NMR Restraints Grid
| |
NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | in_dress | stage | program | type | subtype | subsubtype | item_count |
|
|
30274 |
1c8p   |
4308 | cing | recoord | dress | 2-parsed | STAR | distance | hydrogen bond | simple | 30 |
data_1c8p_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1c8p
_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_1c8p 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1c8p
_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 1c8p "Master copy" parsed_1c8p
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1c8p
_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 1c8p.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1c8p 1
1 1c8p.mr . . XPLOR/CNS 2 distance NOE simple 1575 parsed_1c8p 1
1 1c8p.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 30 parsed_1c8p 1
1 1c8p.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1c8p 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1c8p
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 3
_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_1c8p 1
2 1 . . . parsed_1c8p 1
3 1 . . . parsed_1c8p 1
4 1 . . . parsed_1c8p 1
5 1 . . . parsed_1c8p 1
6 1 . . . parsed_1c8p 1
7 1 . . . parsed_1c8p 1
8 1 . . . parsed_1c8p 1
9 1 . . . parsed_1c8p 1
10 1 . . . parsed_1c8p 1
11 1 . . . parsed_1c8p 1
12 1 . . . parsed_1c8p 1
13 1 . . . parsed_1c8p 1
14 1 . . . parsed_1c8p 1
15 1 . . . parsed_1c8p 1
16 1 . . . parsed_1c8p 1
17 1 . . . parsed_1c8p 1
18 1 . . . parsed_1c8p 1
19 1 . . . parsed_1c8p 1
20 1 . . . parsed_1c8p 1
21 1 . . . parsed_1c8p 1
22 1 . . . parsed_1c8p 1
23 1 . . . parsed_1c8p 1
24 1 . . . parsed_1c8p 1
25 1 . . . parsed_1c8p 1
26 1 . . . parsed_1c8p 1
27 1 . . . parsed_1c8p 1
28 1 . . . parsed_1c8p 1
29 1 . . . parsed_1c8p 1
30 1 . . . parsed_1c8p 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 . . . . . . . . . 21 . HN parsed_1c8p 1
1 1 2 . . . . . . . . . 10 . O parsed_1c8p 1
2 1 1 . . . . . . . . . 21 . N parsed_1c8p 1
2 1 2 . . . . . . . . . 10 . O parsed_1c8p 1
3 1 1 . . . . . . . . . 36 . HN parsed_1c8p 1
3 1 2 . . . . . . . . . 55 . O parsed_1c8p 1
4 1 1 . . . . . . . . . 36 . N parsed_1c8p 1
4 1 2 . . . . . . . . . 55 . O parsed_1c8p 1
5 1 1 . . . . . . . . . 37 . HN parsed_1c8p 1
5 1 2 . . . . . . . . . 77 . O parsed_1c8p 1
6 1 1 . . . . . . . . . 37 . N parsed_1c8p 1
6 1 2 . . . . . . . . . 77 . O parsed_1c8p 1
7 1 1 . . . . . . . . . 38 . HN parsed_1c8p 1
7 1 2 . . . . . . . . . 53 . O parsed_1c8p 1
8 1 1 . . . . . . . . . 38 . N parsed_1c8p 1
8 1 2 . . . . . . . . . 53 . O parsed_1c8p 1
9 1 1 . . . . . . . . . 39 . HN parsed_1c8p 1
9 1 2 . . . . . . . . . 75 . O parsed_1c8p 1
10 1 1 . . . . . . . . . 39 . N parsed_1c8p 1
10 1 2 . . . . . . . . . 75 . O parsed_1c8p 1
11 1 1 . . . . . . . . . 41 . HN parsed_1c8p 1
11 1 2 . . . . . . . . . 73 . O parsed_1c8p 1
12 1 1 . . . . . . . . . 41 . N parsed_1c8p 1
12 1 2 . . . . . . . . . 73 . O parsed_1c8p 1
13 1 1 . . . . . . . . . 72 . HN parsed_1c8p 1
13 1 2 . . . . . . . . . 98 . O parsed_1c8p 1
14 1 1 . . . . . . . . . 72 . N parsed_1c8p 1
14 1 2 . . . . . . . . . 98 . O parsed_1c8p 1
15 1 1 . . . . . . . . . 73 . HN parsed_1c8p 1
15 1 2 . . . . . . . . . 41 . O parsed_1c8p 1
16 1 1 . . . . . . . . . 73 . N parsed_1c8p 1
16 1 2 . . . . . . . . . 41 . O parsed_1c8p 1
17 1 1 . . . . . . . . . 74 . HN parsed_1c8p 1
17 1 2 . . . . . . . . . 96 . O parsed_1c8p 1
18 1 1 . . . . . . . . . 74 . N parsed_1c8p 1
18 1 2 . . . . . . . . . 96 . O parsed_1c8p 1
19 1 1 . . . . . . . . . 75 . HN parsed_1c8p 1
19 1 2 . . . . . . . . . 39 . O parsed_1c8p 1
20 1 1 . . . . . . . . . 75 . N parsed_1c8p 1
20 1 2 . . . . . . . . . 39 . O parsed_1c8p 1
21 1 1 . . . . . . . . . 76 . HN parsed_1c8p 1
21 1 2 . . . . . . . . . 93 . OG parsed_1c8p 1
22 1 1 . . . . . . . . . 76 . N parsed_1c8p 1
22 1 2 . . . . . . . . . 93 . OG parsed_1c8p 1
23 1 1 . . . . . . . . . 77 . HN parsed_1c8p 1
23 1 2 . . . . . . . . . 37 . O parsed_1c8p 1
24 1 1 . . . . . . . . . 77 . N parsed_1c8p 1
24 1 2 . . . . . . . . . 37 . O parsed_1c8p 1
25 1 1 . . . . . . . . . 78 . HN parsed_1c8p 1
25 1 2 . . . . . . . . . 90 . OG parsed_1c8p 1
26 1 1 . . . . . . . . . 78 . N parsed_1c8p 1
26 1 2 . . . . . . . . . 90 . OG parsed_1c8p 1
27 1 1 . . . . . . . . . 93 . HN parsed_1c8p 1
27 1 2 . . . . . . . . . 76 . O parsed_1c8p 1
28 1 1 . . . . . . . . . 93 . N parsed_1c8p 1
28 1 2 . . . . . . . . . 76 . O parsed_1c8p 1
29 1 1 . . . . . . . . . 98 . HN parsed_1c8p 1
29 1 2 . . . . . . . . . 72 . O parsed_1c8p 1
30 1 1 . . . . . . . . . 98 . N parsed_1c8p 1
30 1 2 . . . . . . . . . 72 . O parsed_1c8p 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 . . . . . 0.0 -1.7 2.2 parsed_1c8p 1
2 1 . . . . . 0.0 -2.7 3.2 parsed_1c8p 1
3 1 . . . . . 0.0 -1.7 2.2 parsed_1c8p 1
4 1 . . . . . 0.0 -2.7 3.2 parsed_1c8p 1
5 1 . . . . . 0.0 -1.7 2.2 parsed_1c8p 1
6 1 . . . . . 0.0 -2.7 3.2 parsed_1c8p 1
7 1 . . . . . 0.0 -1.7 2.2 parsed_1c8p 1
8 1 . . . . . 0.0 -2.7 3.2 parsed_1c8p 1
9 1 . . . . . 0.0 -1.7 2.2 parsed_1c8p 1
10 1 . . . . . 0.0 -2.7 3.2 parsed_1c8p 1
11 1 . . . . . 0.0 -1.7 2.2 parsed_1c8p 1
12 1 . . . . . 0.0 -2.7 3.2 parsed_1c8p 1
13 1 . . . . . 0.0 -1.7 2.2 parsed_1c8p 1
14 1 . . . . . 0.0 -2.7 3.2 parsed_1c8p 1
15 1 . . . . . 0.0 -1.7 2.2 parsed_1c8p 1
16 1 . . . . . 0.0 -2.7 3.2 parsed_1c8p 1
17 1 . . . . . 0.0 -1.7 2.2 parsed_1c8p 1
18 1 . . . . . 0.0 -2.7 3.2 parsed_1c8p 1
19 1 . . . . . 0.0 -1.7 2.2 parsed_1c8p 1
20 1 . . . . . 0.0 -2.7 3.2 parsed_1c8p 1
21 1 . . . . . 0.0 -1.7 2.2 parsed_1c8p 1
22 1 . . . . . 0.0 -2.7 3.2 parsed_1c8p 1
23 1 . . . . . 0.0 -1.7 2.2 parsed_1c8p 1
24 1 . . . . . 0.0 -2.7 3.2 parsed_1c8p 1
25 1 . . . . . 0.0 -1.7 2.2 parsed_1c8p 1
26 1 . . . . . 0.0 -2.7 3.2 parsed_1c8p 1
27 1 . . . . . 0.0 -1.7 2.2 parsed_1c8p 1
28 1 . . . . . 0.0 -2.7 3.2 parsed_1c8p 1
29 1 . . . . . 0.0 -1.7 2.2 parsed_1c8p 1
30 1 . . . . . 0.0 -2.7 3.2 parsed_1c8p 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
;
hydrogen bonds
HN 21
;
1 1 3 7 parsed_1c8p 1
2 "HN 36" 16 1 16 7 parsed_1c8p 1
3 "HN 37" 29 1 29 7 parsed_1c8p 1
4 "HN 38" 42 1 42 7 parsed_1c8p 1
5 "HN 39" 55 1 55 7 parsed_1c8p 1
6 "HN 41" 68 1 68 7 parsed_1c8p 1
7 "HN 72" 81 1 81 7 parsed_1c8p 1
8 "HN 73" 94 1 94 7 parsed_1c8p 1
9 "HN 74" 107 1 107 7 parsed_1c8p 1
10 "HN 75" 120 1 120 7 parsed_1c8p 1
11 "HN 76" 133 1 133 7 parsed_1c8p 1
12 "HN 77" 146 1 146 7 parsed_1c8p 1
13 "HN 78" 159 1 159 7 parsed_1c8p 1
14 "HN 93" 172 1 172 7 parsed_1c8p 1
15 "HN 98" 185 1 185 7 parsed_1c8p 1
stop_
save_
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