X-Git-Url: http://source.jalview.org/gitweb/?p=jalview.git;a=blobdiff_plain;f=src%2Fjalview%2Fdatamodel%2Fxdb%2Fembl%2FEmblEntry.java;h=0ae49b998d1d27a1f8dac69e6eb10a4a476d4944;hp=f5dfef4c9f93339b91205db5ff67ccfe71b7ecd3;hb=HEAD;hpb=17e77c3f2949a0729322b4a8d907f3f34b6a9914 diff --git a/src/jalview/datamodel/xdb/embl/EmblEntry.java b/src/jalview/datamodel/xdb/embl/EmblEntry.java deleted file mode 100644 index f5dfef4..0000000 --- a/src/jalview/datamodel/xdb/embl/EmblEntry.java +++ /dev/null @@ -1,845 +0,0 @@ -/* - * Jalview - A Sequence Alignment Editor and Viewer (Version 2.9) - * Copyright (C) 2015 The Jalview Authors - * - * This file is part of Jalview. - * - * Jalview is free software: you can redistribute it and/or - * modify it under the terms of the GNU General Public License - * as published by the Free Software Foundation, either version 3 - * of the License, or (at your option) any later version. - * - * Jalview is distributed in the hope that it will be useful, but - * WITHOUT ANY WARRANTY; without even the implied warranty - * of MERCHANTABILITY or FITNESS FOR A PARTICULAR - * PURPOSE. See the GNU General Public License for more details. - * - * You should have received a copy of the GNU General Public License - * along with Jalview. If not, see . - * The Jalview Authors are detailed in the 'AUTHORS' file. - */ -package jalview.datamodel.xdb.embl; - -import jalview.datamodel.DBRefEntry; -import jalview.datamodel.DBRefSource; -import jalview.datamodel.FeatureProperties; -import jalview.datamodel.Mapping; -import jalview.datamodel.Sequence; -import jalview.datamodel.SequenceFeature; -import jalview.datamodel.SequenceI; - -import java.util.Hashtable; -import java.util.Map.Entry; -import java.util.Vector; - -/** - * Data model for one entry returned from an EMBL query, as marshalled by a - * Castor binding file - * - * For example: http://www.ebi.ac.uk/Tools/dbfetch/dbfetch/embl/x53828/emblxml - * - * @see embl_mapping.xml - */ -public class EmblEntry -{ - String accession; - - String version; - - String taxDivision; - - String desc; - - String rCreated; - - String rLastUpdated; - - String lastUpdated; - - Vector keywords; - - Vector dbRefs; - - Vector features; - - EmblSequence sequence; - - /** - * @return the accession - */ - public String getAccession() - { - return accession; - } - - /** - * @param accession - * the accession to set - */ - public void setAccession(String accession) - { - this.accession = accession; - } - - /** - * @return the dbRefs - */ - public Vector getDbRefs() - { - return dbRefs; - } - - /** - * @param dbRefs - * the dbRefs to set - */ - public void setDbRefs(Vector dbRefs) - { - this.dbRefs = dbRefs; - } - - /** - * @return the desc - */ - public String getDesc() - { - return desc; - } - - /** - * @param desc - * the desc to set - */ - public void setDesc(String desc) - { - this.desc = desc; - } - - /** - * @return the features - */ - public Vector getFeatures() - { - return features; - } - - /** - * @param features - * the features to set - */ - public void setFeatures(Vector features) - { - this.features = features; - } - - /** - * @return the keywords - */ - public Vector getKeywords() - { - return keywords; - } - - /** - * @param keywords - * the keywords to set - */ - public void setKeywords(Vector keywords) - { - this.keywords = keywords; - } - - /** - * @return the lastUpdated - */ - public String getLastUpdated() - { - return lastUpdated; - } - - /** - * @param lastUpdated - * the lastUpdated to set - */ - public void setLastUpdated(String lastUpdated) - { - this.lastUpdated = lastUpdated; - } - - /** - * @return the releaseCreated - */ - public String getRCreated() - { - return rCreated; - } - - /** - * @param releaseCreated - * the releaseCreated to set - */ - public void setRCreated(String releaseCreated) - { - this.rCreated = releaseCreated; - } - - /** - * @return the releaseLastUpdated - */ - public String getRLastUpdated() - { - return rLastUpdated; - } - - /** - * @param releaseLastUpdated - * the releaseLastUpdated to set - */ - public void setRLastUpdated(String releaseLastUpdated) - { - this.rLastUpdated = releaseLastUpdated; - } - - /** - * @return the sequence - */ - public EmblSequence getSequence() - { - return sequence; - } - - /** - * @param sequence - * the sequence to set - */ - public void setSequence(EmblSequence sequence) - { - this.sequence = sequence; - } - - /** - * @return the taxDivision - */ - public String getTaxDivision() - { - return taxDivision; - } - - /** - * @param taxDivision - * the taxDivision to set - */ - public void setTaxDivision(String taxDivision) - { - this.taxDivision = taxDivision; - } - - /** - * @return the version - */ - public String getVersion() - { - return version; - } - - /** - * @param version - * the version to set - */ - public void setVersion(String version) - { - this.version = version; - } - - /* - * EMBL Feature support is limited. The text below is included for the benefit - * of any developer working on improving EMBL feature import in Jalview. - * Extract from EMBL feature specification see - * http://www.embl-ebi.ac.uk/embl/Documentation - * /FT_definitions/feature_table.html 3.5 Location 3.5.1 Purpose - * - * The location indicates the region of the presented sequence which - * corresponds to a feature. - * - * 3.5.2 Format and conventions The location contains at least one sequence - * location descriptor and may contain one or more operators with one or more - * sequence location descriptors. Base numbers refer to the numbering in the - * entry. This numbering designates the first base (5' end) of the presented - * sequence as base 1. Base locations beyond the range of the presented - * sequence may not be used in location descriptors, the only exception being - * location in a remote entry (see 3.5.2.1, e). - * - * Location operators and descriptors are discussed in more detail below. - * - * 3.5.2.1 Location descriptors - * - * The location descriptor can be one of the following: (a) a single base - * number (b) a site between two indicated adjoining bases (c) a single base - * chosen from within a specified range of bases (not allowed for new entries) - * (d) the base numbers delimiting a sequence span (e) a remote entry - * identifier followed by a local location descriptor (i.e., a-d) - * - * A site between two adjoining nucleotides, such as endonucleolytic cleavage - * site, is indicated by listing the two points separated by a carat (^). The - * permitted formats for this descriptor are n^n+1 (for example 55^56), or, - * for circular molecules, n^1, where "n" is the full length of the molecule, - * ie 1000^1 for circular molecule with length 1000. - * - * A single base chosen from a range of bases is indicated by the first base - * number and the last base number of the range separated by a single period - * (e.g., '12.21' indicates a single base taken from between the indicated - * points). From October 2006 the usage of this descriptor is restricted : it - * is illegal to use "a single base from a range" (c) either on its own or in - * combination with the "sequence span" (d) descriptor for newly created - * entries. The existing entries where such descriptors exist are going to be - * retrofitted. - * - * Sequence spans are indicated by the starting base number and the ending - * base number separated by two periods (e.g., '34..456'). The '<' and '>' - * symbols may be used with the starting and ending base numbers to indicate - * that an end point is beyond the specified base number. The starting and - * ending base positions can be represented as distinct base numbers - * ('34..456') or a site between two indicated adjoining bases. - * - * A location in a remote entry (not the entry to which the feature table - * belongs) can be specified by giving the accession-number and sequence - * version of the remote entry, followed by a colon ":", followed by a - * location descriptor which applies to that entry's sequence (i.e. - * J12345.1:1..15, see also examples below) - * - * 3.5.2.2 Operators - * - * The location operator is a prefix that specifies what must be done to the - * indicated sequence to find or construct the location corresponding to the - * feature. A list of operators is given below with their definitions and most - * common format. - * - * complement(location) Find the complement of the presented sequence in the - * span specified by " location" (i.e., read the complement of the presented - * strand in its 5'-to-3' direction) - * - * join(location,location, ... location) The indicated elements should be - * joined (placed end-to-end) to form one contiguous sequence - * - * order(location,location, ... location) The elements can be found in the - * specified order (5' to 3' direction), but nothing is implied about the - * reasonableness about joining them - * - * Note : location operator "complement" can be used in combination with - * either " join" or "order" within the same location; combinations of "join" - * and "order" within the same location (nested operators) are illegal. - * - * - * - * 3.5.3 Location examples - * - * The following is a list of common location descriptors with their meanings: - * - * Location Description - * - * 467 Points to a single base in the presented sequence - * - * 340..565 Points to a continuous range of bases bounded by and including the - * starting and ending bases - * - * <345..500 Indicates that the exact lower boundary point of a feature is - * unknown. The location begins at some base previous to the first base - * specified (which need not be contained in the presented sequence) and - * continues to and includes the ending base - * - * <1..888 The feature starts before the first sequenced base and continues to - * and includes base 888 - * - * 1..>888 The feature starts at the first sequenced base and continues beyond - * base 888 - * - * 102.110 Indicates that the exact location is unknown but that it is one of - * the bases between bases 102 and 110, inclusive - * - * 123^124 Points to a site between bases 123 and 124 - * - * join(12..78,134..202) Regions 12 to 78 and 134 to 202 should be joined to - * form one contiguous sequence - * - * - * complement(34..126) Start at the base complementary to 126 and finish at - * the base complementary to base 34 (the feature is on the strand - * complementary to the presented strand) - * - * - * complement(join(2691..4571,4918..5163)) Joins regions 2691 to 4571 and 4918 - * to 5163, then complements the joined segments (the feature is on the strand - * complementary to the presented strand) - * - * join(complement(4918..5163),complement(2691..4571)) Complements regions - * 4918 to 5163 and 2691 to 4571, then joins the complemented segments (the - * feature is on the strand complementary to the presented strand) - * - * J00194.1:100..202 Points to bases 100 to 202, inclusive, in the entry (in - * this database) with primary accession number 'J00194' - * - * join(1..100,J00194.1:100..202) Joins region 1..100 of the existing entry - * with the region 100..202 of remote entry J00194 - */ - /** - * Recover annotated sequences from EMBL file - * - * @param noNa - * don't return nucleic acid sequences - * @param sourceDb - * TODO - * @param noProtein - * don't return any translated protein sequences marked in features - * @return dataset sequences with DBRefs and features - DNA always comes first - */ - public jalview.datamodel.SequenceI[] getSequences(boolean noNa, - boolean noPeptide, String sourceDb) - { // TODO: ensure emblEntry.getSequences behaves correctly for returning all - // cases of noNa and noPeptide - Vector seqs = new Vector(); - Sequence dna = null; - if (!noNa) - { - // In theory we still need to create this if noNa is set to avoid a null - // pointer exception - dna = new Sequence(sourceDb + "|" + accession, sequence.getSequence()); - dna.setDescription(desc); - DBRefEntry retrievedref = new DBRefEntry(sourceDb, version, accession); - dna.addDBRef(retrievedref); - // add map to indicate the sequence is a valid coordinate frame for the - // dbref - retrievedref.setMap(new Mapping(null, - new int[] { 1, dna.getLength() }, new int[] { 1, - dna.getLength() }, 1, 1)); - // TODO: transform EMBL Database refs to canonical form - if (dbRefs != null) - { - for (DBRefEntry dbref : dbRefs) - { - dna.addDBRef(dbref); - } - } - } - try - { - for (EmblFeature feature : features) - { - if (!noNa) - { - if (feature.dbRefs != null) - { - for (DBRefEntry dbref : feature.dbRefs) - { - dna.addDBRef(dbref); - } - } - } - if (FeatureProperties.isCodingFeature(sourceDb, feature.getName())) - { - parseCodingFeature(feature, sourceDb, seqs, dna, noPeptide); - } - else - { - // General feature type. - // TODO this is just duplicated code ?? - if (!noNa) - { - if (feature.dbRefs != null) - { - for (DBRefEntry dbref : feature.dbRefs) - { - dna.addDBRef(dbref); - } - } - } - } - } - } catch (Exception e) - { - System.err.println("EMBL Record Features parsing error!"); - System.err - .println("Please report the following to help@jalview.org :"); - System.err.println("EMBL Record " + accession); - System.err.println("Resulted in exception: " + e.getMessage()); - e.printStackTrace(System.err); - } - if (!noNa && dna != null) - { - seqs.add(dna); - } - SequenceI[] sqs = new SequenceI[seqs.size()]; - for (int i = 0, j = seqs.size(); i < j; i++) - { - sqs[i] = seqs.elementAt(i); - seqs.set(i, null); - } - return sqs; - } - - /** - * attempt to extract coding region and product from a feature and properly - * decorate it with annotations. - * - * @param feature - * coding feature - * @param sourceDb - * source database for the EMBLXML - * @param seqs - * place where sequences go - * @param dna - * parent dna sequence for this record - * @param noPeptide - * flag for generation of Peptide sequence objects - */ - private void parseCodingFeature(EmblFeature feature, String sourceDb, - Vector seqs, Sequence dna, boolean noPeptide) - { - boolean isEmblCdna = sourceDb.equals(DBRefSource.EMBLCDS); - // extract coding region(s) - jalview.datamodel.Mapping map = null; - int[] exon = null; - if (feature.locations != null) - { - for (EmblFeatureLocations loc : feature.locations) - { - int[] se = loc.getElementRanges(accession); - if (exon == null) - { - exon = se; - } - else - { - int[] t = new int[exon.length + se.length]; - System.arraycopy(exon, 0, t, 0, exon.length); - System.arraycopy(se, 0, t, exon.length, se.length); - exon = t; - } - } - } - String prseq = null; - String prname = new String(); - String prid = null; - Hashtable vals = new Hashtable(); - int prstart = 1; - // get qualifiers - if (feature.getQualifiers() != null) - { - for (Qualifier q : feature.getQualifiers()) - { - String qname = q.getName(); - if (qname.equals("translation")) - { - StringBuilder prsq = new StringBuilder(q.getValues()[0]); - int p = prsq.indexOf(" "); - while (p > -1) - { - prsq.deleteCharAt(p); - p = prsq.indexOf(" ", p); - } - prseq = prsq.toString(); - prsq = null; - - } - else if (qname.equals("protein_id")) - { - prid = q.getValues()[0]; - } - else if (qname.equals("codon_start")) - { - prstart = Integer.parseInt(q.getValues()[0]); - } - else if (qname.equals("product")) - { - prname = q.getValues()[0]; - } - else - { - // throw anything else into the additional properties hash - String[] s = q.getValues(); - StringBuilder sb = new StringBuilder(); - if (s != null) - { - for (int i = 0; i < s.length; i++) - { - sb.append(s[i]); - sb.append("\n"); - } - } - vals.put(qname, sb.toString()); - } - } - } - Sequence product = null; - DBRefEntry protEMBLCDS = null; - exon = adjustForPrStart(prstart, exon); - boolean noProteinDbref = true; - - if (prseq != null && prname != null && prid != null) - { - // extract proteins. - product = new Sequence(prid, prseq, 1, prseq.length()); - product.setDescription(((prname.length() == 0) ? "Protein Product from " - + sourceDb - : prname)); - if (!noPeptide) - { - // Protein is also added to vector of sequences returned - seqs.add(product); - } - // we have everything - create the mapping and perhaps the protein - // sequence - if (exon == null || exon.length == 0) - { - System.err - .println("Implementation Notice: EMBLCDS records not properly supported yet - Making up the CDNA region of this sequence... may be incorrect (" - + sourceDb + ":" + getAccession() + ")"); - if (prseq.length() * 3 == (1 - prstart + dna.getSequence().length)) - { - System.err - .println("Not allowing for additional stop codon at end of cDNA fragment... !"); - // this might occur for CDS sequences where no features are - // marked. - exon = new int[] { dna.getStart() + (prstart - 1), dna.getEnd() }; - map = new jalview.datamodel.Mapping(product, exon, new int[] { 1, - prseq.length() }, 3, 1); - } - if ((prseq.length() + 1) * 3 == (1 - prstart + dna.getSequence().length)) - { - System.err - .println("Allowing for additional stop codon at end of cDNA fragment... will probably cause an error in VAMSAs!"); - exon = new int[] { dna.getStart() + (prstart - 1), - dna.getEnd() - 3 }; - map = new jalview.datamodel.Mapping(product, exon, new int[] { 1, - prseq.length() }, 3, 1); - } - } - else - { - // Trim the exon mapping if necessary - the given product may only be a - // fragment of a larger protein. (EMBL:AY043181 is an example) - - if (isEmblCdna) - { - // TODO: Add a DbRef back to the parent EMBL sequence with the exon - // map - // if given a dataset reference, search dataset for parent EMBL - // sequence if it exists and set its map - // make a new feature annotating the coding contig - } - else - { - // final product length trunctation check - - map = new jalview.datamodel.Mapping(product, - adjustForProteinLength(prseq.length(), exon), new int[] { - 1, prseq.length() }, 3, 1); - // reconstruct the EMBLCDS entry - // TODO: this is only necessary when there codon annotation is - // complete (I think JBPNote) - DBRefEntry pcdnaref = new DBRefEntry(); - pcdnaref.setAccessionId(prid); - pcdnaref.setSource(DBRefSource.EMBLCDS); - pcdnaref.setVersion(getVersion()); // same as parent EMBL version. - jalview.util.MapList mp = new jalview.util.MapList(new int[] { 1, - prseq.length() }, new int[] { 1 + (prstart - 1), - (prstart - 1) + 3 * prseq.length() }, 1, 3); - // { 1 + (prstart - 1) * 3, - // 1 + (prstart - 1) * 3 + prseq.length() * 3 - 1 }, new int[] - // { 1prstart, prstart + prseq.length() - 1 }, 3, 1); - pcdnaref.setMap(new Mapping(mp)); - if (product != null) - { - product.addDBRef(pcdnaref); - protEMBLCDS = new DBRefEntry(pcdnaref); - protEMBLCDS.setSource(DBRefSource.EMBLCDSProduct); - product.addDBRef(protEMBLCDS); - - } - - } - } - // add cds feature to dna seq - this may include the stop codon - for (int xint = 0; exon != null && xint < exon.length; xint += 2) - { - SequenceFeature sf = new SequenceFeature(); - sf.setBegin(exon[xint]); - sf.setEnd(exon[xint + 1]); - sf.setType(feature.getName()); - sf.setFeatureGroup(sourceDb); - sf.setDescription("Exon " + (1 + xint / 2) + " for protein '" - + prname + "' EMBLCDS:" + prid); - sf.setValue(FeatureProperties.EXONPOS, new Integer(1 + xint)); - sf.setValue(FeatureProperties.EXONPRODUCT, prname); - if (vals != null) - { - for (Entry val : vals.entrySet()) - { - sf.setValue(val.getKey(), val.getValue()); - } - } - dna.addSequenceFeature(sf); - } - } - // add dbRefs to sequence - if (feature.dbRefs != null) - { - for (DBRefEntry ref : feature.dbRefs) - { - ref.setSource(jalview.util.DBRefUtils.getCanonicalName(ref - .getSource())); - // Hard code the kind of protein product accessions that EMBL cite - if (ref.getSource().equals(jalview.datamodel.DBRefSource.UNIPROT)) - { - ref.setMap(map); - if (map != null && map.getTo() != null) - { - map.getTo().addDBRef( - new DBRefEntry(ref.getSource(), ref.getVersion(), ref - .getAccessionId())); // don't copy map over. - if (map.getTo().getName().indexOf(prid) == 0) - { - map.getTo().setName( - jalview.datamodel.DBRefSource.UNIPROT + "|" - + ref.getAccessionId()); - } - } - noProteinDbref = false; - } - if (product != null) - { - DBRefEntry pref = new DBRefEntry(ref.getSource(), - ref.getVersion(), ref.getAccessionId()); - pref.setMap(null); // reference is direct - product.addDBRef(pref); - // Add converse mapping reference - if (map != null) - { - Mapping pmap = new Mapping(dna, map.getMap().getInverse()); - pref = new DBRefEntry(sourceDb, getVersion(), - this.getAccession()); - pref.setMap(pmap); - if (map.getTo() != null) - { - map.getTo().addDBRef(pref); - } - } - } - dna.addDBRef(ref); - } - if (noProteinDbref && product != null) - { - // add protein coding reference to dna sequence so xref matches - if (protEMBLCDS == null) - { - protEMBLCDS = new DBRefEntry(); - protEMBLCDS.setAccessionId(prid); - protEMBLCDS.setSource(DBRefSource.EMBLCDSProduct); - protEMBLCDS.setVersion(getVersion()); - protEMBLCDS - .setMap(new Mapping(product, map.getMap().getInverse())); - } - product.addDBRef(protEMBLCDS); - - // Add converse mapping reference - if (map != null) - { - Mapping pmap = new Mapping(product, protEMBLCDS.getMap().getMap() - .getInverse()); - DBRefEntry ncMap = new DBRefEntry(protEMBLCDS); - ncMap.setMap(pmap); - if (map.getTo() != null) - { - dna.addDBRef(ncMap); - } - } - } - } - } - - private int[] adjustForPrStart(int prstart, int[] exon) - { - - int origxon[], sxpos = -1; - int sxstart, sxstop; // unnecessary variables used for debugging - // first adjust range for codon start attribute - if (prstart > 1) - { - origxon = new int[exon.length]; - System.arraycopy(exon, 0, origxon, 0, exon.length); - int cdspos = 0; - for (int x = 0; x < exon.length && sxpos == -1; x += 2) - { - cdspos += exon[x + 1] - exon[x] + 1; - if (prstart <= cdspos) - { - sxpos = x; - sxstart = exon[x]; - sxstop = exon[x + 1]; - // and adjust start boundary of first exon. - exon[x] = exon[x + 1] - cdspos + prstart; - break; - } - } - - if (sxpos > 0) - { - int[] nxon = new int[exon.length - sxpos]; - System.arraycopy(exon, sxpos, nxon, 0, exon.length - sxpos); - exon = nxon; - } - } - return exon; - } - - /** - * truncate the last exon interval to the prlength'th codon - * - * @param prlength - * @param exon - * @return new exon - */ - private int[] adjustForProteinLength(int prlength, int[] exon) - { - - int origxon[], sxpos = -1, endxon = 0, cdslength = prlength * 3; - int sxstart, sxstop; // unnecessary variables used for debugging - // first adjust range for codon start attribute - if (prlength >= 1 && exon != null) - { - origxon = new int[exon.length]; - System.arraycopy(exon, 0, origxon, 0, exon.length); - int cdspos = 0; - for (int x = 0; x < exon.length && sxpos == -1; x += 2) - { - cdspos += exon[x + 1] - exon[x] + 1; - if (cdslength <= cdspos) - { - // advanced beyond last codon. - sxpos = x; - sxstart = exon[x]; - sxstop = exon[x + 1]; - if (cdslength != cdspos) - { - System.err - .println("Truncating final exon interval on region by " - + (cdspos - cdslength)); - } - // locate the new end boundary of final exon as endxon - endxon = exon[x + 1] - cdspos + cdslength; - break; - } - } - - if (sxpos != -1) - { - // and trim the exon interval set if necessary - int[] nxon = new int[sxpos + 2]; - System.arraycopy(exon, 0, nxon, 0, sxpos + 2); - nxon[sxpos + 1] = endxon; // update the end boundary for the new exon - // set - exon = nxon; - } - } - return exon; - } -}