This is an archive copy of the IUCr web site dating from 2008. For current content please visit
https://www.iucr.org.
Category chem_comp_tor
| Top | Dictionary | Category Groups | Categories | Items | Data |
Category Description
Data items in the CHEM_COMP_TOR category record details about
the torsion angles in a chemical component. As torsion angles
can have more than one target value, the target values are
specified in the CHEM_COMP_TOR_VALUE category.
Category Examples
Example 1:
Example 1 - based on PDB entry 5HVP and laboratory records for the
structure corresponding to PDB entry 5HVP
loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
phe phe_chi1 N CA CB CG
phe phe_chi2 CA CB CG CD1
phe phe_ring1 CB CG CD1 CE1
phe phe_ring2 CB CG CD2 CE2
phe phe_ring3 CG CD1 CE1 CZ
phe phe_ring4 CD1 CE1 CZ CE2
phe phe_ring5 CE1 CZ CE2 CD2
Key Category Items
Items in Category chem_comp_tor
| Top | Dictionary | Category Groups | Categories | Items | Data |
This HTML dictionary was created using the
CIFLIB C Language Application Program Interface
at the
Resource Collaboratory for Structural Bioinformatics
Rutgers University, Department of Chemistry
New Brunswick, New Jersey
help@rcsb.rutgers.edu