Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
458029 | 2kdp RC | 16127 | cing | 2-parsed | STAR | dihedral angle | 54 |
data_2kdp_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2kdp
_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_2kdp 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2kdp
_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 2kdp "Master copy" parsed_2kdp
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2kdp
_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 2kdp.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2kdp 1
1 2kdp.mr . . XPLOR/CNS 2 distance NOE ambi 1279 parsed_2kdp 1
1 2kdp.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 18 parsed_2kdp 1
1 2kdp.mr . . XPLOR/CNS 4 distance "general distance" simple 4 parsed_2kdp 1
1 2kdp.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 54 parsed_2kdp 1
1 2kdp.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2kdp 1
stop_
save_
save_CNS/XPLOR_dihedral_5
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2kdp
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 5
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -202.0 -34.0 . SAP 69 . C SAP 70 . N SAP 70 . CA SAP 70 . C parsed_2kdp 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -62.0 . SAP 70 . C SAP 71 . N SAP 71 . CA SAP 71 . C parsed_2kdp 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -168.0 -36.0 . SAP 73 . C SAP 74 . N SAP 74 . CA SAP 74 . C parsed_2kdp 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -158.0 -20.0 . SAP 74 . C SAP 75 . N SAP 75 . CA SAP 75 . C parsed_2kdp 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 -45.0 . SAP 86 . C SAP 87 . N SAP 87 . CA SAP 87 . C parsed_2kdp 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.0 -53.0 . SAP 87 . C SAP 88 . N SAP 88 . CA SAP 88 . C parsed_2kdp 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -41.0 . SAP 88 . C SAP 89 . N SAP 89 . CA SAP 89 . C parsed_2kdp 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -50.0 . SAP 89 . C SAP 90 . N SAP 90 . CA SAP 90 . C parsed_2kdp 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.0 -47.0 . SAP 90 . C SAP 91 . N SAP 91 . CA SAP 91 . C parsed_2kdp 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.0 -49.0 . SAP 91 . C SAP 92 . N SAP 92 . CA SAP 92 . C parsed_2kdp 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -42.0 . SAP 92 . C SAP 93 . N SAP 93 . CA SAP 93 . C parsed_2kdp 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -97.0 -31.0 . SAP 93 . C SAP 94 . N SAP 94 . CA SAP 94 . C parsed_2kdp 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.0 -45.0 . SAP 94 . C SAP 95 . N SAP 95 . CA SAP 95 . C parsed_2kdp 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.0 -63.0 . SAP 99 . C SAP 100 . N SAP 100 . CA SAP 100 . C parsed_2kdp 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -192.0 -90.0 . SAP 100 . C SAP 101 . N SAP 101 . CA SAP 101 . C parsed_2kdp 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -126.0 -48.0 . SAP 101 . C SAP 102 . N SAP 102 . CA SAP 102 . C parsed_2kdp 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.0 -49.0 . SAP 112 . C SAP 113 . N SAP 113 . CA SAP 113 . C parsed_2kdp 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -49.0 . SAP 113 . C SAP 114 . N SAP 114 . CA SAP 114 . C parsed_2kdp 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.0 -48.0 . SAP 114 . C SAP 115 . N SAP 115 . CA SAP 115 . C parsed_2kdp 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -43.0 . SAP 115 . C SAP 116 . N SAP 116 . CA SAP 116 . C parsed_2kdp 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.0 -48.0 . SAP 116 . C SAP 117 . N SAP 117 . CA SAP 117 . C parsed_2kdp 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.0 -48.0 . SAP 117 . C SAP 118 . N SAP 118 . CA SAP 118 . C parsed_2kdp 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -41.0 . SAP 118 . C SAP 119 . N SAP 119 . CA SAP 119 . C parsed_2kdp 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.0 -49.0 . SAP 119 . C SAP 120 . N SAP 120 . CA SAP 120 . C parsed_2kdp 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 91.0 193.0 . SAP 70 . N SAP 70 . CA SAP 70 . C SAP 71 . N parsed_2kdp 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 84.0 168.0 . SAP 71 . N SAP 71 . CA SAP 71 . C SAP 72 . N parsed_2kdp 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 88.0 172.0 . SAP 74 . N SAP 74 . CA SAP 74 . C SAP 75 . N parsed_2kdp 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 64.0 172.0 . SAP 75 . N SAP 75 . CA SAP 75 . C SAP 76 . N parsed_2kdp 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66.0 -6.0 . SAP 87 . N SAP 87 . CA SAP 87 . C SAP 88 . N parsed_2kdp 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.0 -17.0 . SAP 88 . N SAP 88 . CA SAP 88 . C SAP 89 . N parsed_2kdp 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.0 -24.0 . SAP 89 . N SAP 89 . CA SAP 89 . C SAP 90 . N parsed_2kdp 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.0 -27.0 . SAP 90 . N SAP 90 . CA SAP 90 . C SAP 91 . N parsed_2kdp 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 -18.0 . SAP 91 . N SAP 91 . CA SAP 91 . C SAP 92 . N parsed_2kdp 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -4.0 . SAP 92 . N SAP 92 . CA SAP 92 . C SAP 93 . N parsed_2kdp 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66.0 -12.0 . SAP 93 . N SAP 93 . CA SAP 93 . C SAP 94 . N parsed_2kdp 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66.0 -12.0 . SAP 94 . N SAP 94 . CA SAP 94 . C SAP 95 . N parsed_2kdp 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.0 7.0 . SAP 95 . N SAP 95 . CA SAP 95 . C SAP 96 . N parsed_2kdp 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 95.0 173.0 . SAP 100 . N SAP 100 . CA SAP 100 . C SAP 101 . N parsed_2kdp 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107.0 191.0 . SAP 101 . N SAP 101 . CA SAP 101 . C SAP 102 . N parsed_2kdp 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 92.0 170.0 . SAP 102 . N SAP 102 . CA SAP 102 . C SAP 103 . N parsed_2kdp 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.0 -15.0 . SAP 113 . N SAP 113 . CA SAP 113 . C SAP 114 . N parsed_2kdp 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.0 -25.0 . SAP 114 . N SAP 114 . CA SAP 114 . C SAP 115 . N parsed_2kdp 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.0 -12.0 . SAP 115 . N SAP 115 . CA SAP 115 . C SAP 116 . N parsed_2kdp 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.0 -29.0 . SAP 116 . N SAP 116 . CA SAP 116 . C SAP 117 . N parsed_2kdp 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.0 -20.0 . SAP 117 . N SAP 117 . CA SAP 117 . C SAP 118 . N parsed_2kdp 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.0 -15.0 . SAP 118 . N SAP 118 . CA SAP 118 . C SAP 119 . N parsed_2kdp 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.0 -26.0 . SAP 119 . N SAP 119 . CA SAP 119 . C SAP 120 . N parsed_2kdp 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66.0 -6.0 . SAP 120 . N SAP 120 . CA SAP 120 . C SAP 121 . N parsed_2kdp 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . SAP 89 . N SAP 89 . CA SAP 89 . CB SAP 89 . CG1 parsed_2kdp 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . SAP 98 . N SAP 98 . CA SAP 98 . CB SAP 98 . CG1 parsed_2kdp 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . SAP 100 . N SAP 100 . CA SAP 100 . CB SAP 100 . CG1 parsed_2kdp 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . SAP 111 . N SAP 111 . CA SAP 111 . CB SAP 111 . CG1 parsed_2kdp 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . SAP 119 . N SAP 119 . CA SAP 119 . CB SAP 119 . CG1 parsed_2kdp 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . SAP 122 . N SAP 122 . CA SAP 122 . CB SAP 122 . CG1 parsed_2kdp 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 "Phi and Psi restraints" 1 1 1 24 parsed_2kdp 1
2 "Chi1 restraints" 98 1 98 17 parsed_2kdp 1
stop_
save_