Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
487336 | 2kpy RC | 16111 | cing | 2-parsed | STAR | dihedral angle | 58 |
data_2kpy_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2kpy
_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_2kpy 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2kpy
_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 2kpy "Master copy" parsed_2kpy
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2kpy
_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 2kpy.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2kpy 1
1 2kpy.mr . . DYANA/DIANA 2 distance NOE simple 1172 parsed_2kpy 1
1 2kpy.mr . . DYANA/DIANA 3 "dihedral angle" "Not applicable" "Not applicable" 58 parsed_2kpy 1
1 2kpy.mr . . XPLOR/CNS 4 unknown "Not applicable" "Not applicable" 0 parsed_2kpy 1
1 2kpy.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2kpy 1
stop_
save_
save_DYANA/DIANA_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2kpy
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 3
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -147.700 -84.480 . . 5 LEU . . . . . . . . . . . . . parsed_2kpy 1
2 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 121.210 151.270 . . 5 LEU . . . . . . . . . . . . . parsed_2kpy 1
3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -148.980 -121.280 . . 6 CYSS . . . . . . . . . . . . . parsed_2kpy 1
4 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 128.980 149.840 . . 6 CYSS . . . . . . . . . . . . . parsed_2kpy 1
5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.510 -113.730 . . 7 GLU . . . . . . . . . . . . . parsed_2kpy 1
6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.420 136.740 . . 7 GLU . . . . . . . . . . . . . parsed_2kpy 1
7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -148.630 -106.030 . . 8 LYS . . . . . . . . . . . . . parsed_2kpy 1
8 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 118.550 154.450 . . 8 LYS . . . . . . . . . . . . . parsed_2kpy 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.360 -54.560 . . 20 LYS . . . . . . . . . . . . . parsed_2kpy 1
10 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.820 -30.200 . . 20 LYS . . . . . . . . . . . . . parsed_2kpy 1
11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -91.060 -61.420 . . 21 LYS . . . . . . . . . . . . . parsed_2kpy 1
12 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41.960 -30.06 . . 21 LYS . . . . . . . . . . . . . parsed_2kpy 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.440 -54.000 . . 23 ASP . . . . . . . . . . . . . parsed_2kpy 1
14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.630 -27.95 . . 23 ASP . . . . . . . . . . . . . parsed_2kpy 1
15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.620 -56.280 . . 24 LYS . . . . . . . . . . . . . parsed_2kpy 1
16 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.770 -33.49 . . 24 LYS . . . . . . . . . . . . . parsed_2kpy 1
17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.170 -63.010 . . 25 LYS . . . . . . . . . . . . . parsed_2kpy 1
18 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41.750 -22.79 . . 25 LYS . . . . . . . . . . . . . parsed_2kpy 1
19 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -91.520 -51.360 . . 26 CYSS . . . . . . . . . . . . . parsed_2kpy 1
20 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.340 -11.14 . . 26 CYSS . . . . . . . . . . . . . parsed_2kpy 1
21 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.330 -56.410 . . 27 ILE . . . . . . . . . . . . . parsed_2kpy 1
22 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.990 -27.63 . . 27 ILE . . . . . . . . . . . . . parsed_2kpy 1
23 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.420 -58.440 . . 28 GLU . . . . . . . . . . . . . parsed_2kpy 1
24 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.400 -21.70 . . 28 GLU . . . . . . . . . . . . . parsed_2kpy 1
25 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96.810 -74.730 . . 29 TRP . . . . . . . . . . . . . parsed_2kpy 1
26 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41.420 -5.820 . . 29 TRP . . . . . . . . . . . . . parsed_2kpy 1
27 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.140 -71.040 . . 30 GLU . . . . . . . . . . . . . parsed_2kpy 1
28 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -18.800 22.220 . . 30 GLU . . . . . . . . . . . . . parsed_2kpy 1
29 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.100 -63.940 . . 33 GLN . . . . . . . . . . . . . parsed_2kpy 1
30 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -46.290 24.830 . . 33 GLN . . . . . . . . . . . . . parsed_2kpy 1
31 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.530 -97.590 . . 36 ALA . . . . . . . . . . . . . parsed_2kpy 1
32 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 139.150 162.030 . . 36 ALA . . . . . . . . . . . . . parsed_2kpy 1
33 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.420 -122.360 . . 37 CYSS . . . . . . . . . . . . . parsed_2kpy 1
34 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 138.690 164.750 . . 37 CYSS . . . . . . . . . . . . . parsed_2kpy 1
35 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -163.830 -130.250 . . 38 HIS . . . . . . . . . . . . . parsed_2kpy 1
36 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 126.330 157.810 . . 38 HIS . . . . . . . . . . . . . parsed_2kpy 1
37 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -131.770 -90.250 . . 39 LYS . . . . . . . . . . . . . parsed_2kpy 1
38 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.730 130.390 . . 39 LYS . . . . . . . . . . . . . parsed_2kpy 1
39 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -108.920 -61.920 . . 44 LYS . . . . . . . . . . . . . parsed_2kpy 1
40 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.170 147.890 . . 44 LYS . . . . . . . . . . . . . parsed_2kpy 1
41 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -117.500 -72.800 . . 45 GLU . . . . . . . . . . . . . parsed_2kpy 1
42 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 128.430 151.190 . . 45 GLU . . . . . . . . . . . . . parsed_2kpy 1
43 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -131.900 -93.440 . . 46 SER . . . . . . . . . . . . . parsed_2kpy 1
44 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 118.930 147.670 . . 46 SER . . . . . . . . . . . . . parsed_2kpy 1
45 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -143.400 -113.860 . . 47 CYSS . . . . . . . . . . . . . parsed_2kpy 1
46 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 118.420 136.120 . . 47 CYSS . . . . . . . . . . . . . parsed_2kpy 1
47 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.890 -91.610 . . 48 PHE . . . . . . . . . . . . . parsed_2kpy 1
48 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.340 161.800 . . 48 PHE . . . . . . . . . . . . . parsed_2kpy 1
49 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.570 -127.850 . . 49 CYSS . . . . . . . . . . . . . parsed_2kpy 1
50 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 148.830 168.670 . . 49 CYSS . . . . . . . . . . . . . parsed_2kpy 1
51 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -158.460 -101.560 . . 50 TYR . . . . . . . . . . . . . parsed_2kpy 1
52 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 137.090 160.370 . . 50 TYR . . . . . . . . . . . . . parsed_2kpy 1
53 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.910 -112.950 . . 51 PHE . . . . . . . . . . . . . parsed_2kpy 1
54 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 134.180 154.980 . . 51 PHE . . . . . . . . . . . . . parsed_2kpy 1
55 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.230 -68.730 . . 52 ASP . . . . . . . . . . . . . parsed_2kpy 1
56 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 121.410 137.810 . . 52 ASP . . . . . . . . . . . . . parsed_2kpy 1
57 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.550 -114.090 . . 53 CYSS . . . . . . . . . . . . . parsed_2kpy 1
58 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 153.850 185.070 . . 53 CYSS . . . . . . . . . . . . . parsed_2kpy 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 dihedrals 1 1 1 10 parsed_2kpy 1
stop_
save_