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 | item_count |
|
|
630339 |
5zr0   |
36181 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 24 |
data_5zr0_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_5zr0
_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_5zr0 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_5zr0
_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 5zr0 "Master copy" parsed_5zr0
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_5zr0
_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 5zr0.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5zr0 1
1 5zr0.mr . . XPLOR/CNS 2 distance NOE simple 1207 parsed_5zr0 1
1 5zr0.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 24 parsed_5zr0 1
1 5zr0.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_5zr0 1
1 5zr0.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5zr0 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_5zr0
_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_5zr0 1
2 1 . . . parsed_5zr0 1
3 1 . . . parsed_5zr0 1
4 1 . . . parsed_5zr0 1
5 1 . . . parsed_5zr0 1
6 1 . . . parsed_5zr0 1
7 1 . . . parsed_5zr0 1
8 1 . . . parsed_5zr0 1
9 1 . . . parsed_5zr0 1
10 1 . . . parsed_5zr0 1
11 1 . . . parsed_5zr0 1
12 1 . . . parsed_5zr0 1
13 1 . . . parsed_5zr0 1
14 1 . . . parsed_5zr0 1
15 1 . . . parsed_5zr0 1
16 1 . . . parsed_5zr0 1
17 1 . . . parsed_5zr0 1
18 1 . . . parsed_5zr0 1
19 1 . . . parsed_5zr0 1
20 1 . . . parsed_5zr0 1
21 1 . . . parsed_5zr0 1
22 1 . . . parsed_5zr0 1
23 1 . . . parsed_5zr0 1
24 1 . . . parsed_5zr0 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 . . . . . . . . . 185 . HN parsed_5zr0 1
1 1 2 . . . . . . . . . 166 . O parsed_5zr0 1
2 1 1 . . . . . . . . . 223 . HN parsed_5zr0 1
2 1 2 . . . . . . . . . 221 . O parsed_5zr0 1
3 1 1 . . . . . . . . . 217 . HN parsed_5zr0 1
3 1 2 . . . . . . . . . 229 . O parsed_5zr0 1
4 1 1 . . . . . . . . . 237 . HN parsed_5zr0 1
4 1 2 . . . . . . . . . 209 . O parsed_5zr0 1
5 1 1 . . . . . . . . . 213 . HN parsed_5zr0 1
5 1 2 . . . . . . . . . 233 . O parsed_5zr0 1
6 1 1 . . . . . . . . . 221 . HN parsed_5zr0 1
6 1 2 . . . . . . . . . 218 . O parsed_5zr0 1
7 1 1 . . . . . . . . . 154 . HN parsed_5zr0 1
7 1 2 . . . . . . . . . 240 . O parsed_5zr0 1
8 1 1 . . . . . . . . . 165 . HN parsed_5zr0 1
8 1 2 . . . . . . . . . 239 . O parsed_5zr0 1
9 1 1 . . . . . . . . . 165 . HG1 parsed_5zr0 1
9 1 2 . . . . . . . . . 239 . O parsed_5zr0 1
10 1 1 . . . . . . . . . 172 . HN parsed_5zr0 1
10 1 2 . . . . . . . . . 175 . O parsed_5zr0 1
11 1 1 . . . . . . . . . 175 . HN parsed_5zr0 1
11 1 2 . . . . . . . . . 172 . O parsed_5zr0 1
12 1 1 . . . . . . . . . 182 . O parsed_5zr0 1
12 1 2 . . . . . . . . . 168 . HN parsed_5zr0 1
13 1 1 . . . . . . . . . 199 . HN parsed_5zr0 1
13 1 2 . . . . . . . . . 196 . O parsed_5zr0 1
14 1 1 . . . . . . . . . 200 . HN parsed_5zr0 1
14 1 2 . . . . . . . . . 197 . O parsed_5zr0 1
15 1 1 . . . . . . . . . 206 . HN parsed_5zr0 1
15 1 2 . . . . . . . . . 209 . OE2 parsed_5zr0 1
16 1 1 . . . . . . . . . 215 . HN parsed_5zr0 1
16 1 2 . . . . . . . . . 231 . O parsed_5zr0 1
17 1 1 . . . . . . . . . 231 . HN parsed_5zr0 1
17 1 2 . . . . . . . . . 215 . O parsed_5zr0 1
18 1 1 . . . . . . . . . 233 . HN parsed_5zr0 1
18 1 2 . . . . . . . . . 213 . O parsed_5zr0 1
19 1 1 . . . . . . . . . 113 . HN parsed_5zr0 1
19 1 2 . . . . . . . . . 109 . O parsed_5zr0 1
20 1 1 . . . . . . . . . 117 . HN parsed_5zr0 1
20 1 2 . . . . . . . . . 115 . OD1 parsed_5zr0 1
21 1 1 . . . . . . . . . 127 . HE1 parsed_5zr0 1
21 1 2 . . . . . . . . . 180 . O parsed_5zr0 1
22 1 1 . . . . . . . . . 166 . HN parsed_5zr0 1
22 1 2 . . . . . . . . . 185 . O parsed_5zr0 1
23 1 1 . . . . . . . . . 204 . HN parsed_5zr0 1
23 1 2 . . . . . . . . . 158 . O parsed_5zr0 1
24 1 1 . . . . . . . . . 232 . HN parsed_5zr0 1
24 1 2 . . . . . . . . . 171 . O parsed_5zr0 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 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
2 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
3 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
4 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
5 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
6 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
7 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
8 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
9 1 . . . . . 3.00 1.20 3.30 parsed_5zr0 1
10 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
11 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
12 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
13 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
14 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
15 1 . . . . . 3.00 1.20 3.30 parsed_5zr0 1
16 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
17 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
18 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
19 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
20 1 . . . . . 3.00 1.20 3.30 parsed_5zr0 1
21 1 . . . . . 3.00 1.20 3.30 parsed_5zr0 1
22 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
23 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 1
24 1 . . . . . 2.00 0.20 2.30 parsed_5zr0 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 "# Restraints file 2: MP_hbond.tbl" 1 1 1 33 parsed_5zr0 1
stop_
save_
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