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 |
|
|
630791 |
6esp   |
34190 | cing | 2-parsed | STAR | distance | NOE | simple |
data_6esp_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6esp
_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_6esp 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6esp
_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 6esp "Master copy" parsed_6esp
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6esp
_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 6esp.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6esp 1
1 6esp.mr . . DYANA/DIANA 2 distance NOE simple 0 parsed_6esp 1
1 6esp.mr . . "MR format" 3 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6esp 1
stop_
save_
save_DYANA/DIANA_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_6esp
_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 "Restraints file 1: A.cco" 1 1 1 26 parsed_6esp 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 "3 MET H 3 MET HA 6.85 0.34 1.00E+00 0.427 -1.191 8.167" 2 4 2 83 parsed_6esp 1
2 "5 ALA H 5 ALA HA 5.08 0.25 1.00E+00 0.427 -1.191 8.167" 3 4 3 83 parsed_6esp 1
3 "7 ALA H 7 ALA HA 6.38 0.32 1.00E+00 0.427 -1.191 8.167" 4 4 4 83 parsed_6esp 1
4 "12 GLU H 12 GLU HA 8.43 0.42 1.00E+00 0.427 -1.191 8.167" 5 3 5 83 parsed_6esp 1
5 "13 GLU H 13 GLU HA 10.74 0.54 1.00E+00 0.427 -1.191 8.167" 6 3 6 83 parsed_6esp 1
6 "15 THR H 15 THR HA 12.63 0.63 1.00E+00 0.427 -1.191 8.167" 7 3 7 83 parsed_6esp 1
7 "16 LEU H 16 LEU HA 11.59 0.58 1.00E+00 0.427 -1.191 8.167" 8 3 8 83 parsed_6esp 1
8 "17 THR H 17 THR HA 11.96 0.60 1.00E+00 0.427 -1.191 8.167" 9 3 9 83 parsed_6esp 1
9 "18 ILE H 18 ILE HA 12.39 0.62 1.00E+00 0.427 -1.191 8.167" 10 3 10 83 parsed_6esp 1
10 "19 LEU H 19 LEU HA 8.99 0.45 1.00E+00 0.427 -1.191 8.167" 11 3 11 83 parsed_6esp 1
11 "20 ARG H 20 ARG HA 3.10 0.15 1.00E+00 0.427 -1.191 8.167" 12 3 12 83 parsed_6esp 1
12 "21 GLN H 21 GLN HA 7.04 0.35 1.00E+00 0.427 -1.191 8.167" 13 3 13 83 parsed_6esp 1
13 "27 ILE H 27 ILE HA 10.79 0.54 1.00E+00 0.427 -1.191 8.167" 14 3 14 83 parsed_6esp 1
14 "28 SER H 28 SER HA 6.32 0.32 1.00E+00 0.427 -1.191 8.167" 15 3 15 83 parsed_6esp 1
15 "29 ILE H 29 ILE HA 8.34 0.42 1.00E+00 0.427 -1.191 8.167" 16 3 16 83 parsed_6esp 1
16 "30 ALA H 30 ALA HA 12.87 0.64 1.00E+00 0.427 -1.191 8.167" 17 3 17 83 parsed_6esp 1
17 "35 SER H 35 SER HA 8.78 0.44 1.00E+00 0.427 -1.191 8.167" 18 3 18 83 parsed_6esp 1
18 "36 THR H 36 THR HA 5.17 0.26 1.00E+00 0.427 -1.191 8.167" 19 3 19 83 parsed_6esp 1
19 "41 ASP H 41 ASP HA 8.23 0.41 1.00E+00 0.427 -1.191 8.167" 20 3 20 83 parsed_6esp 1
20 "42 ASP H 42 ASP HA 5.09 0.25 1.00E+00 0.427 -1.191 8.167" 21 3 21 83 parsed_6esp 1
21 "43 GLU H 43 GLU HA 9.32 0.47 1.00E+00 0.427 -1.191 8.167" 22 3 22 83 parsed_6esp 1
22 "45 ILE H 45 ILE HA 3.16 0.16 1.00E+00 0.427 -1.191 8.167" 23 3 23 83 parsed_6esp 1
23 "46 PHE H 46 PHE HA 10.36 0.52 1.00E+00 0.427 -1.191 8.167" 24 3 24 83 parsed_6esp 1
24 "47 ILE H 47 ILE HA 7.37 0.37 1.00E+00 0.427 -1.191 8.167" 25 3 25 83 parsed_6esp 1
25 "49 ARG H 49 ARG HA 6.44 0.32 1.00E+00 0.427 -1.191 8.167" 26 3 26 83 parsed_6esp 1
26 "50 VAL H 50 VAL HA 5.83 0.29 1.00E+00 0.427 -1.191 8.167" 27 3 27 83 parsed_6esp 1
27 "51 SER H 51 SER HA 1.80 0.09 1.00E+00 0.427 -1.191 8.167" 28 3 28 83 parsed_6esp 1
28 "52 GLU H 52 GLU HA 4.02 0.20 1.00E+00 0.427 -1.191 8.167" 29 3 29 83 parsed_6esp 1
29 "53 GLU H 53 GLU HA 10.18 0.51 1.00E+00 0.427 -1.191 8.167" 30 3 30 83 parsed_6esp 1
30 "56 ALA H 56 ALA HA 2.57 0.13 1.00E+00 0.427 -1.191 8.167" 31 3 31 83 parsed_6esp 1
31 "58 ARG H 58 ARG HA 3.78 0.19 1.00E+00 0.427 -1.191 8.167" 32 3 32 83 parsed_6esp 1
32 "59 ALA H 59 ALA HA 6.16 0.31 1.00E+00 0.427 -1.191 8.167" 33 3 33 83 parsed_6esp 1
33 "61 VAL H 61 VAL HA 4.76 0.24 1.00E+00 0.427 -1.191 8.167" 34 3 34 83 parsed_6esp 1
34 "63 VAL H 63 VAL HA 1.88 0.09 1.00E+00 0.427 -1.191 8.167" 35 3 35 83 parsed_6esp 1
35 "65 ASP H 65 ASP HA 2.20 0.11 1.00E+00 0.427 -1.191 8.167" 36 3 36 83 parsed_6esp 1
36 "66 LYS H 66 LYS HA 8.84 0.44 1.00E+00 0.427 -1.191 8.167" 37 3 37 83 parsed_6esp 1
37 "67 LEU H 67 LEU HA 6.17 0.31 1.00E+00 0.427 -1.191 8.167" 38 3 38 83 parsed_6esp 1
38 "68 LEU H 68 LEU HA 9.47 0.47 1.00E+00 0.427 -1.191 8.167" 39 3 39 83 parsed_6esp 1
39 "69 GLU H 69 GLU HA 8.09 0.40 1.00E+00 0.427 -1.191 8.167" 40 3 40 83 parsed_6esp 1
40 "71 ASN H 71 ASN HA 6.30 0.31 1.00E+00 0.427 -1.191 8.167" 41 3 41 83 parsed_6esp 1
41 "74 ALA H 74 ALA HA 2.66 0.13 1.00E+00 0.427 -1.191 8.167" 42 3 42 83 parsed_6esp 1
42 "75 LEU H 75 LEU HA 11.52 0.58 1.00E+00 0.427 -1.191 8.167" 43 3 43 83 parsed_6esp 1
43 "76 GLN H 76 GLN HA 2.33 0.12 1.00E+00 0.427 -1.191 8.167" 44 3 44 83 parsed_6esp 1
44 "78 ALA H 78 ALA HA 2.89 0.14 1.00E+00 0.427 -1.191 8.167" 45 3 45 83 parsed_6esp 1
45 "79 GLU H 79 GLU HA 7.59 0.38 1.00E+00 0.427 -1.191 8.167" 46 3 46 83 parsed_6esp 1
46 "80 HIS H 80 HIS HA 4.02 0.20 1.00E+00 0.427 -1.191 8.167" 47 3 47 83 parsed_6esp 1
47 "81 HIS H 81 HIS HA 1.77 0.09 1.00E+00 0.427 -1.191 8.167" 48 3 48 83 parsed_6esp 1
48 "82 GLU H 82 GLU HA 6.38 0.32 1.00E+00 0.427 -1.191 8.167" 49 3 49 83 parsed_6esp 1
49 "83 ALA H 83 ALA HA 6.47 0.32 1.00E+00 0.427 -1.191 8.167" 50 3 50 83 parsed_6esp 1
50 "84 VAL H 84 VAL HA 2.67 0.13 1.00E+00 0.427 -1.191 8.167" 51 3 51 83 parsed_6esp 1
51 "87 LEU H 87 LEU HA 2.39 0.12 1.00E+00 0.427 -1.191 8.167" 52 3 52 83 parsed_6esp 1
52 "88 ARG H 88 ARG HA 2.88 0.14 1.00E+00 0.427 -1.191 8.167" 53 3 53 83 parsed_6esp 1
53 "90 ALA H 90 ALA HA 3.10 0.15 1.00E+00 0.427 -1.191 8.167" 54 3 54 83 parsed_6esp 1
54 "93 ALA H 93 ALA HA 8.29 0.41 1.00E+00 0.427 -1.191 8.167" 55 3 55 83 parsed_6esp 1
55 "94 VAL H 94 VAL HA 11.54 0.58 1.00E+00 0.427 -1.191 8.167" 56 3 56 83 parsed_6esp 1
56 "95 GLN H 95 GLN HA 8.95 0.45 1.00E+00 0.427 -1.191 8.167" 57 3 57 83 parsed_6esp 1
57 "96 MET H 96 MET HA 14.10 0.71 1.00E+00 0.427 -1.191 8.167" 58 3 58 83 parsed_6esp 1
58 "98 VAL H 98 VAL HA 12.24 0.61 1.00E+00 0.427 -1.191 8.167" 59 3 59 83 parsed_6esp 1
59 "99 TRP H 99 TRP HA 14.21 0.71 1.00E+00 0.427 -1.191 8.167" 60 3 60 83 parsed_6esp 1
60 "100 ARG H 100 ARG HA 11.75 0.59 1.00E+00 0.427 -1.191 8.167" 61 2 61 83 parsed_6esp 1
61 "101 GLU H 101 GLU HA 7.36 0.37 1.00E+00 0.427 -1.191 8.167" 62 2 62 83 parsed_6esp 1
62 "103 MET H 103 MET HA 6.29 0.31 1.00E+00 0.427 -1.191 8.167" 63 2 63 83 parsed_6esp 1
63 "105 GLU H 105 GLU HA 10.72 0.54 1.00E+00 0.427 -1.191 8.167" 64 2 64 83 parsed_6esp 1
64 "107 GLU H 107 GLU HA 5.14 0.26 1.00E+00 0.427 -1.191 8.167" 65 2 65 83 parsed_6esp 1
65 "108 ASN H 108 ASN HA 9.98 0.50 1.00E+00 0.427 -1.191 8.167" 66 2 66 83 parsed_6esp 1
66 "109 ALA H 109 ALA HA 5.04 0.25 1.00E+00 0.427 -1.191 8.167" 67 2 67 83 parsed_6esp 1
67 "110 VAL H 110 VAL HA 9.40 0.47 1.00E+00 0.427 -1.191 8.167" 68 2 68 83 parsed_6esp 1
68 "111 THR H 111 THR HA 9.97 0.50 1.00E+00 0.427 -1.191 8.167" 69 2 69 83 parsed_6esp 1
69 "112 ILE H 112 ILE HA 10.02 0.50 1.00E+00 0.427 -1.191 8.167" 70 2 70 83 parsed_6esp 1
70 "113 THR H 113 THR HA 9.72 0.49 1.00E+00 0.427 -1.191 8.167" 71 2 71 83 parsed_6esp 1
71 "115 LEU H 115 LEU HA 6.74 0.34 1.00E+00 0.427 -1.191 8.167" 72 2 72 83 parsed_6esp 1
72 "116 ARG H 116 ARG HA 11.35 0.57 1.00E+00 0.427 -1.191 8.167" 73 2 73 83 parsed_6esp 1
stop_
save_
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