On Tue, Feb 18, 2014 at 8:19 AM, Jan van Agthoven <janc...@gmail.com> wrote:

> I'm filling out my table for NSMB, about a structure of protein ligand
> bound to a receptor. They ask for 3 different lines regarding number
> of atoms & bfactor. 1) Protein 2) Ligand/Ion 3) Water.
> Does my protein ligand belong to Protein or  Ligand/Ion?
>

Why not list them each explicitly?  In my experience the recommended table
of crystallography statistics for most journals is just a suggestion, not a
strict format.  If you leave out information they might complain, but
surely they won't object if you include additional details.  (They usually
just exile it to the unformatted supplementary materials anyway.)

-Nat

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