Hi Martin,
I've just tried to replicate the same procedure and when I select
export peaks file for Sparky, the first dialog box contains a box with
Sequence code start and a number in it. I have also, renumbered a
residue 0 to be Met and if I put zero in this box, I get the correct
numbering.
However, if I try to export another peaks file, this box does not
appear. This may indicate that once the choice is made, it persists.
If I close analysis, re-open and try to export again, I get the same
request to specify sequence code start.
Hope this helps,
Simon
On Aug 27, 2013, at 10:40 AM, Martin Ballaschk wrote:
> Hi all,
>
> I have a project which contains only one chain, and which I modified
> to begin with residue number 0 (a Met) in the Molecule dialog.
> Everything looks great while assigning and navigating inside
> Analysis 2.2.2, but after exporting the peak list to a Sparky file,
> all residues get remapped to 0 -> 1, 1 -> 2 and so on.
>
> See screen shot:
> https://dl.dropboxusercontent.com/u/4019316/Screenshot-1.png
>
> I believe to remember that Analysis asked in the past where the
> actual sequence starts (before I changed the first residue from
> default 1 to 0), but I could not find the respective popup to change
> it again.
>
> Does anyone know a solution?
>
> Best regards,
> Martin
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