Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
582985 | 2mfs RC | 19570 | cing | 2-parsed | STAR | dihedral angle | 68 |
data_2mfs_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2mfs
_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_2mfs 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2mfs
_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 2mfs "Master copy" parsed_2mfs
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2mfs
_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 2mfs.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2mfs 1
1 2mfs.mr . . XPLOR/CNS 2 distance NOE simple 347 parsed_2mfs 1
1 2mfs.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 30 parsed_2mfs 1
1 2mfs.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 68 parsed_2mfs 1
1 2mfs.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2mfs 1
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2mfs
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -90.0 . . 1 . C . 2 . N . 2 . CA . 2 . C parsed_2mfs 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -136.0 -58.4 . . 2 . C . 3 . N . 3 . CA . 3 . C parsed_2mfs 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 64.7 202.3 . . 3 . N . 3 . CA . 3 . C . 4 . N parsed_2mfs 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -153.4 -32.4 . . 5 . C . 6 . N . 6 . CA . 6 . C parsed_2mfs 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.7 177.7 . . 6 . N . 6 . CA . 6 . C . 7 . N parsed_2mfs 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.9 -86.9 . . 6 . C . 7 . N . 7 . CA . 7 . C parsed_2mfs 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.3 172.3 . . 7 . N . 7 . CA . 7 . C . 8 . N parsed_2mfs 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.8 -98.2 . . 7 . C . 8 . N . 8 . CA . 8 . C parsed_2mfs 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.9 175.9 . . 8 . N . 8 . CA . 8 . C . 9 . N parsed_2mfs 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.9 175.9 . . 9 . N . 9 . CA . 9 . C . 10 . N parsed_2mfs 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.8 -38.8 . . 9 . C . 10 . N . 10 . CA . 10 . C parsed_2mfs 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.0 -8.2 . . 10 . N . 10 . CA . 10 . C . 11 . N parsed_2mfs 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -91.1 -51.1 . . 10 . C . 11 . N . 11 . CA . 11 . C parsed_2mfs 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.5 15.7 . . 11 . N . 11 . CA . 11 . C . 12 . N parsed_2mfs 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.2 -57.8 . . 11 . C . 12 . N . 12 . CA . 12 . C parsed_2mfs 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.3 26.9 . . 12 . N . 12 . CA . 12 . C . 13 . N parsed_2mfs 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89.7 -49.7 . . 13 . C . 14 . N . 14 . CA . 14 . C parsed_2mfs 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 132.2 175.4 . . 14 . N . 14 . CA . 14 . C . 15 . N parsed_2mfs 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166.6 -68.4 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_2mfs 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.6 190.4 . . 15 . N . 15 . CA . 15 . C . 16 . N parsed_2mfs 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -20.0 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_2mfs 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -134.2 -53.8 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_2mfs 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 53.6 187.4 . . 17 . N . 17 . CA . 17 . C . 18 . N parsed_2mfs 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.1 -47.1 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_2mfs 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41.6 -1.6 . . 18 . N . 18 . CA . 18 . C . 19 . N parsed_2mfs 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166.4 -73.2 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_2mfs 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -186.2 -82.6 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_2mfs 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.1 196.9 . . 22 . N . 22 . CA . 22 . C . 23 . N parsed_2mfs 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -154.1 -52.7 . . 22 . C . 23 . N . 23 . CA . 23 . C parsed_2mfs 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.3 153.9 . . 23 . N . 23 . CA . 23 . C . 24 . N parsed_2mfs 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -147.5 -66.5 . . 23 . C . 24 . N . 24 . CA . 24 . C parsed_2mfs 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.7 155.3 . . 24 . N . 24 . CA . 24 . C . 25 . N parsed_2mfs 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98.3 -43.7 . . 24 . C . 25 . N . 25 . CA . 25 . C parsed_2mfs 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 121.9 175.3 . . 25 . N . 25 . CA . 25 . C . 26 . N parsed_2mfs 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.6 -47.6 . . 25 . C . 26 . N . 26 . CA . 26 . C parsed_2mfs 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 74.4 196.8 . . 26 . N . 26 . CA . 26 . C . 27 . N parsed_2mfs 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.2 5.0 . . 27 . N . 27 . CA . 27 . C . 28 . N parsed_2mfs 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -90.0 . . 27 . C . 28 . N . 28 . CA . 28 . C parsed_2mfs 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.4 -0.2 . . 28 . N . 28 . CA . 28 . C . 29 . N parsed_2mfs 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -106.3 -66.3 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_2mfs 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.2 0.2 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_2mfs 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -147.3 -107.3 . . 31 . C . 32 . N . 32 . CA . 32 . C parsed_2mfs 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 124.4 172.8 . . 32 . N . 32 . CA . 32 . C . 33 . N parsed_2mfs 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -189.2 -65.6 . . 33 . C . 34 . N . 34 . CA . 34 . C parsed_2mfs 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 126.9 172.5 . . 34 . N . 34 . CA . 34 . C . 35 . N parsed_2mfs 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 90.0 . . 1 . N . 1 . CA . 1 . CB . 1 . SG parsed_2mfs 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 210.0 . . 1 . N . 1 . CA . 1 . CB . 1 . SG parsed_2mfs 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -330.0 -30.0 . . 1 . N . 1 . CA . 1 . CB . 1 . SG parsed_2mfs 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 6 . N . 6 . CA . 6 . CB . 6 . CG parsed_2mfs 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 90.0 . . 7 . N . 7 . CA . 7 . CB . 7 . CG parsed_2mfs 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 210.0 . . 7 . N . 7 . CA . 7 . CB . 7 . CG parsed_2mfs 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -330.0 -30.0 . . 7 . N . 7 . CA . 7 . CB . 7 . CG parsed_2mfs 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 -150.0 . . 9 . N . 9 . CA . 9 . CB . 9 . CG parsed_2mfs 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 10 . N . 10 . CA . 10 . CB . 10 . CG parsed_2mfs 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 12 . N . 12 . CA . 12 . CB . 12 . CG parsed_2mfs 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 16 . N . 16 . CA . 16 . CB . 16 . SG parsed_2mfs 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 17 . N . 17 . CA . 17 . CB . 17 . SG parsed_2mfs 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 90.0 . . 18 . N . 18 . CA . 18 . CB . 18 . OG parsed_2mfs 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 210.0 . . 18 . N . 18 . CA . 18 . CB . 18 . OG parsed_2mfs 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -330.0 -30.0 . . 18 . N . 18 . CA . 18 . CB . 18 . OG parsed_2mfs 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 20 . N . 20 . CA . 20 . CB . 20 . CG parsed_2mfs 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 90.0 . . 28 . N . 28 . CA . 28 . CB . 28 . CG parsed_2mfs 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 210.0 . . 28 . N . 28 . CA . 28 . CB . 28 . CG parsed_2mfs 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -330.0 -30.0 . . 28 . N . 28 . CA . 28 . CB . 28 . CG parsed_2mfs 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 90.0 . . 29 . N . 29 . CA . 29 . CB . 29 . CG parsed_2mfs 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 210.0 . . 29 . N . 29 . CA . 29 . CB . 29 . CG parsed_2mfs 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -330.0 -30.0 . . 29 . N . 29 . CA . 29 . CB . 29 . CG parsed_2mfs 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 33 . N . 33 . CA . 33 . CB . 33 . SG parsed_2mfs 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 Backbone 1 1 1 10 parsed_2mfs 1
2
;
chi Angles
! CYS 1
;
93 1 95 16 parsed_2mfs 1
3 "! CYS 1" 98 3 98 16 parsed_2mfs 1
4 "! CYS 1" 101 3 101 16 parsed_2mfs 1
5 "! GLN 6" 104 2 104 15 parsed_2mfs 1
6 "! ARG 7" 107 3 107 16 parsed_2mfs 1
7 "! ARG 7" 110 3 110 16 parsed_2mfs 1
8 "! ARG 7" 113 3 113 16 parsed_2mfs 1
9 "! ASP 9" 116 2 116 14 parsed_2mfs 1
10 "! ASN 10" 119 2 119 17 parsed_2mfs 1
11 "! Arg 12" 122 2 122 15 parsed_2mfs 1
12 "! CYS 16" 125 3 125 17 parsed_2mfs 1
13 "! CYS 17" 128 3 128 17 parsed_2mfs 1
14 "! SER 18" 131 3 131 17 parsed_2mfs 1
15 "! SER 18" 134 3 134 17 parsed_2mfs 1
16 "! SER 18" 137 3 137 17 parsed_2mfs 1
17 "! GLN 20" 140 3 140 17 parsed_2mfs 1
18 "! PHE 28" 143 3 143 17 parsed_2mfs 1
19 "! PHE 28" 146 3 146 17 parsed_2mfs 1
20 "! PHE 28" 149 3 149 17 parsed_2mfs 1
21 "! LEU 29" 152 3 152 17 parsed_2mfs 1
22 "! LEU 29" 155 3 155 17 parsed_2mfs 1
23 "! LEU 29" 158 3 158 17 parsed_2mfs 1
24 "! CYS 33" 161 3 161 17 parsed_2mfs 1
stop_
save_