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wrong modification assignment in modifications_default.tsv #103

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AnnaLobas opened this issue Mar 4, 2019 · 1 comment
Open

wrong modification assignment in modifications_default.tsv #103

AnnaLobas opened this issue Mar 4, 2019 · 1 comment

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@AnnaLobas
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The N-terminal modification n[43] in TPP terms is actually acetylation not carbamylation. The chemical formula has to be changed correspondingly

@hroest
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hroest commented Mar 5, 2019

Acetylation is http://www.unimod.org/modifications_view.php?editid1=1 with a weight of 42 while Carbamyl has a weight of 43 http://www.unimod.org/modifications_view.php?editid1=5 - it is also my understanding that the tpp would write the first one as n[+42] or n[43] while the UniMod 5 would be n[+43] or n[44] if I understand the format correctly. See also here: OpenMS/OpenMS#3558

hroest added a commit that referenced this issue Mar 5, 2019
As indicated in #103
- I dont know what the ProteinPilot nomenclature would be for this
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