PDBx/mmCIF
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Data Category nef_dihedral_restraint

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General

Category name
nef_dihedral_restraint
Required in PDB entries
no
Category group membership
nef_group
Used in current PDB entries
No

Category Relationship Diagrams

70
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Category Description 

 The data items in the NEF_DIHEDRAL_RESTRAINT category records the list of dihedral restraints.

Category Example

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   loop_
    _nef_dihedral_restraint.index
    _nef_dihedral_restraint.restraint_id
    _nef_dihedral_restraint.restraint_combination_id
    _nef_dihedral_restraint.chain_code_1
    _nef_dihedral_restraint.sequence_code_1
    _nef_dihedral_restraint.residue_name_1
    _nef_dihedral_restraint.atom_name_1
    _nef_dihedral_restraint.chain_code_2
    _nef_dihedral_restraint.sequence_code_2
    _nef_dihedral_restraint.residue_name_2
    _nef_dihedral_restraint.atom_name_2
    _nef_dihedral_restraint.chain_code_3
    _nef_dihedral_restraint.sequence_code_3
    _nef_dihedral_restraint.residue_name_3
    _nef_dihedral_restraint.atom_name_3
    _nef_dihedral_restraint.chain_code_4
    _nef_dihedral_restraint.sequence_code_4
    _nef_dihedral_restraint.residue_name_4
    _nef_dihedral_restraint.atom_name_4
    _nef_dihedral_restraint.weight
    _nef_dihedral_restraint.target_value
    _nef_dihedral_restraint.target_value_uncertainty
    _nef_dihedral_restraint.lower_linear_limit
    _nef_dihedral_restraint.lower_limit
    _nef_dihedral_restraint.upper_limit
    _nef_dihedral_restraint.upper_linear_limit
    _nef_dihedral_restraint.name

1  1  .  A 21 ALA N  A 21 ALA CA  A 21 ALA  C  A 22 THR N 1.00 -50.0 5.0 .  -60.0 -40.0  . PSI
2  1  .  A 21 ALA N  A 21 ALA CA  A 21 ALA  C  A 22 THR N 1.00 105.0 5.0 .   90.0 120.0  . PSI
3  2  .  A 12 ALA C  A 22 THR N   A 22 THR CA  A 22 THR C 3.00 -50.0 8.0 .  -60.0 -40.0  . PHI
4  3  1  A 23 LYS C  A 24 ASP N   A 24 ASP CA  A 24 ASP C 1.00 -50.0 5.0 .  -60.0 -40.0  . PHI
5  3  1  A 24 ASP N  A 24 ASP CA  A 24 ASP  C  A 25 HIS N 1.00 105.0 5.0 .   90.0 120.0  . PSI
6  4  2  A 15 GLY C  A 16 ASN N   A 16 ASN CA  A 16 ASN C 1.00 -50.0 5.0 .  -60.0 -40.0  . PHI
7  4  2  A 16 ASN N  A 16 ASN CA  A 16 ASN  C  A 17 CYS N 1.00 105.0 5.0 .   90.0 120.0  . PSI
8  4  3  A 15 GLY C  A 16 ASN N   A 16 ASN CA  A 16 ASN C 1.00 -80.0 5.0 .  -90.0 -70.0  . PHI
9  4  3  A 16 ASN N  A 16 ASN CA  A 16 ASN  C  A 17 CYS N 1.00 155.0 5.0 .  140.0 170.0  . PSI
stop_

Key Data Items

Category Data Items

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