There is also a clear problem with the way Tide has reported the
modification on the peptide in pepXML:


On Fri, Aug 7, 2015 at 11:51 AM, David Shteynberg <
[email protected]> wrote:

> Hi Han,
>
> It is possible the reported scores are not all that PeptideProphet expects
> in this type of pepXML file.  If you can post the file for download I can
> test the actual issue.
>
> Thanks,
> -David
>
> On Fri, Aug 7, 2015 at 11:02 AM, Han Hu <[email protected]> wrote:
>
>> Hi,
>>
>> I was trying to run PeptideProphet on Tide results and got following
>> results
>>
>> The data (interact.tide.pep.xml) looks like
>> <spectrum_query spectrum="20130510_EXQ1_IgPa_QC_UPS1_04.63208.63208.4"
>> start_scan="63208" end_scan="63208" precursor_neutral_mass="3949.8508"
>> assumed_charge="4" index="317452">
>> <search_result>
>> <search_hit hit_rank="1" peptide="LFMREMFEFWVYVFSLGICLVCGWWLFWGR"
>> peptide_prev_aa="K" peptide_next_aa="F" protein="sp|Q46867|YGIZ_ECOLI"
>> num_tot_proteins="1" num_matched_ions="1" tot_num_ions="174"
>> calc_neutral_pep_mass="3949.8796" massdiff="-0.0288" num_tol_term="2"
>> num_missed_cleavages="1" num_matched_peptides="2" is_rejected="0"
>> protein_descr="Inner membrane protein YgiZ OS=Escherichia coli (strain K12)
>> GN=ygiZ PE=1 SV=1">
>> <modification_info modified_peptide="LFM[16]REMFEFWVYVFSLGICLVCGWWLFWGR">
>> <mod_aminoacid_mass position="3" mass="15.99"/>
>> </modification_info>
>> <modification_info modified_peptide="LFMREMFEFWVYVFSLGICLVCGWWLFWGR">
>> <mod_aminoacid_mass position="19" mass="57.02"/>
>> <mod_aminoacid_mass position="22" mass="57.02"/>
>> </modification_info>
>> <search_score name="spscore" value="0.19079092"/>
>> <search_score name="sprank" value="1"/>
>> <search_score name="xcorr_score" value="0.20136720"/>
>> <search_score name="xcorr_rank" value="1"/>
>> <search_score name="deltacn" value="0.00247400"/>
>> </search_hit>
>> </search_result>
>> </spectrum_query>
>> <spectrum_query spectrum="20130510_EXQ1_IgPa_QC_UPS1_04.62879.62879.4"
>> start_scan="62879" end_scan="62879" precursor_neutral_mass="3949.8508"
>> assumed_charge="4" index="317453">
>> <search_result>
>> <search_hit hit_rank="1" peptide="LFMREMFEFWVYVFSLGICLVCGWWLFWGR"
>> peptide_prev_aa="K" peptide_next_aa="F" protein="sp|Q46867|YGIZ_ECOLI"
>> num_tot_proteins="1" num_matched_ions="0" tot_num_ions="174"
>> calc_neutral_pep_mass="3949.8796" massdiff="-0.0288" num_tol_term="2"
>> num_missed_cleavages="1" num_matched_peptides="2" is_rejected="0"
>> protein_descr="Inner membrane protein YgiZ OS=Escherichia coli (strain K12)
>> GN=ygiZ PE=1 SV=1">
>> <modification_info modified_peptide="LFMREM[16]FEFWVYVFSLGICLVCGWWLFWGR">
>> <mod_aminoacid_mass position="6" mass="15.99"/>
>> </modification_info>
>> <modification_info modified_peptide="LFMREMFEFWVYVFSLGICLVCGWWLFWGR">
>> <mod_aminoacid_mass position="19" mass="57.02"/>
>> <mod_aminoacid_mass position="22" mass="57.02"/>
>> </modification_info>
>> <search_score name="spscore" value="0.00000000"/>
>> <search_score name="sprank" value="1"/>
>> <search_score name="xcorr_score" value="0.09289770"/>
>> <search_score name="xcorr_rank" value="1"/>
>> <search_score name="deltacn" value="0.00039120"/>
>> </search_hit>
>> </search_result>
>> </spectrum_query>
>>
>> ---------------------------------------------------------------------------------------------------------------------------------------------------------------------
>> $ PeptideProphetParser interact.tide.pep.xml MINPROB=0 FORCEDISTR
>> Forcing output of mixture model
>>  (Crux) (minprob 0)
>> init with Crux trypsin
>> MS Instrument info: Manufacturer: NA, Model: NA, Ionization: NA,
>> Analyzer: UNKNOWN, Detector: UNKNOWN
>>
>>  PeptideProphet  (TPP v4.8.0 PHILAE, Build 201506081212-exported
>> (RedHatEnterpriseServer-x86_64)) AKeller@ISB
>>  read in 0 1+, 0 2+, 0 3+, 0 4+, 0 5+, 0 6+, and 0 7+ spectra.
>>  read in no data
>>
>> Does anyone know the reason? Is it because of the format, low score or
>> something else.
>>
>> Thanks a lot,
>>
>>
>> -Han
>>
>>
>>
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