NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
602501 |
2mxc   |
25402 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 44 |
data_2mxc_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2mxc
_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_2mxc 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2mxc
_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 2mxc "Master copy" parsed_2mxc
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2mxc
_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 2mxc.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2mxc 1
1 2mxc.mr . . XPLOR/CNS 2 distance "hydrogen bond" simple 44 parsed_2mxc 1
1 2mxc.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2mxc 1
1 2mxc.mr . . XPLOR/CNS 4 distance NOE ambi 0 parsed_2mxc 1
1 2mxc.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2mxc 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2mxc
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
_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_2mxc 1
2 1 . . . parsed_2mxc 1
3 1 . . . parsed_2mxc 1
4 1 . . . parsed_2mxc 1
5 1 . . . parsed_2mxc 1
6 1 . . . parsed_2mxc 1
7 1 . . . parsed_2mxc 1
8 1 . . . parsed_2mxc 1
9 1 . . . parsed_2mxc 1
10 1 . . . parsed_2mxc 1
11 1 . . . parsed_2mxc 1
12 1 . . . parsed_2mxc 1
13 1 . . . parsed_2mxc 1
14 1 . . . parsed_2mxc 1
15 1 . . . parsed_2mxc 1
16 1 . . . parsed_2mxc 1
17 1 . . . parsed_2mxc 1
18 1 . . . parsed_2mxc 1
19 1 . . . parsed_2mxc 1
20 1 . . . parsed_2mxc 1
21 1 . . . parsed_2mxc 1
22 1 . . . parsed_2mxc 1
23 1 . . . parsed_2mxc 1
24 1 . . . parsed_2mxc 1
25 1 . . . parsed_2mxc 1
26 1 . . . parsed_2mxc 1
27 1 . . . parsed_2mxc 1
28 1 . . . parsed_2mxc 1
29 1 . . . parsed_2mxc 1
30 1 . . . parsed_2mxc 1
31 1 . . . parsed_2mxc 1
32 1 . . . parsed_2mxc 1
33 1 . . . parsed_2mxc 1
34 1 . . . parsed_2mxc 1
35 1 . . . parsed_2mxc 1
36 1 . . . parsed_2mxc 1
37 1 . . . parsed_2mxc 1
38 1 . . . parsed_2mxc 1
39 1 . . . parsed_2mxc 1
40 1 . . . parsed_2mxc 1
41 1 . . . parsed_2mxc 1
42 1 . . . parsed_2mxc 1
43 1 . . . parsed_2mxc 1
44 1 . . . parsed_2mxc 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 . . . . . . . . . 30 . HN parsed_2mxc 1
1 1 2 . . . . . . . . . 54 . O parsed_2mxc 1
2 1 1 . . . . . . . . . 30 . N parsed_2mxc 1
2 1 2 . . . . . . . . . 54 . O parsed_2mxc 1
3 1 1 . . . . . . . . . 32 . HN parsed_2mxc 1
3 1 2 . . . . . . . . . 52 . O parsed_2mxc 1
4 1 1 . . . . . . . . . 32 . N parsed_2mxc 1
4 1 2 . . . . . . . . . 52 . O parsed_2mxc 1
5 1 1 . . . . . . . . . 34 . HN parsed_2mxc 1
5 1 2 . . . . . . . . . 50 . O parsed_2mxc 1
6 1 1 . . . . . . . . . 34 . N parsed_2mxc 1
6 1 2 . . . . . . . . . 50 . O parsed_2mxc 1
7 1 1 . . . . . . . . . 49 . HN parsed_2mxc 1
7 1 2 . . . . . . . . . 69 . O parsed_2mxc 1
8 1 1 . . . . . . . . . 49 . N parsed_2mxc 1
8 1 2 . . . . . . . . . 69 . O parsed_2mxc 1
9 1 1 . . . . . . . . . 50 . HN parsed_2mxc 1
9 1 2 . . . . . . . . . 34 . O parsed_2mxc 1
10 1 1 . . . . . . . . . 50 . N parsed_2mxc 1
10 1 2 . . . . . . . . . 34 . O parsed_2mxc 1
11 1 1 . . . . . . . . . 51 . HN parsed_2mxc 1
11 1 2 . . . . . . . . . 67 . O parsed_2mxc 1
12 1 1 . . . . . . . . . 51 . N parsed_2mxc 1
12 1 2 . . . . . . . . . 67 . O parsed_2mxc 1
13 1 1 . . . . . . . . . 52 . HN parsed_2mxc 1
13 1 2 . . . . . . . . . 32 . O parsed_2mxc 1
14 1 1 . . . . . . . . . 52 . N parsed_2mxc 1
14 1 2 . . . . . . . . . 32 . O parsed_2mxc 1
15 1 1 . . . . . . . . . 54 . HN parsed_2mxc 1
15 1 2 . . . . . . . . . 30 . O parsed_2mxc 1
16 1 1 . . . . . . . . . 54 . N parsed_2mxc 1
16 1 2 . . . . . . . . . 30 . O parsed_2mxc 1
17 1 1 . . . . . . . . . 67 . HN parsed_2mxc 1
17 1 2 . . . . . . . . . 51 . O parsed_2mxc 1
18 1 1 . . . . . . . . . 67 . N parsed_2mxc 1
18 1 2 . . . . . . . . . 51 . O parsed_2mxc 1
19 1 1 . . . . . . . . . 69 . HN parsed_2mxc 1
19 1 2 . . . . . . . . . 49 . O parsed_2mxc 1
20 1 1 . . . . . . . . . 69 . N parsed_2mxc 1
20 1 2 . . . . . . . . . 49 . O parsed_2mxc 1
21 1 1 . . . . . . . . . 74 . HN parsed_2mxc 1
21 1 2 . . . . . . . . . 70 . O parsed_2mxc 1
22 1 1 . . . . . . . . . 74 . N parsed_2mxc 1
22 1 2 . . . . . . . . . 70 . O parsed_2mxc 1
23 1 1 . . . . . . . . . 77 . HN parsed_2mxc 1
23 1 2 . . . . . . . . . 73 . O parsed_2mxc 1
24 1 1 . . . . . . . . . 77 . N parsed_2mxc 1
24 1 2 . . . . . . . . . 73 . O parsed_2mxc 1
25 1 1 . . . . . . . . . 78 . HN parsed_2mxc 1
25 1 2 . . . . . . . . . 74 . O parsed_2mxc 1
26 1 1 . . . . . . . . . 78 . N parsed_2mxc 1
26 1 2 . . . . . . . . . 74 . O parsed_2mxc 1
27 1 1 . . . . . . . . . 80 . HN parsed_2mxc 1
27 1 2 . . . . . . . . . 76 . O parsed_2mxc 1
28 1 1 . . . . . . . . . 80 . N parsed_2mxc 1
28 1 2 . . . . . . . . . 76 . O parsed_2mxc 1
29 1 1 . . . . . . . . . 81 . HN parsed_2mxc 1
29 1 2 . . . . . . . . . 77 . O parsed_2mxc 1
30 1 1 . . . . . . . . . 81 . N parsed_2mxc 1
30 1 2 . . . . . . . . . 77 . O parsed_2mxc 1
31 1 1 . . . . . . . . . 82 . HN parsed_2mxc 1
31 1 2 . . . . . . . . . 78 . O parsed_2mxc 1
32 1 1 . . . . . . . . . 82 . N parsed_2mxc 1
32 1 2 . . . . . . . . . 78 . O parsed_2mxc 1
33 1 1 . . . . . . . . . 126 . HN parsed_2mxc 1
33 1 2 . . . . . . . . . 122 . O parsed_2mxc 1
34 1 1 . . . . . . . . . 126 . N parsed_2mxc 1
34 1 2 . . . . . . . . . 122 . O parsed_2mxc 1
35 1 1 . . . . . . . . . 129 . HN parsed_2mxc 1
35 1 2 . . . . . . . . . 125 . O parsed_2mxc 1
36 1 1 . . . . . . . . . 129 . N parsed_2mxc 1
36 1 2 . . . . . . . . . 125 . O parsed_2mxc 1
37 1 1 . . . . . . . . . 130 . HN parsed_2mxc 1
37 1 2 . . . . . . . . . 126 . O parsed_2mxc 1
38 1 1 . . . . . . . . . 130 . N parsed_2mxc 1
38 1 2 . . . . . . . . . 126 . O parsed_2mxc 1
39 1 1 . . . . . . . . . 144 . HN parsed_2mxc 1
39 1 2 . . . . . . . . . 140 . O parsed_2mxc 1
40 1 1 . . . . . . . . . 144 . N parsed_2mxc 1
40 1 2 . . . . . . . . . 140 . O parsed_2mxc 1
41 1 1 . . . . . . . . . 145 . HN parsed_2mxc 1
41 1 2 . . . . . . . . . 141 . O parsed_2mxc 1
42 1 1 . . . . . . . . . 145 . N parsed_2mxc 1
42 1 2 . . . . . . . . . 141 . O parsed_2mxc 1
43 1 1 . . . . . . . . . 146 . HN parsed_2mxc 1
43 1 2 . . . . . . . . . 142 . O parsed_2mxc 1
44 1 1 . . . . . . . . . 146 . N parsed_2mxc 1
44 1 2 . . . . . . . . . 142 . O parsed_2mxc 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 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
2 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
3 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
4 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
5 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
6 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
7 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
8 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
9 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
10 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
11 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
12 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
13 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
14 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
15 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
16 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
17 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
18 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
19 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
20 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
21 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
22 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
23 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
24 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
25 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
26 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
27 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
28 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
29 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
30 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
31 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
32 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
33 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
34 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
35 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
36 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
37 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
38 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
39 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
40 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
41 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
42 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 1
43 1 . . . . . 2.3 1.8 2.4 parsed_2mxc 1
44 1 . . . . . 3.3 2.6 3.4 parsed_2mxc 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 "hbond for resid 29" 1 1 1 20 parsed_2mxc 1
2 "hbond for resid 31" 5 1 5 20 parsed_2mxc 1
3 "hbond for resid 33" 9 1 9 20 parsed_2mxc 1
4 "hbond for resid 48" 13 1 13 20 parsed_2mxc 1
5 "hbond for resid 49" 17 1 17 20 parsed_2mxc 1
6 "hbond for resid 50" 21 1 21 20 parsed_2mxc 1
7 "hbond for resid 51" 25 1 25 20 parsed_2mxc 1
8 "hbond for resid 53" 29 1 29 20 parsed_2mxc 1
9 "hbond for resid 66" 33 1 33 20 parsed_2mxc 1
10 "hbond for resid 68" 37 1 37 20 parsed_2mxc 1
11 "hbond for resid 73" 41 1 41 20 parsed_2mxc 1
12 "hbond for resid 76" 45 1 45 20 parsed_2mxc 1
13 "hbond for resid 77" 49 1 49 20 parsed_2mxc 1
14 "hbond for resid 79" 53 1 53 20 parsed_2mxc 1
15 "hbond for resid 80" 57 1 57 20 parsed_2mxc 1
16 "hbond for resid 81" 61 1 61 20 parsed_2mxc 1
17 "hbond for resid 125" 65 1 65 21 parsed_2mxc 1
18 "hbond for resid 128" 69 1 69 21 parsed_2mxc 1
19 "hbond for resid 129" 73 1 73 21 parsed_2mxc 1
20 "hbond for resid 143" 77 1 77 21 parsed_2mxc 1
21 "hbond for resid 144" 81 1 81 21 parsed_2mxc 1
22 "hbond for resid 145" 85 1 85 21 parsed_2mxc 1
stop_
save_
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