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 |
|
|
548411 |
2lxd   |
16779 | cing | 2-parsed | STAR | dihedral angle | 45 |
data_2lxd_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2lxd
_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_2lxd 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2lxd
_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 2lxd "Master copy" parsed_2lxd
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2lxd
_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 2lxd.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2lxd 1
1 2lxd.mr . . DYANA/DIANA 2 "dihedral angle" "Not applicable" "Not applicable" 45 parsed_2lxd 1
1 2lxd.mr . . DYANA/DIANA 3 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2lxd 1
1 2lxd.mr . . DYANA/DIANA 4 distance NOE simple 0 parsed_2lxd 1
1 2lxd.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2lxd 1
stop_
save_
save_DYANA/DIANA_dihedral_2
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2lxd
_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 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 3 ARG+ . . . . . . . . . . . . . parsed_2lxd 1
2 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 12 ALA . . . . . . . . . . . . . parsed_2lxd 1
3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 13 SER . . . . . . . . . . . . . parsed_2lxd 1
4 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 16 LYS+ . . . . . . . . . . . . . parsed_2lxd 1
5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 17 ARG+ . . . . . . . . . . . . . parsed_2lxd 1
6 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 18 ILE . . . . . . . . . . . . . parsed_2lxd 1
7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 25 MET . . . . . . . . . . . . . parsed_2lxd 1
8 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 29 ASP- . . . . . . . . . . . . . parsed_2lxd 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 30 LYS+ . . . . . . . . . . . . . parsed_2lxd 1
10 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 31 VAL . . . . . . . . . . . . . parsed_2lxd 1
11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 33 HIS . . . . . . . . . . . . . parsed_2lxd 1
12 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 34 LEU . . . . . . . . . . . . . parsed_2lxd 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 35 GLU- . . . . . . . . . . . . . parsed_2lxd 1
14 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 36 CYS . . . . . . . . . . . . . parsed_2lxd 1
15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 38 LYS+ . . . . . . . . . . . . . parsed_2lxd 1
16 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 39 CYS . . . . . . . . . . . . . parsed_2lxd 1
17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 41 ALA . . . . . . . . . . . . . parsed_2lxd 1
18 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 42 CYS . . . . . . . . . . . . . parsed_2lxd 1
19 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 44 LYS+ . . . . . . . . . . . . . parsed_2lxd 1
20 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 45 HIS . . . . . . . . . . . . . parsed_2lxd 1
21 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 47 SER . . . . . . . . . . . . . parsed_2lxd 1
22 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 48 VAL . . . . . . . . . . . . . parsed_2lxd 1
23 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 53 LEU . . . . . . . . . . . . . parsed_2lxd 1
24 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 54 LEU . . . . . . . . . . . . . parsed_2lxd 1
25 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 55 ILE . . . . . . . . . . . . . parsed_2lxd 1
26 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 57 SER . . . . . . . . . . . . . parsed_2lxd 1
27 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 58 ASP- . . . . . . . . . . . . . parsed_2lxd 1
28 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 60 VAL . . . . . . . . . . . . . parsed_2lxd 1
29 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 61 CYS . . . . . . . . . . . . . parsed_2lxd 1
30 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 63 GLN . . . . . . . . . . . . . parsed_2lxd 1
31 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 65 ILE . . . . . . . . . . . . . parsed_2lxd 1
32 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 66 TYR . . . . . . . . . . . . . parsed_2lxd 1
33 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 67 GLU- . . . . . . . . . . . . . parsed_2lxd 1
34 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 68 TRP . . . . . . . . . . . . . parsed_2lxd 1
35 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 70 LYS+ . . . . . . . . . . . . . parsed_2lxd 1
36 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 86 MET . . . . . . . . . . . . . parsed_2lxd 1
37 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 87 VAL . . . . . . . . . . . . . parsed_2lxd 1
38 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 88 VAL . . . . . . . . . . . . . parsed_2lxd 1
39 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 89 GLY . . . . . . . . . . . . . parsed_2lxd 1
40 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 90 GLU- . . . . . . . . . . . . . parsed_2lxd 1
41 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 92 THR . . . . . . . . . . . . . parsed_2lxd 1
42 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 93 LEU . . . . . . . . . . . . . parsed_2lxd 1
43 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65 40 . . 94 MET . . . . . . . . . . . . . parsed_2lxd 1
44 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 112 THR . . . . . . . . . . . . . parsed_2lxd 1
45 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 40 . . 120 ILE . . . . . . . . . . . . . parsed_2lxd 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 "Angle constraints created based on the HN-HA coupling constants." 1 1 1 65 parsed_2lxd 1
2 "32 TYR PHI -65 40" 12 1 12 18 parsed_2lxd 1
3 "40 ALA PHI -65 40" 19 1 19 18 parsed_2lxd 1
stop_
save_
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