NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
|
|
35328 |
1lb7   |
cing | 2-parsed | STAR | dihedral angle | 26 |
data_1lb7_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1lb7
_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_1lb7 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1lb7
_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 1lb7 "Master copy" parsed_1lb7
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1lb7
_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 1lb7.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1lb7 1
1 1lb7.mr . . DISCOVER 2 stereochemistry chirality "Not applicable" 0 parsed_1lb7 1
1 1lb7.mr . . DISCOVER 3 stereochemistry prochirality "Not applicable" 0 parsed_1lb7 1
1 1lb7.mr . . DISCOVER 4 distance NOE simple 73 parsed_1lb7 1
1 1lb7.mr . . DISCOVER 5 distance NOE simple 25 parsed_1lb7 1
1 1lb7.mr . . DISCOVER 6 "dihedral angle" "Not applicable" "Not applicable" 26 parsed_1lb7 1
1 1lb7.mr . . DISCOVER 7 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1lb7 1
1 1lb7.mr . . "MR format" 8 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1lb7 1
stop_
save_
save_Discover_dihedral_6
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1lb7
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 6
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -179.0 -1.0 . 1 1 AR+N C 1 2 ASN N 1 2 ASN CA 1 2 ASN C parsed_1lb7 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . 1 2 ASN C 1 3 CYS N 1 3 CYS CA 1 3 CYS C parsed_1lb7 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -90.0 . 1 3 CYS C 1 4 PHE N 1 4 PHE CA 1 4 PHE C parsed_1lb7 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -179.0 -1.0 . 1 4 PHE C 1 5 GLU N 1 5 GLU CA 1 5 GLU C parsed_1lb7 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -179.0 -1.0 . 1 5 GLU C 1 6 SER N 1 6 SER CA 1 6 SER C parsed_1lb7 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.0 -28.0 . 1 6 SER C 1 7 VAL N 1 7 VAL CA 1 7 VAL C parsed_1lb7 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.0 7.0 . 1 7 VAL N 1 7 VAL CA 1 7 VAL C 1 8 ALA N parsed_1lb7 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . 1 7 VAL C 1 8 ALA N 1 8 ALA CA 1 8 ALA C parsed_1lb7 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 0.0 . 1 8 ALA N 1 8 ALA CA 1 8 ALA C 1 9 ALA N parsed_1lb7 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . 1 8 ALA C 1 9 ALA N 1 9 ALA CA 1 9 ALA C parsed_1lb7 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.0 -4.0 . 1 9 ALA N 1 9 ALA CA 1 9 ALA C 1 10 LEU N parsed_1lb7 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . 1 9 ALA C 1 10 LEU N 1 10 LEU CA 1 10 LEU C parsed_1lb7 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.0 2.0 . 1 10 LEU N 1 10 LEU CA 1 10 LEU C 1 11 ARG N parsed_1lb7 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . 1 10 LEU C 1 11 ARG N 1 11 ARG CA 1 11 ARG C parsed_1lb7 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.0 8.0 . 1 11 ARG N 1 11 ARG CA 1 11 ARG C 1 12 ARG N parsed_1lb7 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -35.0 . 1 11 ARG C 1 12 ARG N 1 12 ARG CA 1 12 ARG C parsed_1lb7 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . 1 12 ARG N 1 12 ARG CA 1 12 ARG C 1 13 CYS N parsed_1lb7 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.0 -33.0 . 1 12 ARG C 1 13 CYS N 1 13 CYS CA 1 13 CYS C parsed_1lb7 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.0 1.0 . 1 13 CYS N 1 13 CYS CA 1 13 CYS C 1 14 MET N parsed_1lb7 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98.0 -38.0 . 1 13 CYS C 1 14 MET N 1 14 MET CA 1 14 MET C parsed_1lb7 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68.0 12.0 . 1 14 MET N 1 14 MET CA 1 14 MET C 1 15 TYR N parsed_1lb7 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -60.0 . 1 14 MET C 1 15 TYR N 1 15 TYR CA 1 15 TYR C parsed_1lb7 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . 1 3 CYS N 1 3 CYS CA 1 3 CYS CB 1 3 CYS SG parsed_1lb7 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . 1 4 PHE N 1 4 PHE CA 1 4 PHE CB 1 4 PHE CG parsed_1lb7 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . 1 6 SER N 1 6 SER CA 1 6 SER CB 1 6 SER OG parsed_1lb7 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -30.0 . 1 13 CYS N 1 13 CYS CA 1 13 CYS CB 1 13 CYS SG parsed_1lb7 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 NMR_dihedral 1 1 1 13 parsed_1lb7 1
stop_
save_
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