #peak 216 151207
# 4 VAL HB 5 CYSS HN 3.33 #peak 219
# 4 VAL HB 5 CYSS HN 3.66 #peak 219 281207
# 4 VAL HN 4 VAL HB 3.39 #peak 220
# 4 VAL HN 5 CYSS HN 3.21 #peak 221
# 10 VAL HA 23 TRP HD1 4.23 #peak 45
# 10 VAL HA 23 TRP HE1 3.79 #peak 46
# 23 TRP HA 23 TRP HD1 3.73 #peak 135
# 23 TRP QB 23 TRP HE3 4.12 #peak 146
# 23 TRP HD1 24 PRO HA 3.83 #peak 150
# 23 TRP HE3 24 PRO HA 4.32 #peak 151
# 28 ARG HN 28 ARG QD 6.38 #peak 194
# 28 ARG HN 28 ARG QG 4.86 #peak 196
# 28 ARG QG 29 ASN HN 6.35 #peak 197
# 2 LEU HA 3 PRO HD1 3.89 #peak 204
# 2 LEU HA 3 PRO HD2 3.89 #peak 205
# 8 THR HA 25 VAL QQG 5.89 #peak 23
# 8 THR HN 8 THR QG2 4.97 #peak 28
# 8 THR QG2 9 CYSS HN 6.05 #peak 29
# 10 VAL HN 10 VAL QQG 6.61 #peak 51
# 10 VAL QQG 11 GLY HN 7.60 #peak 52
# 10 VAL QQG 23 TRP HZ2 7.60 #peak 53
# 13 THR HN 13 THR QG2 5.53 #peak 74
# 13 THR QG2 14 CYSS HN 6.12 #peak 75
# 20 THR QG2 21 CYSS HN 5.90 #peak 123
# 22 SER QB 27 THR QG2 5.08 #peak 134
# 25 VAL HN 25 VAL QQG 6.30 #peak 171
# 25 VAL QQG 26 CYSS HN 7.60 #peak 172
# 27 THR HN 27 THR QG2 5.28 #peak 184
# 27 THR QG2 28 ARG HN 5.65 #peak 185
# 4 VAL QQG 5 CYSS HN 6.89 #peak 222
# 4 VAL HN 4 VAL QQG 6.27 #peak 224
# 2 LEU HN 2 LEU QB 3.37 #peak 207
# 2 LEU HA 3 PRO QD 3.32 #peak 204
# 2 LEU HG 3 PRO QD 3.71 #peak 210
# 2 LEU QQD 3 PRO QD 7.29 #peak 213
# 5 CYSS HN 5 CYSS QB 3.14 #peak 4
# 5 CYSS QB 6 GLY HN 2.79 #peak 6
# 6 GLY QA 7 GLU HN 3.11 #peak 11
# 6 GLY QA 25 VAL QQG 5.94 #peak 12
# 7 GLU HN 7 GLU QB 3.23 #peak 18
# 7 GLU HN 26 CYSS QB 3.82 #peak 177
# 7 GLU QB 8 THR HN 3.21 #peak 17
# 9 CYSS HN 9 CYSS QB 3.43 #peak 36
# 9 CYSS HA 9 CYSS QB 2.36 #peak 31
# 9 CYSS QB 10 VAL HN 3.59 #peak 35
# 9 CYSS QB 10 VAL HN 3.78 #peak 35 131207
# 9 CYSS QB 10 VAL HA 4.09 #peak 41
# 9 CYSS QB 10 VAL HA 4.35 #peak 41 201207
# 9 CYSS QB 13 THR HN 2.57 #peak 37
# 9 CYSS QB 13 THR HN 3.81 #peak 37 221207
# 9 CYSS QB 23 TRP HD1 3.88 #peak 38
# 9 CYSS QB 26 CYSS HN 3.70 #peak 39
# 11 GLY QA 13 THR QG2 4.35 #peak 59
# 12 GLY HN 12 GLY QA 2.58 #peak 64
# 12 GLY QA 23 TRP HD1 5.02 #peak 62
# 14 CYSS HN 14 CYSS QB 2.88 #peak 78
# 16 THR HA 17 PRO QD 3.26 #peak 87
# 16 THR HB 19 CYSS QB 4.06 #peak 91
# 16 THR QG2 17 PRO QD 4.76 #peak 99
# 18 GLY HN 18 GLY QA 2.58 #peak 106
# 19 CYSS HN 19 CYSS QB 2.94 #peak 111
# 19 CYSS QB 20 THR HN 3.21 #peak 114
# 21 CYSS QB 22 SER HN 4.21 #peak 131
# 24 PRO QD 25 VAL QQG 6.46 #peak 169
# 26 CYSS HN 26 CYSS QB 2.94 #peak 178
# 26 CYSS QB 27 THR HN 3.53 #peak 180
# 29 ASN HN 29 ASN QB 3.35 #peak 201
;
1 1 141 62 parsed_2khb 1
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save_
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