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 | item_count |
|
|
527936 |
2l9i   |
17458 | cing | 2-parsed | STAR | dihedral angle | 27 |
data_2l9i_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2l9i
_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_2l9i 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2l9i
_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 2l9i "Master copy" parsed_2l9i
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2l9i
_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 2l9i.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2l9i 1
1 2l9i.mr . . AMBER 2 distance NOE simple 411 parsed_2l9i 1
1 2l9i.mr . . AMBER 3 stereochemistry chirality "Not applicable" 0 parsed_2l9i 1
1 2l9i.mr . . AMBER 4 "dihedral angle" "Not applicable" "Not applicable" 27 parsed_2l9i 1
1 2l9i.mr . . AMBER 5 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2l9i 1
1 2l9i.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2l9i 1
stop_
save_
save_AMBER_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2l9i
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 4
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 170. 190. . 2l9i_ambr001 3 ASP CA 2l9i_ambr001 3 ASP N 2l9i_ambr001 2 SER C 2l9i_ambr001 2 SER CA parsed_2l9i 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 4 ALA CA 2l9i_ambr001 4 ALA N 2l9i_ambr001 3 ASP C 2l9i_ambr001 3 ASP CA parsed_2l9i 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 5 ALA CA 2l9i_ambr001 5 ALA N 2l9i_ambr001 4 ALA C 2l9i_ambr001 4 ALA CA parsed_2l9i 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 6 VAL CA 2l9i_ambr001 6 VAL N 2l9i_ambr001 5 ALA C 2l9i_ambr001 5 ALA CA parsed_2l9i 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 7 ASP CA 2l9i_ambr001 7 ASP N 2l9i_ambr001 6 VAL C 2l9i_ambr001 6 VAL CA parsed_2l9i 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 8 THR CA 2l9i_ambr001 8 THR N 2l9i_ambr001 7 ASP C 2l9i_ambr001 7 ASP CA parsed_2l9i 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 9 SER CA 2l9i_ambr001 9 SER N 2l9i_ambr001 8 THR C 2l9i_ambr001 8 THR CA parsed_2l9i 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 10 SER CA 2l9i_ambr001 10 SER N 2l9i_ambr001 9 SER C 2l9i_ambr001 9 SER CA parsed_2l9i 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 11 GLU CA 2l9i_ambr001 11 GLU N 2l9i_ambr001 10 SER C 2l9i_ambr001 10 SER CA parsed_2l9i 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 12 ILE CA 2l9i_ambr001 12 ILE N 2l9i_ambr001 11 GLU C 2l9i_ambr001 11 GLU CA parsed_2l9i 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 13 THR CA 2l9i_ambr001 13 THR N 2l9i_ambr001 12 ILE C 2l9i_ambr001 12 ILE CA parsed_2l9i 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 14 THR CA 2l9i_ambr001 14 THR N 2l9i_ambr001 13 THR C 2l9i_ambr001 13 THR CA parsed_2l9i 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 15 LYS CA 2l9i_ambr001 15 LYS N 2l9i_ambr001 14 THR C 2l9i_ambr001 14 THR CA parsed_2l9i 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 16 ASP CA 2l9i_ambr001 16 ASP N 2l9i_ambr001 15 LYS C 2l9i_ambr001 15 LYS CA parsed_2l9i 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 17 LEU CA 2l9i_ambr001 17 LEU N 2l9i_ambr001 16 ASP C 2l9i_ambr001 16 ASP CA parsed_2l9i 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 18 LYS CA 2l9i_ambr001 18 LYS N 2l9i_ambr001 17 LEU C 2l9i_ambr001 17 LEU CA parsed_2l9i 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 19 GLU CA 2l9i_ambr001 19 GLU N 2l9i_ambr001 18 LYS C 2l9i_ambr001 18 LYS CA parsed_2l9i 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 20 LYS CA 2l9i_ambr001 20 LYS N 2l9i_ambr001 19 GLU C 2l9i_ambr001 19 GLU CA parsed_2l9i 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 21 LYS CA 2l9i_ambr001 21 LYS N 2l9i_ambr001 20 LYS C 2l9i_ambr001 20 LYS CA parsed_2l9i 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 22 GLU CA 2l9i_ambr001 22 GLU N 2l9i_ambr001 21 LYS C 2l9i_ambr001 21 LYS CA parsed_2l9i 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 23 VAL CA 2l9i_ambr001 23 VAL N 2l9i_ambr001 22 GLU C 2l9i_ambr001 22 GLU CA parsed_2l9i 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 24 VAL CA 2l9i_ambr001 24 VAL N 2l9i_ambr001 23 VAL C 2l9i_ambr001 23 VAL CA parsed_2l9i 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 25 GLU CA 2l9i_ambr001 25 GLU N 2l9i_ambr001 24 VAL C 2l9i_ambr001 24 VAL CA parsed_2l9i 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 26 GLU CA 2l9i_ambr001 26 GLU N 2l9i_ambr001 25 GLU C 2l9i_ambr001 25 GLU CA parsed_2l9i 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 27 ALA CA 2l9i_ambr001 27 ALA N 2l9i_ambr001 26 GLU C 2l9i_ambr001 26 GLU CA parsed_2l9i 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 28 GLU CA 2l9i_ambr001 28 GLU N 2l9i_ambr001 27 ALA C 2l9i_ambr001 27 ALA CA parsed_2l9i 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2l9i_ambr001 29 ASN CA 2l9i_ambr001 29 ASN N 2l9i_ambr001 28 GLU C 2l9i_ambr001 28 GLU CA parsed_2l9i 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 "trans-omega constraint for residue 3" 1 1 1 40 parsed_2l9i 1
2 "trans-omega constraint for residue 4" 4 1 5 40 parsed_2l9i 1
3 "trans-omega constraint for residue 5" 7 1 8 40 parsed_2l9i 1
4 "trans-omega constraint for residue 6" 10 1 11 40 parsed_2l9i 1
5 "trans-omega constraint for residue 7" 13 1 14 40 parsed_2l9i 1
6 "trans-omega constraint for residue 8" 16 1 17 40 parsed_2l9i 1
7 "trans-omega constraint for residue 9" 19 1 20 40 parsed_2l9i 1
8 "trans-omega constraint for residue 10" 22 1 23 41 parsed_2l9i 1
9 "trans-omega constraint for residue 11" 25 1 26 41 parsed_2l9i 1
10 "trans-omega constraint for residue 12" 28 1 29 41 parsed_2l9i 1
11 "trans-omega constraint for residue 13" 31 1 32 41 parsed_2l9i 1
12 "trans-omega constraint for residue 14" 34 1 35 41 parsed_2l9i 1
13 "trans-omega constraint for residue 15" 37 1 38 41 parsed_2l9i 1
14 "trans-omega constraint for residue 16" 40 1 41 41 parsed_2l9i 1
15 "trans-omega constraint for residue 17" 43 1 44 41 parsed_2l9i 1
16 "trans-omega constraint for residue 18" 46 1 47 41 parsed_2l9i 1
17 "trans-omega constraint for residue 19" 49 1 50 41 parsed_2l9i 1
18 "trans-omega constraint for residue 20" 52 1 53 41 parsed_2l9i 1
19 "trans-omega constraint for residue 21" 55 1 56 41 parsed_2l9i 1
20 "trans-omega constraint for residue 22" 58 1 59 41 parsed_2l9i 1
21 "trans-omega constraint for residue 23" 61 1 62 41 parsed_2l9i 1
22 "trans-omega constraint for residue 24" 64 1 65 41 parsed_2l9i 1
23 "trans-omega constraint for residue 25" 67 1 68 41 parsed_2l9i 1
24 "trans-omega constraint for residue 26" 70 1 71 41 parsed_2l9i 1
25 "trans-omega constraint for residue 27" 73 1 74 41 parsed_2l9i 1
26 "trans-omega constraint for residue 28" 76 1 77 41 parsed_2l9i 1
27 "trans-omega constraint for residue 29" 79 1 80 41 parsed_2l9i 1
stop_
save_
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