package jalview.datamodel; import jalview.io.gff.Gff3Helper; import jalview.schemes.ResidueProperties; import jalview.util.MappingUtils; import jalview.util.StringUtils; import java.util.HashSet; import java.util.List; import java.util.Set; /** * A data bean to hold a list of mapped sequence features (e.g. CDS features * mapped from protein), and the mapping between the sequences * * @author gmcarstairs */ public class MappedFeatures { private static final String HGV_SP = "HGVSp"; private static final String CSQ = "CSQ"; /* * the mapping from one sequence to another */ public final Mapping mapping; /** * the sequence mapped to */ public final SequenceI fromSeq; /* * the residue position in the sequence mapped from */ public final int fromPosition; /* * the residue at fromPosition */ public final char fromResidue; /* * features on the sequence mapped to that overlap the mapped positions */ public final List features; /* * if the mapping is 1:3 (peptide to CDS), this holds the * mapped positions i.e. codon base positions in CDS; to * support calculation of peptide variants from alleles */ public final int[] codonPos; private final char[] baseCodon; /** * Constructor * * @param theMapping * @param pos * @param res * @param theFeatures */ public MappedFeatures(Mapping theMapping, SequenceI from, int pos, char res, List theFeatures) { mapping = theMapping; fromSeq = from; fromPosition = pos; fromResidue = res; features = theFeatures; /* * determine codon positions and canonical codon * for a peptide-to-CDS mapping */ codonPos = MappingUtils.flattenRanges( mapping.getMap().locateInFrom(fromPosition, fromPosition)); if (codonPos.length == 3) { baseCodon = new char[3]; int cdsStart = fromSeq.getStart(); baseCodon[0] = fromSeq.getCharAt(codonPos[0] - cdsStart); baseCodon[1] = fromSeq.getCharAt(codonPos[1] - cdsStart); baseCodon[2] = fromSeq.getCharAt(codonPos[2] - cdsStart); } else { baseCodon = null; } } /** * Computes and returns comma-delimited HGVS notation peptide variants derived * from codon allele variants. If no variants are found, answers an empty * string. * * @return */ public String findProteinVariants(SequenceFeature sf) { if (!features.contains(sf) || baseCodon == null) { return ""; } StringBuilder vars = new StringBuilder(); /* * VCF data may already contain the protein consequence */ String hgvsp = sf.getValueAsString(CSQ, HGV_SP); if (hgvsp != null) { int colonPos = hgvsp.indexOf(':'); if (colonPos >= 0) { String var = hgvsp.substring(colonPos + 1); return var; } } /* * otherwise, compute codon and peptide variant */ // todo avoid duplication of code in AlignmentUtils.buildDnaVariantsMap int cdsPos = sf.getBegin(); if (cdsPos != sf.getEnd()) { // not handling multi-locus variant features return ""; } if (cdsPos != codonPos[0] && cdsPos != codonPos[1] && cdsPos != codonPos[2]) { // e.g. feature on intron within spliced codon! return ""; } String alls = (String) sf.getValue(Gff3Helper.ALLELES); if (alls == null) { return ""; } String from3 = StringUtils.toSentenceCase( ResidueProperties.aa2Triplet.get(String.valueOf(fromResidue))); /* * make a peptide variant for each SNP allele * e.g. C,G,T gives variants G and T for base C */ Set variantPeptides = new HashSet<>(); String[] alleles = alls.toUpperCase().split(","); for (String allele : alleles) { allele = allele.trim().toUpperCase(); if (allele.length() > 1 || "-".equals(allele)) { continue; // multi-locus variant } char[] variantCodon = new char[3]; variantCodon[0] = baseCodon[0]; variantCodon[1] = baseCodon[1]; variantCodon[2] = baseCodon[2]; /* * poke variant base into canonical codon */ int i = cdsPos == codonPos[0] ? 0 : (cdsPos == codonPos[1] ? 1 : 2); variantCodon[i] = allele.toUpperCase().charAt(0); String codon = new String(variantCodon); String peptide = ResidueProperties.codonTranslate(codon); if (fromResidue != peptide.charAt(0)) { String to3 = ResidueProperties.STOP.equals(peptide) ? "STOP" : StringUtils.toSentenceCase( ResidueProperties.aa2Triplet.get(peptide)); String var = "p." + from3 + fromPosition + to3; if (!variantPeptides.contains(peptide)) // duplicate consequence { variantPeptides.add(peptide); if (vars.length() > 0) { vars.append(","); } vars.append(var); } } } return vars.toString(); } }