NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
37084 |
1p1d   |
cing | 2-parsed | STAR | distance | hydrogen bond | simple | 114 |
data_1p1d_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1p1d
_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_1p1d 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1p1d
_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 1p1d "Master copy" parsed_1p1d
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1p1d
_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 1p1d.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1p1d 1
1 1p1d.mr . . XPLOR/CNS 2 distance NOE simple 2986 parsed_1p1d 1
1 1p1d.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 153 parsed_1p1d 1
1 1p1d.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 114 parsed_1p1d 1
1 1p1d.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1p1d 1
stop_
save_
save_CNS/XPLOR_distance_constraints_4
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1p1d
_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_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_1p1d 1
2 1 . . . parsed_1p1d 1
3 1 . . . parsed_1p1d 1
4 1 . . . parsed_1p1d 1
5 1 . . . parsed_1p1d 1
6 1 . . . parsed_1p1d 1
7 1 . . . parsed_1p1d 1
8 1 . . . parsed_1p1d 1
9 1 . . . parsed_1p1d 1
10 1 . . . parsed_1p1d 1
11 1 . . . parsed_1p1d 1
12 1 . . . parsed_1p1d 1
13 1 . . . parsed_1p1d 1
14 1 . . . parsed_1p1d 1
15 1 . . . parsed_1p1d 1
16 1 . . . parsed_1p1d 1
17 1 . . . parsed_1p1d 1
18 1 . . . parsed_1p1d 1
19 1 . . . parsed_1p1d 1
20 1 . . . parsed_1p1d 1
21 1 . . . parsed_1p1d 1
22 1 . . . parsed_1p1d 1
23 1 . . . parsed_1p1d 1
24 1 . . . parsed_1p1d 1
25 1 . . . parsed_1p1d 1
26 1 . . . parsed_1p1d 1
27 1 . . . parsed_1p1d 1
28 1 . . . parsed_1p1d 1
29 1 . . . parsed_1p1d 1
30 1 . . . parsed_1p1d 1
31 1 . . . parsed_1p1d 1
32 1 . . . parsed_1p1d 1
33 1 . . . parsed_1p1d 1
34 1 . . . parsed_1p1d 1
35 1 . . . parsed_1p1d 1
36 1 . . . parsed_1p1d 1
37 1 . . . parsed_1p1d 1
38 1 . . . parsed_1p1d 1
39 1 . . . parsed_1p1d 1
40 1 . . . parsed_1p1d 1
41 1 . . . parsed_1p1d 1
42 1 . . . parsed_1p1d 1
43 1 . . . parsed_1p1d 1
44 1 . . . parsed_1p1d 1
45 1 . . . parsed_1p1d 1
46 1 . . . parsed_1p1d 1
47 1 . . . parsed_1p1d 1
48 1 . . . parsed_1p1d 1
49 1 . . . parsed_1p1d 1
50 1 . . . parsed_1p1d 1
51 1 . . . parsed_1p1d 1
52 1 . . . parsed_1p1d 1
53 1 . . . parsed_1p1d 1
54 1 . . . parsed_1p1d 1
55 1 . . . parsed_1p1d 1
56 1 . . . parsed_1p1d 1
57 1 . . . parsed_1p1d 1
58 1 . . . parsed_1p1d 1
59 1 . . . parsed_1p1d 1
60 1 . . . parsed_1p1d 1
61 1 . . . parsed_1p1d 1
62 1 . . . parsed_1p1d 1
63 1 . . . parsed_1p1d 1
64 1 . . . parsed_1p1d 1
65 1 . . . parsed_1p1d 1
66 1 . . . parsed_1p1d 1
67 1 . . . parsed_1p1d 1
68 1 . . . parsed_1p1d 1
69 1 . . . parsed_1p1d 1
70 1 . . . parsed_1p1d 1
71 1 . . . parsed_1p1d 1
72 1 . . . parsed_1p1d 1
73 1 . . . parsed_1p1d 1
74 1 . . . parsed_1p1d 1
75 1 . . . parsed_1p1d 1
76 1 . . . parsed_1p1d 1
77 1 . . . parsed_1p1d 1
78 1 . . . parsed_1p1d 1
79 1 . . . parsed_1p1d 1
80 1 . . . parsed_1p1d 1
81 1 . . . parsed_1p1d 1
82 1 . . . parsed_1p1d 1
83 1 . . . parsed_1p1d 1
84 1 . . . parsed_1p1d 1
85 1 . . . parsed_1p1d 1
86 1 . . . parsed_1p1d 1
87 1 . . . parsed_1p1d 1
88 1 . . . parsed_1p1d 1
89 1 . . . parsed_1p1d 1
90 1 . . . parsed_1p1d 1
91 1 . . . parsed_1p1d 1
92 1 . . . parsed_1p1d 1
93 1 . . . parsed_1p1d 1
94 1 . . . parsed_1p1d 1
95 1 . . . parsed_1p1d 1
96 1 . . . parsed_1p1d 1
97 1 . . . parsed_1p1d 1
98 1 . . . parsed_1p1d 1
99 1 . . . parsed_1p1d 1
100 1 . . . parsed_1p1d 1
101 1 . . . parsed_1p1d 1
102 1 . . . parsed_1p1d 1
103 1 . . . parsed_1p1d 1
104 1 . . . parsed_1p1d 1
105 1 . . . parsed_1p1d 1
106 1 . . . parsed_1p1d 1
107 1 . . . parsed_1p1d 1
108 1 . . . parsed_1p1d 1
109 1 . . . parsed_1p1d 1
110 1 . . . parsed_1p1d 1
111 1 . . . parsed_1p1d 1
112 1 . . . parsed_1p1d 1
113 1 . . . parsed_1p1d 1
114 1 . . . parsed_1p1d 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 . . . . . . . . . 91 . O parsed_1p1d 1
1 1 2 . . . . . . . . . 95 . N parsed_1p1d 1
2 1 1 . . . . . . . . . 91 . O parsed_1p1d 1
2 1 2 . . . . . . . . . 95 . HN parsed_1p1d 1
3 1 1 . . . . . . . . . 92 . O parsed_1p1d 1
3 1 2 . . . . . . . . . 96 . N parsed_1p1d 1
4 1 1 . . . . . . . . . 92 . O parsed_1p1d 1
4 1 2 . . . . . . . . . 96 . HN parsed_1p1d 1
5 1 1 . . . . . . . . . 93 . O parsed_1p1d 1
5 1 2 . . . . . . . . . 97 . N parsed_1p1d 1
6 1 1 . . . . . . . . . 93 . O parsed_1p1d 1
6 1 2 . . . . . . . . . 97 . HN parsed_1p1d 1
7 1 1 . . . . . . . . . 94 . O parsed_1p1d 1
7 1 2 . . . . . . . . . 98 . N parsed_1p1d 1
8 1 1 . . . . . . . . . 94 . O parsed_1p1d 1
8 1 2 . . . . . . . . . 98 . HN parsed_1p1d 1
9 1 1 . . . . . . . . . 95 . O parsed_1p1d 1
9 1 2 . . . . . . . . . 99 . N parsed_1p1d 1
10 1 1 . . . . . . . . . 95 . O parsed_1p1d 1
10 1 2 . . . . . . . . . 99 . HN parsed_1p1d 1
11 1 1 . . . . . . . . . 96 . O parsed_1p1d 1
11 1 2 . . . . . . . . . 100 . N parsed_1p1d 1
12 1 1 . . . . . . . . . 96 . O parsed_1p1d 1
12 1 2 . . . . . . . . . 100 . HN parsed_1p1d 1
13 1 1 . . . . . . . . . 65 . O parsed_1p1d 1
13 1 2 . . . . . . . . . 69 . N parsed_1p1d 1
14 1 1 . . . . . . . . . 65 . O parsed_1p1d 1
14 1 2 . . . . . . . . . 69 . HN parsed_1p1d 1
15 1 1 . . . . . . . . . 190 . O parsed_1p1d 1
15 1 2 . . . . . . . . . 194 . N parsed_1p1d 1
16 1 1 . . . . . . . . . 190 . O parsed_1p1d 1
16 1 2 . . . . . . . . . 194 . HN parsed_1p1d 1
17 1 1 . . . . . . . . . 191 . O parsed_1p1d 1
17 1 2 . . . . . . . . . 195 . N parsed_1p1d 1
18 1 1 . . . . . . . . . 191 . O parsed_1p1d 1
18 1 2 . . . . . . . . . 195 . HN parsed_1p1d 1
19 1 1 . . . . . . . . . 192 . O parsed_1p1d 1
19 1 2 . . . . . . . . . 196 . N parsed_1p1d 1
20 1 1 . . . . . . . . . 192 . O parsed_1p1d 1
20 1 2 . . . . . . . . . 196 . HN parsed_1p1d 1
21 1 1 . . . . . . . . . 193 . O parsed_1p1d 1
21 1 2 . . . . . . . . . 197 . N parsed_1p1d 1
22 1 1 . . . . . . . . . 193 . O parsed_1p1d 1
22 1 2 . . . . . . . . . 197 . HN parsed_1p1d 1
23 1 1 . . . . . . . . . 194 . O parsed_1p1d 1
23 1 2 . . . . . . . . . 198 . N parsed_1p1d 1
24 1 1 . . . . . . . . . 194 . O parsed_1p1d 1
24 1 2 . . . . . . . . . 198 . HN parsed_1p1d 1
25 1 1 . . . . . . . . . 195 . O parsed_1p1d 1
25 1 2 . . . . . . . . . 199 . N parsed_1p1d 1
26 1 1 . . . . . . . . . 195 . O parsed_1p1d 1
26 1 2 . . . . . . . . . 199 . HN parsed_1p1d 1
27 1 1 . . . . . . . . . 164 . O parsed_1p1d 1
27 1 2 . . . . . . . . . 168 . N parsed_1p1d 1
28 1 1 . . . . . . . . . 164 . O parsed_1p1d 1
28 1 2 . . . . . . . . . 168 . HN parsed_1p1d 1
29 1 1 . . . . . . . . . 13 . O parsed_1p1d 1
29 1 2 . . . . . . . . . 20 . HN parsed_1p1d 1
30 1 1 . . . . . . . . . 13 . O parsed_1p1d 1
30 1 2 . . . . . . . . . 20 . N parsed_1p1d 1
31 1 1 . . . . . . . . . 20 . O parsed_1p1d 1
31 1 2 . . . . . . . . . 13 . HN parsed_1p1d 1
32 1 1 . . . . . . . . . 20 . O parsed_1p1d 1
32 1 2 . . . . . . . . . 13 . N parsed_1p1d 1
33 1 1 . . . . . . . . . 15 . O parsed_1p1d 1
33 1 2 . . . . . . . . . 18 . HN parsed_1p1d 1
34 1 1 . . . . . . . . . 15 . O parsed_1p1d 1
34 1 2 . . . . . . . . . 18 . N parsed_1p1d 1
35 1 1 . . . . . . . . . 18 . O parsed_1p1d 1
35 1 2 . . . . . . . . . 15 . HN parsed_1p1d 1
36 1 1 . . . . . . . . . 18 . O parsed_1p1d 1
36 1 2 . . . . . . . . . 15 . N parsed_1p1d 1
37 1 1 . . . . . . . . . 120 . O parsed_1p1d 1
37 1 2 . . . . . . . . . 127 . HN parsed_1p1d 1
38 1 1 . . . . . . . . . 120 . O parsed_1p1d 1
38 1 2 . . . . . . . . . 127 . N parsed_1p1d 1
39 1 1 . . . . . . . . . 127 . O parsed_1p1d 1
39 1 2 . . . . . . . . . 120 . HN parsed_1p1d 1
40 1 1 . . . . . . . . . 127 . O parsed_1p1d 1
40 1 2 . . . . . . . . . 120 . N parsed_1p1d 1
41 1 1 . . . . . . . . . 23 . O parsed_1p1d 1
41 1 2 . . . . . . . . . 113 . HN parsed_1p1d 1
42 1 1 . . . . . . . . . 23 . O parsed_1p1d 1
42 1 2 . . . . . . . . . 113 . N parsed_1p1d 1
43 1 1 . . . . . . . . . 113 . O parsed_1p1d 1
43 1 2 . . . . . . . . . 23 . HN parsed_1p1d 1
44 1 1 . . . . . . . . . 113 . O parsed_1p1d 1
44 1 2 . . . . . . . . . 23 . N parsed_1p1d 1
45 1 1 . . . . . . . . . 25 . O parsed_1p1d 1
45 1 2 . . . . . . . . . 111 . HN parsed_1p1d 1
46 1 1 . . . . . . . . . 25 . O parsed_1p1d 1
46 1 2 . . . . . . . . . 111 . N parsed_1p1d 1
47 1 1 . . . . . . . . . 111 . O parsed_1p1d 1
47 1 2 . . . . . . . . . 25 . HN parsed_1p1d 1
48 1 1 . . . . . . . . . 111 . O parsed_1p1d 1
48 1 2 . . . . . . . . . 25 . N parsed_1p1d 1
49 1 1 . . . . . . . . . 27 . O parsed_1p1d 1
49 1 2 . . . . . . . . . 109 . HN parsed_1p1d 1
50 1 1 . . . . . . . . . 27 . O parsed_1p1d 1
50 1 2 . . . . . . . . . 109 . N parsed_1p1d 1
51 1 1 . . . . . . . . . 109 . O parsed_1p1d 1
51 1 2 . . . . . . . . . 27 . HN parsed_1p1d 1
52 1 1 . . . . . . . . . 109 . O parsed_1p1d 1
52 1 2 . . . . . . . . . 27 . N parsed_1p1d 1
53 1 1 . . . . . . . . . 29 . O parsed_1p1d 1
53 1 2 . . . . . . . . . 107 . HN parsed_1p1d 1
54 1 1 . . . . . . . . . 29 . O parsed_1p1d 1
54 1 2 . . . . . . . . . 107 . N parsed_1p1d 1
55 1 1 . . . . . . . . . 107 . O parsed_1p1d 1
55 1 2 . . . . . . . . . 29 . HN parsed_1p1d 1
56 1 1 . . . . . . . . . 107 . O parsed_1p1d 1
56 1 2 . . . . . . . . . 29 . N parsed_1p1d 1
57 1 1 . . . . . . . . . 105 . O parsed_1p1d 1
57 1 2 . . . . . . . . . 31 . HN parsed_1p1d 1
58 1 1 . . . . . . . . . 105 . O parsed_1p1d 1
58 1 2 . . . . . . . . . 31 . N parsed_1p1d 1
59 1 1 . . . . . . . . . 110 . O parsed_1p1d 1
59 1 2 . . . . . . . . . 79 . HN parsed_1p1d 1
60 1 1 . . . . . . . . . 110 . O parsed_1p1d 1
60 1 2 . . . . . . . . . 79 . N parsed_1p1d 1
61 1 1 . . . . . . . . . 81 . O parsed_1p1d 1
61 1 2 . . . . . . . . . 84 . HN parsed_1p1d 1
62 1 1 . . . . . . . . . 81 . O parsed_1p1d 1
62 1 2 . . . . . . . . . 84 . N parsed_1p1d 1
63 1 1 . . . . . . . . . 84 . O parsed_1p1d 1
63 1 2 . . . . . . . . . 81 . HN parsed_1p1d 1
64 1 1 . . . . . . . . . 84 . O parsed_1p1d 1
64 1 2 . . . . . . . . . 81 . N parsed_1p1d 1
65 1 1 . . . . . . . . . 108 . O parsed_1p1d 1
65 1 2 . . . . . . . . . 82 . HN parsed_1p1d 1
66 1 1 . . . . . . . . . 108 . O parsed_1p1d 1
66 1 2 . . . . . . . . . 82 . N parsed_1p1d 1
67 1 1 . . . . . . . . . 42 . O parsed_1p1d 1
67 1 2 . . . . . . . . . 56 . HN parsed_1p1d 1
68 1 1 . . . . . . . . . 42 . O parsed_1p1d 1
68 1 2 . . . . . . . . . 56 . N parsed_1p1d 1
69 1 1 . . . . . . . . . 56 . O parsed_1p1d 1
69 1 2 . . . . . . . . . 42 . HN parsed_1p1d 1
70 1 1 . . . . . . . . . 56 . O parsed_1p1d 1
70 1 2 . . . . . . . . . 42 . N parsed_1p1d 1
71 1 1 . . . . . . . . . 40 . O parsed_1p1d 1
71 1 2 . . . . . . . . . 58 . HN parsed_1p1d 1
72 1 1 . . . . . . . . . 40 . O parsed_1p1d 1
72 1 2 . . . . . . . . . 58 . N parsed_1p1d 1
73 1 1 . . . . . . . . . 38 . O parsed_1p1d 1
73 1 2 . . . . . . . . . 61 . HN parsed_1p1d 1
74 1 1 . . . . . . . . . 38 . O parsed_1p1d 1
74 1 2 . . . . . . . . . 61 . N parsed_1p1d 1
75 1 1 . . . . . . . . . 124 . O parsed_1p1d 1
75 1 2 . . . . . . . . . 210 . HN parsed_1p1d 1
76 1 1 . . . . . . . . . 124 . O parsed_1p1d 1
76 1 2 . . . . . . . . . 210 . N parsed_1p1d 1
77 1 1 . . . . . . . . . 126 . O parsed_1p1d 1
77 1 2 . . . . . . . . . 208 . HN parsed_1p1d 1
78 1 1 . . . . . . . . . 126 . O parsed_1p1d 1
78 1 2 . . . . . . . . . 208 . N parsed_1p1d 1
79 1 1 . . . . . . . . . 208 . O parsed_1p1d 1
79 1 2 . . . . . . . . . 126 . HN parsed_1p1d 1
80 1 1 . . . . . . . . . 208 . O parsed_1p1d 1
80 1 2 . . . . . . . . . 126 . N parsed_1p1d 1
81 1 1 . . . . . . . . . 128 . O parsed_1p1d 1
81 1 2 . . . . . . . . . 206 . HN parsed_1p1d 1
82 1 1 . . . . . . . . . 128 . O parsed_1p1d 1
82 1 2 . . . . . . . . . 206 . N parsed_1p1d 1
83 1 1 . . . . . . . . . 206 . O parsed_1p1d 1
83 1 2 . . . . . . . . . 128 . HN parsed_1p1d 1
84 1 1 . . . . . . . . . 206 . O parsed_1p1d 1
84 1 2 . . . . . . . . . 128 . N parsed_1p1d 1
85 1 1 . . . . . . . . . 130 . O parsed_1p1d 1
85 1 2 . . . . . . . . . 204 . HN parsed_1p1d 1
86 1 1 . . . . . . . . . 130 . O parsed_1p1d 1
86 1 2 . . . . . . . . . 204 . N parsed_1p1d 1
87 1 1 . . . . . . . . . 204 . O parsed_1p1d 1
87 1 2 . . . . . . . . . 130 . HN parsed_1p1d 1
88 1 1 . . . . . . . . . 204 . O parsed_1p1d 1
88 1 2 . . . . . . . . . 130 . N parsed_1p1d 1
89 1 1 . . . . . . . . . 202 . O parsed_1p1d 1
89 1 2 . . . . . . . . . 132 . HN parsed_1p1d 1
90 1 1 . . . . . . . . . 202 . O parsed_1p1d 1
90 1 2 . . . . . . . . . 132 . N parsed_1p1d 1
91 1 1 . . . . . . . . . 176 . O parsed_1p1d 1
91 1 2 . . . . . . . . . 209 . HN parsed_1p1d 1
92 1 1 . . . . . . . . . 176 . O parsed_1p1d 1
92 1 2 . . . . . . . . . 209 . N parsed_1p1d 1
93 1 1 . . . . . . . . . 207 . O parsed_1p1d 1
93 1 2 . . . . . . . . . 178 . HN parsed_1p1d 1
94 1 1 . . . . . . . . . 207 . O parsed_1p1d 1
94 1 2 . . . . . . . . . 178 . N parsed_1p1d 1
95 1 1 . . . . . . . . . 180 . O parsed_1p1d 1
95 1 2 . . . . . . . . . 183 . HN parsed_1p1d 1
96 1 1 . . . . . . . . . 180 . O parsed_1p1d 1
96 1 2 . . . . . . . . . 183 . N parsed_1p1d 1
97 1 1 . . . . . . . . . 183 . O parsed_1p1d 1
97 1 2 . . . . . . . . . 180 . HN parsed_1p1d 1
98 1 1 . . . . . . . . . 183 . O parsed_1p1d 1
98 1 2 . . . . . . . . . 180 . N parsed_1p1d 1
99 1 1 . . . . . . . . . 205 . O parsed_1p1d 1
99 1 2 . . . . . . . . . 181 . HN parsed_1p1d 1
100 1 1 . . . . . . . . . 205 . O parsed_1p1d 1
100 1 2 . . . . . . . . . 181 . N parsed_1p1d 1
101 1 1 . . . . . . . . . 143 . O parsed_1p1d 1
101 1 2 . . . . . . . . . 155 . HN parsed_1p1d 1
102 1 1 . . . . . . . . . 143 . O parsed_1p1d 1
102 1 2 . . . . . . . . . 155 . N parsed_1p1d 1
103 1 1 . . . . . . . . . 155 . O parsed_1p1d 1
103 1 2 . . . . . . . . . 143 . HN parsed_1p1d 1
104 1 1 . . . . . . . . . 155 . O parsed_1p1d 1
104 1 2 . . . . . . . . . 143 . N parsed_1p1d 1
105 1 1 . . . . . . . . . 141 . O parsed_1p1d 1
105 1 2 . . . . . . . . . 157 . HN parsed_1p1d 1
106 1 1 . . . . . . . . . 141 . O parsed_1p1d 1
106 1 2 . . . . . . . . . 157 . N parsed_1p1d 1
107 1 1 . . . . . . . . . 139 . O parsed_1p1d 1
107 1 2 . . . . . . . . . 160 . HN parsed_1p1d 1
108 1 1 . . . . . . . . . 139 . O parsed_1p1d 1
108 1 2 . . . . . . . . . 160 . N parsed_1p1d 1
109 1 1 . . . . . . . . . 23 . OE1 parsed_1p1d 1
109 1 2 . . . . . . . . . 161 . HZ1 parsed_1p1d 1
110 1 1 . . . . . . . . . 23 . OE1 parsed_1p1d 1
110 1 2 . . . . . . . . . 161 . NZ parsed_1p1d 1
111 1 1 . . . . . . . . . 137 . OE1 parsed_1p1d 1
111 1 2 . . . . . . . . . 160 . HZ2 parsed_1p1d 1
112 1 1 . . . . . . . . . 137 . OE1 parsed_1p1d 1
112 1 2 . . . . . . . . . 160 . NZ parsed_1p1d 1
113 1 1 . . . . . . . . . 26 . OE1 parsed_1p1d 1
113 1 2 . . . . . . . . . 160 . HZ1 parsed_1p1d 1
114 1 1 . . . . . . . . . 26 . OE1 parsed_1p1d 1
114 1 2 . . . . . . . . . 160 . NZ parsed_1p1d 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
2 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
3 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
4 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
5 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
6 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
7 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
8 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
9 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
10 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
11 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
12 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
13 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
14 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
15 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
16 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
17 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
18 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
19 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
20 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
21 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
22 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
23 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
24 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
25 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
26 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
27 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
28 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
29 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
30 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
31 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
32 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
33 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
34 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
35 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
36 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
37 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
38 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
39 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
40 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
41 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
42 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
43 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
44 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
45 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
46 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
47 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
48 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
49 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
50 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
51 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
52 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
53 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
54 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
55 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
56 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
57 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
58 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
59 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
60 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
61 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
62 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
63 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
64 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
65 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
66 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
67 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
68 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
69 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
70 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
71 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
72 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
73 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
74 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
75 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
76 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
77 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
78 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
79 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
80 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
81 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
82 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
83 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
84 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
85 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
86 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
87 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
88 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
89 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
90 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
91 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
92 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
93 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
94 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
95 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
96 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
97 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
98 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
99 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
100 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
101 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
102 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
103 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
104 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
105 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
106 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
107 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
108 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
109 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
110 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
111 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
112 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
113 1 . . . . . 2.2 1.8 2.2 parsed_1p1d 1
114 1 . . . . . 3.3 2.2 3.3 parsed_1p1d 1
stop_
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 "helix B PDZ4" 1 1 1 14 parsed_1p1d 1
2
;
helix A PDZ4
assign (resid 66 and name O ) (resid 70 and name N ) 3.3 1.1 0.0
assign (resid 66 and name O ) (resid 70 and name HN ) 2.2 0.4 0.0
;
21 1 24 67 parsed_1p1d 1
3
;
assign (resid 68 and name O ) (resid 72 and name N ) 3.3 1.1 0.0
assign (resid 68 and name O ) (resid 72 and name HN ) 2.2 0.4 0.0
helix B PDZ5
;
29 1 32 14 parsed_1p1d 1
4 "helix A PDZ5" 52 1 52 14 parsed_1p1d 1
5
;
assign (resid 165 and name O ) (resid 169 and name N ) 3.3 1.1 0.0
assign (resid 165 and name O ) (resid 169 and name HN ) 2.2 0.4 0.0
assign (resid 166 and name O ) (resid 170 and name N ) 3.3 1.1 0.0
assign (resid 166 and name O ) (resid 170 and name HN ) 2.2 0.4 0.0
assign (resid 167 and name O ) (resid 171 and name N ) 3.3 1.1 0.0
assign (resid 167 and name O ) (resid 171 and name HN ) 2.2 0.4 0.0
b-sheet link region
;
57 1 67 21 parsed_1p1d 1
6
;
assign (resid 122 and name O ) (resid 125 and name HN ) 2.2 0.4 0.0
assign (resid 122 and name O ) (resid 125 and name N ) 3.3 1.1 0.0
assign (resid 125 and name O ) (resid 122 and name HN ) 2.2 0.4 0.0
assign (resid 125 and name O ) (resid 122 and name N ) 3.3 1.1 0.0
assign (resid 21 and name O ) (resid 115 and name HN ) 2.2 0.4 0.0
assign (resid 21 and name O ) (resid 115 and name N ) 3.3 1.1 0.0
assign (resid 115 and name O ) (resid 21 and name HN ) 2.2 0.4 0.0
assign (resid 115 and name O ) (resid 21 and name N ) 3.3 1.1 0.0
assign (resid 19 and name O ) (resid 117 and name HN ) 2.2 0.4 0.0
assign (resid 117 and name O ) (resid 19 and name N ) 3.3 1.1 0.0
b-sheet PDZ4
;
84 1 97 14 parsed_1p1d 1
7
;
assign (resid 31 and name O ) (resid 105 and name HN ) 2.2 0.4 0.0
assign (resid 31 and name O ) (resid 105 and name N ) 3.3 1.1 0.0
;
120 1 121 67 parsed_1p1d 1
8
;
assign (resid 77 and name O ) (resid 112 and name HN ) 2.2 0.4 0.0
assign (resid 77 and name O ) (resid 112 and name N ) 3.3 1.1 0.0
assign (resid 112 and name O ) (resid 77 and name HN ) 2.2 0.4 0.0
assign (resid 112 and name O ) (resid 77 and name N ) 3.3 1.1 0.0
assign (resid 79 and name O ) (resid 110 and name HN ) 2.2 0.4 0.0
assign (resid 79 and name O ) (resid 110 and name N ) 3.3 1.1 0.0
;
125 1 131 67 parsed_1p1d 1
9
;
assign (resid 58 and name O ) (resid 40 and name HN ) 2.2 0.4 0.0
assign (resid 58 and name O ) (resid 40 and name N ) 3.3 1.1 0.0
;
150 1 151 66 parsed_1p1d 1
10 "b-sheet PDZ5" 156 1 156 14 parsed_1p1d 1
11
;
assign (resid 210 and name O ) (resid 124 and name HN ) 2.2 0.4 0.0
assign (resid 210 and name O ) (resid 124 and name N ) 3.3 1.1 0.0
;
160 1 161 68 parsed_1p1d 1
12
;
assign (resid 132 and name O ) (resid 202 and name HN ) 2.2 0.4 0.0
assign (resid 132 and name O ) (resid 202 and name N ) 3.3 1.1 0.0
;
179 1 180 68 parsed_1p1d 1
13
;
assign (resid 209 and name O ) (resid 176 and name HN ) 2.2 0.4 0.0
assign (resid 209 and name O ) (resid 176 and name N ) 3.3 1.1 0.0
assign (resid 178 and name O ) (resid 207 and name HN ) 2.2 0.4 0.0
assign (resid 178 and name O ) (resid 207 and name N ) 3.3 1.1 0.0
;
186 1 190 68 parsed_1p1d 1
14
;
assign (resid 157 and name O ) (resid 141 and name HN ) 2.2 0.4 0.0
assign (resid 157 and name O ) (resid 141 and name N ) 3.3 1.1 0.0
;
209 1 210 68 parsed_1p1d 1
15 append 217 1 217 8 parsed_1p1d 1
stop_
save_
Contact the webmaster for help, if required. Wednesday, May 29, 2024 1:21:09 AM GMT (wattos1)