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INTERNATIONAL TABLES for CRYSTALLOGRAPHY |
Volume G |
Definition and Exchange of Crystallographic Data |
Description:
Data items in the SYMMETRY_EQUIV category list the symmetry-equivalent positions for the space group.Example:
Example 1 - based on PDB entry 5HVP and laboratory records for the
structure corresponding to PDB entry 5HVP.
loop_
_symmetry_equiv.id
_symmetry_equiv.pos_as_xyz
1 '+x,+y,+z'
2 '-x,-y,z'
3 '1/2+x,1/2-y,-z'
4 '1/2-x,1/2+y,-z'
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Mandatory category: no
Copyright © 2005 International Union of Crystallography