Hi Brian,

Perhaps a bug was introduced in 4.7.0?  Did this work with the older
version?  If you could put together a small repro dataset to play with I
can make sure to fix it in a future version.

Thanks!
-David


On Thu, Apr 10, 2014 at 10:06 AM, Brian Hampton <[email protected]>wrote:

> Hello,
>
> I have been using ASAPRatio from previous versions of the TPP
> successfully.  However, now I cannot obtain appropriate data for the ratios
> with the version present in 4.7.  ASAPRatio is not appropriately matching
> the corresponding heavy labeled peptide with its light partner.  It is
> choosing a peptide partner with a mass delta that doesn't make sense.
>
> I am labeling amines by reductive alkylation with acetone (D0 and D6).  I
> use Tandem for the search and specify the mods as per the API instructions
> where I specify static mod of 42@[ and 42@K and potential mods of 6@[ and
> 6@K.
>
> In ASAPRatio setup, I specify the following (via Petunia not the command
> line):
>
> xinteract -Ninteract.pep.xml -p0 -l5 -Op -dDECOY
> -A-lnK-b-r0.5-mn48.0846K176.1795
>
> Depending on the charge the mass delta between the light and heavy will be
> multiples of 6 for each labeled site, but I'm seeing multiples of 48
> instead and so the h/l pairs are not correct.
>
> I am not certain if this is a problem with ASAPRatio, is it a newer
> version than what was in 4.6, or if it has something to do with the output
> of Tandem.  If the former I can go and replace the new version of ASAPRatio
> with an older version and see if that fixes it.
>
> Any help much appreciated.
>
> Brian
>
>
>
> Brian Hampton
> Protein Analysis Lab
> Center for Vascular and Inflammatory Diseases
> University of Maryland School of Medicine
> 655 West Baltimore Street BRB 7-018
> Baltimore  MD  21201
> V: 410-706-8207
>
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