Introduction
This vignette gives an overview about requirements for
mpwR. The outputs of the following software
applications are supported:
- Spectronaut
 
- MaxQuant
 
- DIA-NN
 
- Proteome Discoverer
 
Spectronaut
The following columns are required:
- R.FileName
 
- PG.ProteinGroups
 
- PG.Quantity
 
- PEP.StrippedSequence
 
- PEP.NrOfMissedCleavages
 
- PEP.Quantity
 
- EG.Identified
 
- EG.ModifiedPeptide
 
- EG.PrecursorId
 
- EG.ApexRT
 
- FG.Charge
 
 
MaxQuant
The following files and respective columns are required:
- evidence.txt
- Raw file
 
- Proteins
 
- Sequence
 
- Missed cleavages
 
- Retention time
 
- Modified sequence
 
- Charge
 
- Protein group IDs
 
- Peptide ID
 
- Potential contaminant
 
- Reverse
 
- Intensity
 
 
- peptides.txt
- Sequence
 
- Missed cleavages
 
- Last amino acid
 
- Amino acid after
 
- Intensity column(s)
 
- LFQ intensity column(s)
 
- Protein group IDs
 
- Evidence IDs
 
- Potential contaminant
 
- Reverse
 
 
- proteinGroups.txt
- ProteinIDs
 
- Majority protein IDs
 
- Peptide counts (all)
 
- Intensity column(s)
 
- LFQ intensity column(s)
 
- id
 
- Peptide IDs
 
- Evidence IDs
 
- Potential contaminant
 
- Reverse
 
- Only identified by site
 
 
 
DIA-NN
The following columns are required:
- Protein.Group
 
- Precursor.Id
 
- Run
 
- Stripped.Sequence
 
- Protein.Ids
 
- Modified.Sequence
 
- PG.MaxLFQ
 
- Precursor.Charge
 
- RT
 
- Precursor.Id
 
- Precursor.Quantity
 
- PG.Q.Value
 
- Q.Value
 
 
Proteome Discoverer
Please enable R-friendly headers for exporting the files. The
following files and respective columns are required:
- PSMs.txt
- Confidence
 
- Spectrum File
 
- Number of Missed Cleavages
 
- Protein Accessions
 
- Annotated Sequence
 
- Modifications
 
- Charge
 
- RT in min
 
 
- PeptideGroups.txt
- Number of Protein Groups
 
- Number of Proteins
 
- Number of PSMs
 
- Confidence
 
- Sequence
 
- Modifications
 
- Number of Missed Cleavages
 
- Found in Sample column(s) (Required: Data Distributions node in the
consensus workflow; set Show Found in Samples parameter to True)
 
 
- Proteins.txt
- Proteins Unique Sequence ID
 
- Protein FDR Confidence Combined
 
- Accession
 
- Description
 
- Found in Sample column(s) (Required: Data Distributions node in the
consensus workflow; set Show Found in Samples parameter to True)
 
 
- ProteinGroups.txt
- Protein Groups Protein Group ID
 
- Group Description
 
- Number of Proteins
 
- Number of Unique Peptides
 
- Found in Sample column(s) (Required: Data Distributions node in the
consensus workflow; set Show Found in Samples parameter to True)