INTERNATIONAL TABLES

for CRYSTALLOGRAPHY

Volume G

Definition and Exchange of Crystallographic Data

Index

Protein Data Bank exchange dictionary (pdbx) version 1.017

_chem_comp_atom.charge

Name:
'_chem_comp_atom.charge'

Definition:

   The net integer charge assigned to this atom. This is the
   formal charge assignment normally found in chemical diagrams.

Examples:

1 for an ammonium nitrogen
-1 for a chloride ion

Type: int

Mandatory item: no


The permitted range is [-8, 8]

Enumeration default: 0

Category: chem_comp_atom