Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
645699 | 6nug RC | 30566 | cing | 2-parsed | STAR | entry | full | 44 |
data_6nug_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6nug
_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_6nug 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6nug
_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 6nug "Master copy" parsed_6nug
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6nug
_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 6nug.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6nug 1
1 6nug.mr . . DYANA/DIANA 2 "dihedral angle" "Not applicable" "Not applicable" 32 parsed_6nug 1
1 6nug.mr . . DYANA/DIANA 3 distance "hydrogen bond" simple 12 parsed_6nug 1
1 6nug.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6nug 1
stop_
save_
save_MR_file_comment_1
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_6nug
_Org_constr_file_comment.ID 1
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 1
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
*HEADER CYTOKINE 01-FEB-19 6NUG
*TITLE HGRNA4-28_3S
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: GRANULIN-4;
*COMPND 3 CHAIN: A;
*COMPND 4 FRAGMENT: RESIDUES 284-307;
*COMPND 5 SYNONYM: PROEPITHELIN,PEPI;
*COMPND 6 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES;
*SOURCE 3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE 4 ORGANISM_COMMON: HUMAN;
*SOURCE 5 ORGANISM_TAXID: 9606
*KEYWDS WOUND HEALING AGENT, CYTOKINE
*EXPDTA SOLUTION NMR
*NUMMDL 20
*AUTHOR M.DASTPEYMAN,P.BANSAL,D.WILSON,A.LOUKAS,M.SMOUT,N.DALY
*REVDAT 1 05-FEB-20 6NUG 0
;
save_
save_DYANA/DIANA_dihedral_2
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_6nug
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 2
_Torsion_angle_constraint_list.Details "Generated by Wattos"
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 10.0 . . 3 MET . . . . . . . . . . . . . parsed_6nug 1
2 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 180.0 . . 5 VAL . . . . . . . . . . . . . parsed_6nug 1
3 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.0 0.0 . . 8 PRO . . . . . . . . . . . . . parsed_6nug 1
4 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.0 30.0 . . 9 ASP . . . . . . . . . . . . . parsed_6nug 1
5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 50.0 110.0 . . 10 GLY . . . . . . . . . . . . . parsed_6nug 1
6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.0 40.0 . . 10 GLY . . . . . . . . . . . . . parsed_6nug 1
7 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.0 180.0 . . 11 TYR . . . . . . . . . . . . . parsed_6nug 1
8 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.0 180.0 . . 12 THR . . . . . . . . . . . . . parsed_6nug 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -80.0 . . 13 CYS . . . . . . . . . . . . . parsed_6nug 1
10 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.0 180.0 . . 13 CYS . . . . . . . . . . . . . parsed_6nug 1
11 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.0 180.0 . . 14 CYS . . . . . . . . . . . . . parsed_6nug 1
12 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 0.0 . . 17 GLN . . . . . . . . . . . . . parsed_6nug 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 50.0 120.0 . . 19 GLY . . . . . . . . . . . . . parsed_6nug 1
14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.0 50.0 . . 19 GLY . . . . . . . . . . . . . parsed_6nug 1
15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 -90 . . 21 TRP . . . . . . . . . . . . . parsed_6nug 1
16 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 -90 . . 24 CYS . . . . . . . . . . . . . parsed_6nug 1
17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 -90 . . 12 THR . . . . . . . . . . . . . parsed_6nug 1
18 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 -90 . . 14 CYS . . . . . . . . . . . . . parsed_6nug 1
19 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 17 GLN . . . . . . . . . . . . . parsed_6nug 1
20 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 -90 . . 23 CYS . . . . . . . . . . . . . parsed_6nug 1
21 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90 -30 . . 9 ASP . . . . . . . . . . . . . parsed_6nug 1
22 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 -90 . . 11 TYR . . . . . . . . . . . . . parsed_6nug 1
23 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180 -20 . . 2 ASP . . . . . . . . . . . . . parsed_6nug 1
24 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 3 MET . . . . . . . . . . . . . parsed_6nug 1
25 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180 -20 . . 4 GLU . . . . . . . . . . . . . parsed_6nug 1
26 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90 -30 . . 18 SER . . . . . . . . . . . . . parsed_6nug 1
27 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 -90 . . 5 VAL . . . . . . . . . . . . . parsed_6nug 1
28 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 -90 . . 7 CYS . . . . . . . . . . . . . parsed_6nug 1
29 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 -90 . . 6 SER . . . . . . . . . . . . . parsed_6nug 1
30 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 -90 . . 15 ARG . . . . . . . . . . . . . parsed_6nug 1
31 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150 -90 . . 16 LEU . . . . . . . . . . . . . parsed_6nug 1
32 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 18 SER . . . . . . . . . . . . . parsed_6nug 1
stop_
loop_
_TA_constraint_comment_org.ID
_TA_constraint_comment_org.Comment_text
_TA_constraint_comment_org.Comment_begin_line
_TA_constraint_comment_org.Comment_begin_column
_TA_constraint_comment_org.Comment_end_line
_TA_constraint_comment_org.Comment_end_column
_TA_constraint_comment_org.Entry_ID
_TA_constraint_comment_org.Torsion_angle_constraint_list_ID
1 "Restraints file 1: grna.aco" 1 1 1 29 parsed_6nug 1
stop_
save_
save_DYANA/DIANA_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_6nug
_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_6nug 1
2 1 . . . parsed_6nug 1
3 1 . . . parsed_6nug 1
4 1 . . . parsed_6nug 1
5 1 . . . parsed_6nug 1
6 1 . . . parsed_6nug 1
7 1 . . . parsed_6nug 1
8 1 . . . parsed_6nug 1
9 1 . . . parsed_6nug 1
10 1 . . . parsed_6nug 1
11 1 . . . parsed_6nug 1
12 1 . . . parsed_6nug 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 . . . . . . . . . 22 GLY O parsed_6nug 1
1 1 2 . . . . . . . . . 14 CYSS H parsed_6nug 1
2 1 1 . . . . . . . . . 22 GLY O parsed_6nug 1
2 1 2 . . . . . . . . . 14 CYSS N parsed_6nug 1
3 1 1 . . . . . . . . . 12 THR O parsed_6nug 1
3 1 2 . . . . . . . . . 24 CYSS H parsed_6nug 1
4 1 1 . . . . . . . . . 12 THR O parsed_6nug 1
4 1 2 . . . . . . . . . 24 CYSS N parsed_6nug 1
5 1 1 . . . . . . . . . 16 LEU H parsed_6nug 1
5 1 2 . . . . . . . . . 20 ALA O parsed_6nug 1
6 1 1 . . . . . . . . . 16 LEU N parsed_6nug 1
6 1 2 . . . . . . . . . 20 ALA O parsed_6nug 1
7 1 1 . . . . . . . . . 19 GLY H parsed_6nug 1
7 1 2 . . . . . . . . . 16 LEU O parsed_6nug 1
8 1 1 . . . . . . . . . 19 GLY N parsed_6nug 1
8 1 2 . . . . . . . . . 16 LEU O parsed_6nug 1
9 1 1 . . . . . . . . . 12 THR H parsed_6nug 1
9 1 2 . . . . . . . . . 24 CYSS O parsed_6nug 1
10 1 1 . . . . . . . . . 12 THR N parsed_6nug 1
10 1 2 . . . . . . . . . 24 CYSS O parsed_6nug 1
11 1 1 . . . . . . . . . 2 ASP H parsed_6nug 1
11 1 2 . . . . . . . . . 5 VAL O parsed_6nug 1
12 1 1 . . . . . . . . . 2 ASP N parsed_6nug 1
12 1 2 . . . . . . . . . 5 VAL O parsed_6nug 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 . . . . . . . 2.2 parsed_6nug 1
2 1 . . . . . . . 3.2 parsed_6nug 1
3 1 . . . . . . . 2.2 parsed_6nug 1
4 1 . . . . . . . 3.2 parsed_6nug 1
5 1 . . . . . . . 2.2 parsed_6nug 1
6 1 . . . . . . . 3.2 parsed_6nug 1
7 1 . . . . . . . 2.2 parsed_6nug 1
8 1 . . . . . . . 3.2 parsed_6nug 1
9 1 . . . . . . . 2.2 parsed_6nug 1
10 1 . . . . . . . 3.2 parsed_6nug 1
11 1 . . . . . . . 2.2 parsed_6nug 1
12 1 . . . . . . . 3.2 parsed_6nug 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 "Restraints file 2: D_1000239441_mr_P1.cyana.V2" 1 1 1 48 parsed_6nug 1
stop_
save_