NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
610780 |
5ixf   |
cing | 2-parsed | STAR | distance | NOE | simple | 14 |
data_5ixf_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_5ixf
_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_5ixf 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_5ixf
_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 5ixf "Master copy" parsed_5ixf
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_5ixf
_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 5ixf.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5ixf 1
1 5ixf.mr . . XPLOR/CNS 2 distance NOE simple 14 parsed_5ixf 1
1 5ixf.mr . . "MR format" 3 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5ixf 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_5ixf
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_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_5ixf 1
2 1 . . . parsed_5ixf 1
3 1 . . . parsed_5ixf 1
4 1 . . . parsed_5ixf 1
5 1 . . . parsed_5ixf 1
6 1 . . . parsed_5ixf 1
7 1 . . . parsed_5ixf 1
8 1 . . . parsed_5ixf 1
9 1 . . . parsed_5ixf 1
10 1 . . . parsed_5ixf 1
11 1 . . . parsed_5ixf 1
12 1 . . . parsed_5ixf 1
13 1 . . . parsed_5ixf 1
14 1 . . . parsed_5ixf 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 . . . . . . . . A 231 . HG# parsed_5ixf 1
1 1 2 . . . . . . . . B 2 . HG# parsed_5ixf 1
2 1 1 . . . . . . . . A 244 . HA parsed_5ixf 1
2 1 2 . . . . . . . . B 11 . HG# parsed_5ixf 1
3 1 1 . . . . . . . . A 246 . HB# parsed_5ixf 1
3 1 2 . . . . . . . . B 12 . HG# parsed_5ixf 1
4 1 1 . . . . . . . . A 266 . HA parsed_5ixf 1
4 1 2 . . . . . . . . B 2 . HA parsed_5ixf 1
5 1 1 . . . . . . . . A 246 . HD1 parsed_5ixf 1
5 1 2 . . . . . . . . B 12 . HD# parsed_5ixf 1
6 1 1 . . . . . . . . A 218 . HD# parsed_5ixf 1
6 1 2 . . . . . . . . B 8 . HH# parsed_5ixf 1
7 1 1 . . . . . . . . A 242 . HN parsed_5ixf 1
7 1 2 . . . . . . . . B 12 . HD# parsed_5ixf 1
8 1 1 . . . . . . . . A 243 . HN parsed_5ixf 1
8 1 2 . . . . . . . . B 12 . HG# parsed_5ixf 1
9 1 1 . . . . . . . . A 243 . HN parsed_5ixf 1
9 1 2 . . . . . . . . B 13 . HA# parsed_5ixf 1
10 1 1 . . . . . . . . A 246 . HN parsed_5ixf 1
10 1 2 . . . . . . . . B 12 . HD# parsed_5ixf 1
11 1 1 . . . . . . . . A 246 . HE1 parsed_5ixf 1
11 1 2 . . . . . . . . B 12 . HD# parsed_5ixf 1
12 1 1 . . . . . . . . A 246 . HE1 parsed_5ixf 1
12 1 2 . . . . . . . . B 11 . HG# parsed_5ixf 1
13 1 1 . . . . . . . . A 260 . HN parsed_5ixf 1
13 1 2 . . . . . . . . B 6 . HA parsed_5ixf 1
14 1 1 . . . . . . . . A 261 . HN parsed_5ixf 1
14 1 2 . . . . . . . . B 6 . HA parsed_5ixf 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 . . . . . 3.200 1.400 5.200 parsed_5ixf 1
2 1 . . . . . 5.050 1.850 5.050 parsed_5ixf 1
3 1 . . . . . 4.940 1.840 4.990 parsed_5ixf 1
4 1 . . . . . 4.220 1.820 5.020 parsed_5ixf 1
5 1 . . . . . 2.700 1.800 5.000 parsed_5ixf 1
6 1 . . . . . 2.680 1.800 5.180 parsed_5ixf 1
7 1 . . . . . 5.330 1.830 6.330 parsed_5ixf 1
8 1 . . . . . 4.800 1.800 5.800 parsed_5ixf 1
9 1 . . . . . 4.700 1.900 5.700 parsed_5ixf 1
10 1 . . . . . 5.240 1.840 6.240 parsed_5ixf 1
11 1 . . . . . 5.410 1.810 6.410 parsed_5ixf 1
12 1 . . . . . 4.400 1.800 6.400 parsed_5ixf 1
13 1 . . . . . 4.400 1.800 5.400 parsed_5ixf 1
14 1 . . . . . 5.200 1.800 6.200 parsed_5ixf 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 1: dist.tbl" 1 1 1 29 parsed_5ixf 1
stop_
save_
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