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 |
|
|
475142 |
2kmd   |
16426 | cing | 2-parsed | STAR | dipolar coupling |
data_2kmd_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2kmd
_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_2kmd 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2kmd
_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 2kmd "Master copy" parsed_2kmd
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2kmd
_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 2kmd.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2kmd 1
1 2kmd.mr . . XPLOR/CNS 2 distance "hydrogen bond" simple 48 parsed_2kmd 1
1 2kmd.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 152 parsed_2kmd 1
1 2kmd.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2kmd 1
1 2kmd.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2kmd 1
1 2kmd.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2kmd 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_5
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2kmd
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 5
_RDC_constraint_list.Details "Generated by Wattos"
loop_
_RDC_constraint_parse_err.ID
_RDC_constraint_parse_err.Content
_RDC_constraint_parse_err.Begin_line
_RDC_constraint_parse_err.Begin_column
_RDC_constraint_parse_err.End_line
_RDC_constraint_parse_err.End_column
_RDC_constraint_parse_err.Entry_ID
_RDC_constraint_parse_err.RDC_constraint_list_ID
1 "assign ( resid 41 and name CA ) ( resid 41 and name HA ) 11.76 4.0 1.00 0" 1 1 1 82 parsed_2kmd 1
2 "assign ( resid 42 and name CA ) ( resid 42 and name HA ) -3.016 4.0 1.00 0" 2 1 2 83 parsed_2kmd 1
3 "assign ( resid 46 and name CA ) ( resid 46 and name HA ) -1.2064 4.0 1.00 0" 3 1 3 84 parsed_2kmd 1
4 "assign ( resid 47 and name CA ) ( resid 47 and name HA ) 9.6512 4.0 1.00 0" 4 1 4 83 parsed_2kmd 1
5 "assign ( resid 48 and name CA ) ( resid 48 and name HA ) 15.3816 4.0 1.00 0" 5 1 5 84 parsed_2kmd 1
6 "assign ( resid 50 and name CA ) ( resid 50 and name HA ) -25.636 4.0 1.00 0" 6 1 6 84 parsed_2kmd 1
7 "assign ( resid 51 and name CA ) ( resid 51 and name HA ) 6.6352 4.0 1.00 0" 7 1 7 83 parsed_2kmd 1
8 "assign ( resid 54 and name CA ) ( resid 54 and name HA ) -2.4128 4.0 1.00 0" 8 1 8 84 parsed_2kmd 1
9 "assign ( resid 56 and name CA ) ( resid 56 and name HA ) -9.9528 4.0 1.00 0" 9 1 9 84 parsed_2kmd 1
10 "assign ( resid 57 and name CA ) ( resid 57 and name HA ) -12.3656 4.0 1.00 0" 10 1 10 85 parsed_2kmd 1
11 "assign ( resid 58 and name CA ) ( resid 58 and name HA ) 6.032 4.0 1.00 0" 11 1 11 82 parsed_2kmd 1
12 "assign ( resid 59 and name CA ) ( resid 59 and name HA ) 16.8896 4.0 1.00 0" 12 1 12 84 parsed_2kmd 1
13 "assign ( resid 60 and name CA ) ( resid 60 and name HA ) -20.2072 4.0 1.00 0" 13 1 13 85 parsed_2kmd 1
14 "assign ( resid 61 and name CA ) ( resid 61 and name HA ) -3.016 4.0 1.00 0" 14 1 14 83 parsed_2kmd 1
15 "assign ( resid 63 and name CA ) ( resid 63 and name HA ) -3.016 4.0 1.00 0" 15 1 15 83 parsed_2kmd 1
16 "assign ( resid 64 and name CA ) ( resid 64 and name HA ) -4.524 4.0 1.00 0" 16 1 16 83 parsed_2kmd 1
17 "assign ( resid 66 and name CA ) ( resid 66 and name HA ) 5.7304 4.0 1.00 0" 17 1 17 83 parsed_2kmd 1
18 "assign ( resid 67 and name CA ) ( resid 67 and name HA ) 4.524 4.0 1.00 0" 18 1 18 82 parsed_2kmd 1
19 "assign ( resid 69 and name CA ) ( resid 69 and name HA ) 10.2544 4.0 1.00 0" 19 1 19 84 parsed_2kmd 1
20 "assign ( resid 70 and name CA ) ( resid 70 and name HA ) -4.524 4.0 1.00 0" 20 1 20 83 parsed_2kmd 1
21 "assign ( resid 71 and name CA ) ( resid 71 and name HA ) -20.8104 4.0 1.00 0" 21 1 21 85 parsed_2kmd 1
22 "assign ( resid 72 and name CA ) ( resid 72 and name HA ) 12.9688 4.0 1.00 0" 22 1 22 84 parsed_2kmd 1
23 "assign ( resid 73 and name CA ) ( resid 73 and name HA ) 32.2712 4.0 1.00 0" 23 1 23 84 parsed_2kmd 1
24 "assign ( resid 74 and name CA ) ( resid 74 and name HA ) 9.9528 4.0 1.00 0" 24 1 24 83 parsed_2kmd 1
25 "assign ( resid 75 and name CA ) ( resid 75 and name HA ) -4.2224 4.0 1.00 0" 25 1 25 84 parsed_2kmd 1
26 "assign ( resid 77 and name CA ) ( resid 77 and name HA ) -5.7304 4.0 1.00 0" 26 1 26 84 parsed_2kmd 1
27 "assign ( resid 78 and name CA ) ( resid 78 and name HA ) -0.9048 4.0 1.00 0" 27 1 27 84 parsed_2kmd 1
28 "assign ( resid 79 and name CA ) ( resid 79 and name HA ) 1.2064 4.0 1.00 0" 28 1 28 83 parsed_2kmd 1
29 "assign ( resid 80 and name CA ) ( resid 80 and name HA ) 9.3496 4.0 1.00 0" 29 1 29 83 parsed_2kmd 1
30 "assign ( resid 81 and name CA ) ( resid 81 and name HA ) -6.3336 4.0 1.00 0" 30 1 30 84 parsed_2kmd 1
31 "assign ( resid 82 and name CA ) ( resid 82 and name HA ) -1.2064 4.0 1.00 0" 31 1 31 84 parsed_2kmd 1
32 "assign ( resid 83 and name CA ) ( resid 83 and name HA ) 22.3184 4.0 1.00 0" 32 1 32 84 parsed_2kmd 1
33 "assign ( resid 84 and name CA ) ( resid 84 and name HA ) -17.1912 4.0 1.00 0" 33 1 33 85 parsed_2kmd 1
34 "assign ( resid 85 and name CA ) ( resid 85 and name HA ) 11.4608 4.0 1.00 0" 34 1 34 84 parsed_2kmd 1
35 "assign ( resid 87 and name CA ) ( resid 87 and name HA ) 16.8896 4.0 1.00 0" 35 1 35 84 parsed_2kmd 1
36 "assign ( resid 88 and name CA ) ( resid 88 and name HA ) -27.144 4.0 1.00 0" 36 1 36 84 parsed_2kmd 1
37 "assign ( resid 89 and name CA ) ( resid 89 and name HA ) -8.4448 4.0 1.00 0" 37 1 37 84 parsed_2kmd 1
38 "assign ( resid 90 and name CA ) ( resid 90 and name HA ) -15.08 4.0 1.00 0" 38 1 38 83 parsed_2kmd 1
39 "assign ( resid 92 and name CA ) ( resid 92 and name HA ) -4.2224 4.0 1.00 0" 39 1 39 84 parsed_2kmd 1
40 "assign ( resid 93 and name CA ) ( resid 93 and name HA ) 27.4456 4.0 1.00 0" 40 1 40 84 parsed_2kmd 1
41 "assign ( resid 95 and name CA ) ( resid 95 and name HA ) -3.9208 4.0 1.00 0" 41 1 41 84 parsed_2kmd 1
42 "assign ( resid 96 and name CA ) ( resid 96 and name HA ) -3.6192 4.0 1.00 0" 42 1 42 84 parsed_2kmd 1
43 "assign ( resid 97 and name CA ) ( resid 97 and name HA ) 0.3016 4.0 1.00 0" 43 1 43 83 parsed_2kmd 1
44 "assign ( resid 99 and name CA ) ( resid 99 and name HA ) 14.1752 4.0 1.00 0" 44 1 44 84 parsed_2kmd 1
45 "assign ( resid 100 and name CA ) ( resid 100 and name HA ) -18.3976 4.0 1.00 0" 45 1 45 87 parsed_2kmd 1
46 "assign ( resid 101 and name CA ) ( resid 101 and name HA ) 16.2864 4.0 1.00 0" 46 1 46 86 parsed_2kmd 1
47 "assign ( resid 102 and name CA ) ( resid 102 and name HA ) -1.508 4.0 1.00 0" 47 1 47 85 parsed_2kmd 1
48 "assign ( resid 103 and name CA ) ( resid 103 and name HA ) -16.8896 4.0 1.00 0" 48 1 48 87 parsed_2kmd 1
49 "assign ( resid 104 and name CA ) ( resid 104 and name HA ) 16.2864 4.0 1.00 0" 49 1 49 86 parsed_2kmd 1
50 "assign ( resid 105 and name CA ) ( resid 105 and name HA ) 5.4288 4.0 1.00 0" 50 1 50 85 parsed_2kmd 1
51 "assign ( resid 106 and name CA ) ( resid 106 and name HA ) -16.8896 4.0 1.00 0" 51 1 51 87 parsed_2kmd 1
52 "assign ( resid 107 and name CA ) ( resid 107 and name HA ) 3.6192 4.0 1.00 0" 52 1 52 85 parsed_2kmd 1
53 "assign ( resid 108 and name CA ) ( resid 108 and name HA ) -8.4448 4.0 1.00 0" 53 1 53 86 parsed_2kmd 1
54 "assign ( resid 111 and name CA ) ( resid 111 and name HA ) 0.3016 4.0 1.00 0" 54 1 54 85 parsed_2kmd 1
55 "assign ( resid 114 and name CA ) ( resid 114 and name HA ) 15.9848 4.0 1.00 0" 55 1 55 86 parsed_2kmd 1
56 "assign ( resid 115 and name CA ) ( resid 115 and name HA ) 2.4128 4.0 1.00 0" 56 1 56 85 parsed_2kmd 1
57 "assign ( resid 119 and name CA ) ( resid 119 and name HA ) 21.7152 4.0 1.00 0" 57 1 57 86 parsed_2kmd 1
58 "assign ( resid 120 and name CA ) ( resid 120 and name HA ) 16.588 4.0 1.00 0" 58 1 58 85 parsed_2kmd 1
59 "assign ( resid 122 and name CA ) ( resid 122 and name HA ) -1.508 4.0 1.00 0" 59 1 59 85 parsed_2kmd 1
60 "assign ( resid 123 and name CA ) ( resid 123 and name HA ) 18.096 4.0 1.00 0" 60 1 60 85 parsed_2kmd 1
61 "assign ( resid 124 and name CA ) ( resid 124 and name HA ) -24.0168 4.0 1.00 0" 61 1 61 87 parsed_2kmd 1
62 "assign ( resid 125 and name CA ) ( resid 125 and name HA ) 9.048 4.0 1.00 0" 62 1 62 84 parsed_2kmd 1
63 "assign ( resid 126 and name CA ) ( resid 126 and name HA ) 11.7624 4.0 1.00 0" 63 1 63 86 parsed_2kmd 1
64 "assign ( resid 127 and name CA ) ( resid 127 and name HA ) 15.6832 4.0 1.00 0" 64 1 64 86 parsed_2kmd 1
65 "assign ( resid 128 and name CA ) ( resid 128 and name HA ) -21.112 4.0 1.00 0" 65 1 65 86 parsed_2kmd 1
66 "assign ( resid 129 and name CA ) ( resid 129 and name HA ) 12.9688 4.0 1.00 0" 66 1 66 86 parsed_2kmd 1
67 "assign ( resid 130 and name CA ) ( resid 130 and name HA ) -22.9216 4.0 1.00 0" 67 1 67 87 parsed_2kmd 1
68 "assign ( resid 131 and name CA ) ( resid 131 and name HA ) 7.2384 4.0 1.00 0" 68 1 68 85 parsed_2kmd 1
69 "assign ( resid 132 and name CA ) ( resid 132 and name HA ) 3.3176 4.0 1.00 0" 69 1 69 85 parsed_2kmd 1
70 "assign ( resid 133 and name CA ) ( resid 133 and name HA ) -13.2704 4.0 1.00 0" 70 1 70 87 parsed_2kmd 1
71 "assign ( resid 134 and name CA ) ( resid 134 and name HA ) 14.1752 4.0 1.00 0" 71 1 71 86 parsed_2kmd 1
stop_
save_
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