-
Notifications
You must be signed in to change notification settings - Fork 19
1. PRIDE Inspector feature list
-
Key Features:
1.1. Rapid loading of Peaks files: mzML, mgf, pkl, ms2, dta, apl, mzData, mzXML
1.2. Rapid loading of identification and quantitation files: PRIDE XML, mzIdentML, mzTab
1.3. Search, access and download PRIDE Archive ‘complete’ public experiments through web-services, with search capabilities for modifications, species, disease, tissue, etc
1.4. Distinct views on mass spectra, chromatograms, proteins, peptide-spectrum-matches, peptides, protein-groups, quantification and experiment details:
-
Visualize all spectra and chromatograms with their fragment annotations
- Automatic annotation of Fragment Ion information
-
Automatic annotation for spectra using MS/MS fragment ions (if ion assignments are not included) Support for various ion types, including co-eluting and immonium ions and amino acid annotation for different fragment ion series within a spectrum
- Filtering based on types of fragment ions and amino acid annotations
- Ability to show/hide mass differences for amino acid annotations
- Configurable fragment ion mass error tolerance for performing the amino acid annotations
- Visualization of Mass Table to see the differences between assigned ions and spectrum peaks
- Visualization of the delta mass at Fragment Ion level
- Save a spectrum or chromatogram as an image. Supported formats include SVG, PNG, JPEG, GIF and PDF file.
- Highlight peaks with m/z and intensity values in a spectrum.
- Export spectra data to mgf
- Show mass differences for selected peaks and annotated fragment ions, showing the sequence of the assigned peptide
- Automatic suggestion on possible amino acids and charges based on mass differences of the selected peaks
- Highlight peak with its m/z and intensity value
- Show categorized metadata for each spectrum or chromatogram and annotated precursor ions
- Batch loading for experiments containing large number of spectra
- Easy adjustment on the display size of spectra and chromatogram
- Show MS level and precursor details for each spectrum
-
Visualization of Quantitation Results by supporting study variables and abundances for Quantitation Experiments at protein and peptide levels
-
Visualize original information from PSM/Peptide/Protein search engines, scores, p-values, thresholds and annotations
- Show all protein identifications, together with the peptide-spectrum-matches and the spectra used for identification.
- Show general details about protein identifications (such as search engine, search database, search parameters, number of PSMs, number of unique peptides) from original data
- Automatic correction of poorly formatted protein accessions by using web services to retrieve protein names, protein status and protein sequences from different protein databases (for UniProt, UniParc, Ensembl)
- Show Protein sequence information for those files that contains sequences such as mzIdentML and mzTab
- Calculate the theoretical pI for both protein and peptide identifications
- Show the protein group for those files that contains Protein Group information
- Calculate delta m/z for each peptide (difference between the theoretical and the experimental m/z). Highlighting is also done according to the chosen threshold (4 Da)
- Show for each peptide the list of PSM with the corresponding information of protein modifications, scores, etc
- Hyperlink all valid protein accessions and protein modifications accessions.
- Possibility to filter by PSM ranks
-
Visualization of protein group information in tree tables from original files and also visualization of Protein Inference information using graph representation
-
Display short summary of key measurements on experiment quality like delta masses, protein modification annotations
1.5 Download additional protein details, such as the protein name and the most up-to-date protein sequence (for the following protein sequence databases: UniProt, UniParc, Ensembl).
1.6 Protein inference algorithm to those experiments without protein group information.
- Display Protein group information and the relation between protein-peptides-PSMs
- Select different topologies to visualize the protein group information
- Collapse and un-collapse peptide and PSMs information
- Highlight the differences between peptides and PSMs
- Filter the data by PSMs scores
- Compute the number of shared peptides and PSMs by protein
- Highlight the overlapping peptides and the protein groups
1.7 Ability to perform an initial data quality assessment using a statistical view with different charts for four different categories: all spectra, identified spectra, decoy identifications and target identifications.
1.8 User-friendly download facility for private PRIDE experiments (suitable for journal reviewers and editors)
1.9 Experiment Detail Related Features
- Display experiment details, including sample, protocol and instrument configurations. The overview tab is split in three different views: ‘Experiment General’, ‘Sample and Protocol’, and ‘Instrument and Processing’
- Information about the peptide/protein identification protocols: databases, software, search parameters, etc
- Possibility to export the peptide/protein identifications to mzTab files 1.10 Quantification Related Features
- Show the quantification method that has been used and the current study variables and abundances for each variable
- Show a summary of sample study variables and the abundances details for each quantification reagent
- Show quantification ratios for both proteins and peptides based on a selected for all the study variables or for abundances depending of the selection of (abundances or study variables)
- Possibility to multi-select peptide isoforms for the same Protein
- Display bar charts based on quantification ratios
- Map filtered proteins identifications to the Ensembl web Karyotype Viewer
- Save/Print the protein quantification data to a file 1.11 Summary Chart Related Features
- ‘Delta m/z’ distribution for all peptides, including all spectra, identified, non-identified, target and decoy identifications
- Histogram on number of peptides per protein identification (percentage of controversial identifications)
- Histogram on the distribution of missed tryptic cleavages for all peptides including all spectra, identified, non-identified, target and decoy identifications
- Average MS/MS spectrum (for all spectra, or filtering between identified and unidentified spectra)
- Histogram on the distribution of precursor ion charge for identified spectra including all spectra, identified, non-identified, target and decoy identifications
- Precursor ion masses distribution for all spectra including all spectra, identified, non-identified, target and decoy identifications. It is also possible to visualize a human, mouse and PRIDE reference curves
- Histogram on number of peaks per spectrum including all spectra, identified, non-identified, target and decoy identifications
- Histogram on peak intensity for all spectra (for all, or filtering between identified and unidentified spectra) including all spectra, identified, non-identified, target and decoy identifications
- Histogram on number of peaks per spectrum including all spectra, identified, non-identified, target and decoy identifications
- Distribution of Peptide per Ratio showing all the quantitation study variables and abundances
- Save/Print all charts as images
- Zoom in/out ability for all the charts
- Easy navigation between charts
-