Hi Mike

Thanks for your fast answer! I am sorry I couldn't get back to you earlier.
I understand protein inference must be carried out prior to running 
StPeter. However, I still don't understand the Spectral Index (SI) 
definition from the original Griffin 
paper https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2805705/ . I would 
appreciate if you could shed some light.

The spectral index (SI) for a protein is the cumulative fragment ion 
> intensity for each spectrum of each peptide giving rise to a protein, which 
> can be represented using the equation from Griffin et al. where *i* is 
> the fragment ion intensity of peptide *k*, *j* is the *j*th spectral 
> count of *sc* total spectral counts for peptide *k* and *pn* is the 
> number of peptides identified for that protein


<https://lh3.googleusercontent.com/-fxXf4Vlx0m4/WxJHqr8AafI/AAAAAAAANwQ/uaPdP9JDycE4hCuE0amGXvJv_hYcLpUVACLcBGAs/s1600/SI.png>


I don't understand what's  the fragment ion intensity of peptide *k. *Please 
correct me if I am wrong here. Peptide *k* is a precursor ion and it has a 
single intensity (measured in MS1). After going through MS1, it fragments 
generating multiple fragment ions. So according to my understanding, 
there's a single precursor ion intensity and several fragment ion 
intensities for peptide *k*. Therefore, I don't comprehend what's *i* in 
the equation above.


I understand that *i* is summed over for all *sc *spectra identified as 
coming from peptide *k,* and then for all *pn* peptides coming from protein 
*K.* This total sum whould make protein's K SI.


Thanks for your help and time!! :)


Best


Antonio


onsdag den 23. maj 2018 kl. 01.05.15 UTC+2 skrev Michael Hoopmann:
>
> Hi Antonio,
> To use StPeter, you must perform peptide validation and protein inference 
> first. These are done, minimally, with the PeptideProphet and 
> ProteinProphet tools, respectively. They are needed because StPeter 
> quantifies proteins, not peptides, and thus you need to first perform 
> protein inference.
>
> We do have a tutorial for StPeter, sorry if our links don't line up 
> precisely from the launch location you started at. Updating the 
> documentation site is a work in progress. Try here: 
> http://tools.proteomecenter.org/wiki/index.php?title=Tutorial:StPeter1 
> <http://www.google.com/url?q=http%3A%2F%2Ftools.proteomecenter.org%2Fwiki%2Findex.php%3Ftitle%3DTutorial%3AStPeter1&sa=D&sntz=1&usg=AFQjCNEogKp8slamhq2lozPqyziMcnFZyA>
>   
> Unfortunately, it does assume using the GUI. StPeter (and the other TPP 
> tools) should all have command line usage statements if you simply type 
> them without parameters. But it is easiest to try solving your Apache2 
> problems.
>
> And regarding your last question, no, the precursor intensity is never 
> used as part of StPeter. The quantification is done entirely with spectral 
> indexes which utilize the intensity of fragment ions, not precursor ions.
>
> Cheers,
> Mike
>
> On Saturday, May 19, 2018 at 5:03:25 PM UTC-7, Antonio Ortega wrote:
>>
>> Hi all! My name is Antonio Ortega, and I am a Master student in 
>> Bioinfomatics at the University of Copenhagen, currently doing my Master 
>> Thesis on proteomics and mass spectrometry.
>>
>> I was wondering how can I use StPeter as a quantification tool if I pass 
>> as input the output of search engines like MSGF or Comet. I can see in the 
>> tutorial that Stpeter receives as input protXML files, however Comet 
>> produces pepXML output and MSGF produces mzid files that apparently can be 
>> converted to pepXML with idconvert
>>
>> https://groups.google.com/forum/#!topic/spctools-discuss/tbkcovbFxEc
>>
>> Why is the intermediate proXML file produced by PeptideProphet, iProphet 
>> and ProteinProphet needed? Is there any step by step tutorial on how to use 
>> these tools from the command line? The tutorial here 
>> http://tools.proteomecenter.org/wiki/index.php?title=TPP_Tutorial 
>> applies for people using the GUI Petunia, however, Apache2 gives me a 
>> forbidden access error when I try to access the TPP port., so  I cannot 
>> follow the instructions there.
>>
>> Regarding the method, the fragment ion intensity of the j spectrum of 
>> peptide k corresponds to the intensity of the precursor that generated 
>> spectrum j right? And this number can be found in .mgf spectrum files as 
>> the second number in the PEPMASS field right?
>> PEPMASS=XXXX YYY
>> being YYY equal to the intensity.
>>
>> Thank you very much for your help in advance and keep up the good work!
>>
>> Best regards
>>
>>
>> Antonio
>>  
>>
>

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