50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
131
132
133
134
135
136
137
138
139
140
141
142
143
144
145
146
147
148
149
150
151
152
153
154
155
156
157
158
159
160
161
162
163
164
165
166
167
168
169
170
171
172
173
174
175
176
177
178
179
180
181
182
183
184
185
186
187
188
189
190
191
192
193
194
195
196
197
198
199
200
201
202
203
204
205
206
207
208
209
210
211
212
213
214
215
216
217
218
219
220
221
222
223
224
225
226
227
228
229
230
231
232
233
234
235
236
237
238
239
240
241
242
243
244
245
246
247
248
249
250
251
252
253
254
255
256
257
258
259
260
261
262
263
264
265
266
267
268
269
270
271
272
273
274
275
276
277
278
279
280
281
282
283
284
285
286
287
288
289
290
291
292
293
294
295
296
297
298
299
300
301
302
303
304
305
306
307
308
309
310
311
312
313
314
315
316
317
318
319
320
321
322
323
324
325
326
327
328
329
330
331
332
333
334
335
336
337
338
339
340
341
342
343
344
345
346
347
348
349
350
351
352
353
354
355
356
357
358
359
360
361
362
363
364
365
366
367
368
369
370
371
372
373
374
375
376
377
378
379
380
381
382
383
384
385
386
387
388
389
390
391
392
393
394
395
396
397
398
399
400
401
402
403
404
405
406
407
408
409
410
411
412
413
414
415
416
417
418
419
420
421
422
423
424
425
426
427
428
429
430
431
432
433
434
435
436
437
438
439
440
441
442
443
444
445
446
447
448
449
450
451
452
453
454
455
456
457
458
459
460 | class compare_fasta(eHive.BaseRunnable):
def param_defaults(self):
return {}
def run(self) -> None:
report = self.param_required("report")
fasta1 = self.param_required("fasta1")
fasta2 = self.param_required("fasta2")
map_dna_path = self.param_required("seq_regions")
output_dir = self.param_required("output_dir")
species = self.param_required("species")
name = self.param_required("comparison_name")
accession = self.param_required("accession")
map_dna = self.get_map(map_dna_path)
seq1 = self.get_fasta(fasta1, map_dna)
seq2 = self.get_fasta(fasta2, map_dna)
(stats, diffs, seq_map) = self.compare_seqs(seq1, seq2)
# Print mapping to a file (add report data)
map_file = output_dir + "/" + species + "_" + name + ".map"
self.print_map(seq_map, map_file, report, accession)
# Print full list of results in a file
output_file = output_dir + "/" + species + "_" + name + ".log"
print(f"Write results in {output_file}")
with open(output_file, "w") as out_fh:
for line in diffs:
out_fh.write(line + "\n")
# Print the stats separately
out = {"species": species, "stats": stats}
self.dataflow(out, 2)
def print_map(self, seq_map: dict, map_file: str, report_file: str, accession: str) -> None:
report_parser = SeqregionParser()
report_seq = report_parser.get_report_regions(report_file, accession)
report = self.add_report_to_map(seq_map, report_seq)
print(f"Write map in {map_file}")
with open(map_file, "w") as out_fh:
out_fh.write(json.dumps(report, sort_keys=True, indent=4))
def add_report_to_map(self, seq_map: dict, report_seq: dict) -> List[Any]:
accession_version = r"\.\d+$"
report = []
for insdc_name, old_name in seq_map.items():
if insdc_name not in report_seq:
raise Exception("No INSDC %s found in report" % insdc_name)
else:
seqr = report_seq[insdc_name]
seqr["name"] = old_name
seqr["EBI_seq_region_name"] = old_name
brc4_name = insdc_name
brc4_name = re.sub(accession_version, "", brc4_name)
seqr["BRC4_seq_region_name"] = brc4_name
syns = [{"source": "INSDC", "name": insdc_name}]
seqr["synonyms"] = syns
report.append(seqr)
return report
def get_map(self, map_path: str) -> dict:
print(f"Read file {map_path}")
data = self.get_json(map_path)
map_dna = {}
for seqr in data:
name = seqr["name"]
if "synonyms" in seqr:
for syn in seqr["synonyms"]:
if syn["name"] == "INSDC":
map_dna[name] = syn["value"]
return map_dna
def get_json(self, json_path: str) -> dict:
with open(json_path) as json_file:
return json.load(json_file)
def build_seq_dict(self, seqs: dict) -> dict:
"""Build a seq dict taking duplicates into account"""
seqs_dict = dict()
for name, seq in seqs.items():
if seq in seqs_dict:
seqs_dict[seq].add_id(name)
else:
seqs_dict[seq] = SeqGroup(seq, name)
return seqs_dict
def get_fasta(self, fasta_path: str, map_dna: dict) -> dict:
print(f"Read file {fasta_path}")
sequences = {}
with open_gz_file(fasta_path) as fasta_fh:
for rec in SeqIO.parse(fasta_fh, "fasta"):
name = rec.id
if name in map_dna:
name = map_dna[name]
sequences[name] = re.sub(r"[^CGTA]", "N", str(rec.seq.upper()))
return sequences
def compare_seqs(self, seq1: dict, seq2: dict) -> Tuple[dict, list, dict]:
comp = []
accession = self.param_required("accession")
diff = abs(len(seq1) - len(seq2))
stats = {
"accession": accession,
"seq_count_1": len(seq1),
"seq_count_2": len(seq2),
"num_diff_seq": diff,
"common": 0,
"only1": 0,
"only2": 0,
"max_only1": 0,
"max_only2": 0,
"only1_200": 0,
"only1_1000": 0,
"only2_200": 0,
"only2_1000": 0,
"other_locations": 0,
"summary": None,
"organellar_summary": None,
"Assembly_level_1": None,
"Assembly_level_2": None,
}
value = "identical" # variable used for summary
org_value = "no_organelles_present" # variable used for organellar_summary
# Compare sequences
seqs1 = self.build_seq_dict(seq1)
seqs2 = self.build_seq_dict(seq2)
# Compare number of sequences
if len(seq1) != len(seq2):
comp.append(f"WARNING: Different number of sequences: {len(seq1)} vs {len(seq2)}")
else:
comp.append(f"Same number of sequences: {len(seq1)}")
# Sequences that are not common
only1 = {seq: group for seq, group in seqs1.items() if not seq in seqs2}
only2 = {seq: group for seq, group in seqs2.items() if not seq in seqs1}
common, group_comp = self.find_common_groups(seqs1, seqs2)
comp += group_comp
if only1 or only2:
value = "mismatch"
# Gathering the organellar sequences
report = self.param_required("report")
report_parser = SeqregionParser()
report_seq = report_parser.get_report_regions(report, accession)
map_dna_path = self.param_required("seq_regions")
seq_data = self.get_json(map_dna_path)
org_loc = self.organellar_assembly(report_seq, seq_data)
INSDC_assembly_level, core_assembly_level = self.assembly_level(report_seq, seq_data)
comp.append(f"Assembly level: {INSDC_assembly_level} vs {core_assembly_level}")
names_length = {}
# sequences which have extra N at the end
if only1 and only2:
for seq_1, name1 in only1.items():
len1 = len(seq_1)
seq1_N = seq_1.count("N")
for seq_2, name2 in only2.items():
len2 = len(seq_2)
seq2_N = seq_2.count("N")
sequence_2 = seq_2[:len1]
if sequence_2 == seq_1:
ignored_seq = seq_2[len1:]
N = ignored_seq.count("N")
if len(ignored_seq) == N:
comp.append(f"Please check extra Ns added in core in {name1} and {name2}")
else:
comp.append(
f"ALERT INSERTIONS at the end or diff assembly level {name1} and {name2}"
)
elif len1 == len2:
if seq2_N > seq1_N:
comp.append(f"Core has more Ns, check {name1} and {name2}")
elif seq1_N > seq2_N:
comp.append(f"INSDC has more Ns, check {name1} and {name2}")
else:
names_length[name1] = name2
else:
continue
if names_length:
length = len(names_length)
comp.append(f"{length} sequences have the same length")
for insdc, core in names_length.items():
comp.append(f"INSDC: {insdc} and coredb : {core}")
# Remove the duplicates
for org_name in list(org_loc.keys()):
for insdc_id, core_id in common.items():
if org_name == core_id:
org_loc.pop(org_name)
# checking for multiple entries of organellar seq
multi_org = [name.split(".")[0] for name in org_loc.keys()]
multi_org_acc = [j[:-1] for j in multi_org] # similar accession
unique_org_id = list(set(multi_org_acc))
location = [location for location in org_loc.values()]
unique_location = location.count("mitochondrial_chromosome")
unique_apicoplast = location.count("apicoplast_chromosome")
only1_id = [str(id1) for id1 in only1.values()]
# comparing organellar sequences with common, only1 and only2
count = 0
for org_name, loc in org_loc.items():
if org_name == "na":
comp.append("MISSING accession in the report (na)")
else:
if org_name in common.keys():
count = count + 1
comp.append(f"{org_name} (both) in location: {loc}")
if count > 0:
org_value = "identical"
elif org_name in only1_id:
count = count + 1
comp.append(f"{org_name} (only1) in location: {loc}")
org_value = "unknown_with_organellar"
else:
count = count + 1
comp.append(f"{org_name} (only2) in location: {loc}")
org_value = "unknown_with_organellar"
# if the mistmatch is due to added organellar sequences
if len(seqs1) > len(seqs2):
greater_len = len(seq1)
else:
greater_len = len(seq2)
diff_common = greater_len - len(common)
diff = abs(len(only1) + len(only2))
if diff != 0:
if diff == count and diff_common == count:
org_value = "organellar_present"
if count == 0:
org_value = "no_organelles_present"
# checking if multiple entries of organellar sequences are present
if len(multi_org_acc) != len(unique_org_id):
if unique_location > 1 or unique_apicoplast > 1:
org_value = "WARNING:Multiple_entry"
# updating the stats
stats["num_diff_seq"] = diff
stats["common"] = len(common)
stats["only1"] = len(only1)
stats["only2"] = len(only2)
stats["other_locations"] = count
stats["summary"] = value
stats["organellar_summary"] = org_value
stats["Assembly_level_1"] = INSDC_assembly_level
stats["Assembly_level_2"] = core_assembly_level
print(stats)
if only1:
stats["max_only1"] = len(max(only1, key=lambda k: len(k)))
# Only list sequences where the length is > 200
mini = {seq: name for seq, name in only1.items() if len(seq) <= 200}
maxi = {seq: name for seq, name in only1.items() if len(seq) > 200}
if mini and len(mini) > 3000:
comp.append(f"WARNING: Ignoring {len(mini)} sequences from 1 with length <= 200")
only1 = maxi
if only1:
# Only list sequences where the length is > 1000
mini = {seq: name for seq, name in only1.items() if len(seq) <= 1000}
maxi = {seq: name for seq, name in only1.items() if len(seq) > 1000}
if mini and len(mini) > 3000:
comp.append(f"WARNING: Ignoring {len(mini)} sequences from 1 with length <= 1000")
only1 = maxi
if only1:
total = sum([len(seq) for seq in only1.keys()])
comp.append(f"WARNING: Sequences only in 1: {len(only1)} ({total})")
only_seq1 = {name: len(seq) for seq, name in only1.items()}
for name, length in sorted(only_seq1.items(), key=lambda x: x[1]):
comp.append(f"\tOnly in 1: {name} ({length})")
if only2:
stats["max_only2"] = len(max(only2, key=lambda k: len(k)))
# Only list sequences where the length is > 200
mini = {seq: name for seq, name in only2.items() if len(seq) <= 200}
maxi = {seq: name for seq, name in only2.items() if len(seq) > 200}
if mini and len(mini) > 3000:
comp.append(f"WARNING: Ignoring {len(mini)} sequences from 2 with length <= 200")
only2 = maxi
if only2:
# Only list sequences where the length is > 1000
mini = {seq: name for seq, name in only2.items() if len(seq) <= 1000}
maxi = {seq: name for seq, name in only2.items() if len(seq) > 1000}
if mini and len(mini) > 3000:
comp.append(f"WARNING: Ignoring {len(mini)} sequences from 2 with length <= 1000")
only2 = maxi
if only2:
total = sum([len(seq) for seq in only2.keys()])
comp.append(f"WARNING: Sequences only in 2: {len(only2)} ({total})")
only_seq2 = {name: len(seq) for seq, name in only2.items()}
for name, length in sorted(only_seq2.items(), key=lambda x: x[1]):
comp.append(f"\tOnly in 2: {name} ({length})")
return (stats, comp, common)
def find_common_groups(self, seqs1: dict, seqs2: dict) -> Tuple[dict, List[Any]]:
print(len(seqs1))
print(len(seqs2))
comp = []
common = {}
for seq1, group1 in seqs1.items():
if seq1 in seqs2:
group2 = seqs2[seq1]
# Check that the 2 groups have the same number of sequences
if group1.count == group2.count:
if group1.count == 1:
common[group1.ids[0]] = group2.ids[0]
else:
comp.append(f"Matched 2 identical groups of sequences: {group1} and {group2}")
possible_id2 = " OR ".join(group2.ids)
for id1 in group1.ids:
common[id1] = possible_id2
else:
comp.append(
f"Matched 2 different groups of sequences ({group1.count} vs {group2.count}): {group1} and {group2}"
)
print(len(common))
return common, comp
def organellar_assembly(self, report_seq: dict, data: List[dict]) -> dict:
org_loc = {}
# Gathering data from the INSDC report file and storing it into a list
for name1, details1 in report_seq.items():
if "location" in details1:
if details1["location"] not in (
"chromosome",
"nuclear_chromosome",
"linkage_group",
):
loc = details1["location"]
org_loc[name1] = loc
# Gathering data from Seq_json file and storing it into a list
for rep in data:
for name2, details2 in rep.items():
if "location" in name2:
if details2 not in (
"chromosome",
"nuclear_chromosome",
"linkage_group",
):
name = rep["BRC4_seq_region_name"]
org_loc[name] = details2
return org_loc
def assembly_level(self, report_seq: dict, core_data: list) -> Tuple[str, str]:
INSDC_assembly_level = []
core_assembly_level = []
core_assembly = {}
scaffold_INSDC = 0
chromosome_INSDC = 0
scaffold_core = 0
chromosome_core = 0
for name, insdc_rep in report_seq.items():
if insdc_rep["coord_system_level"] not in (
"chromosome",
"nuclear_chromosome",
):
scaffold_INSDC += 1
else:
chromosome_INSDC += 1
INSDC_assembly_level.extend([scaffold_INSDC, chromosome_INSDC])
for core_details in core_data:
name = core_details["BRC4_seq_region_name"]
coord_system_level = core_details["coord_system_level"]
core_assembly[name] = coord_system_level
for name, coord_level in core_assembly.items():
if coord_level not in ("chromosome", "nuclear_chromosome"):
scaffold_core += 1
else:
chromosome_core += 1
core_assembly_level.extend([scaffold_core, chromosome_core])
INSDC_assembly_level = ", ".join([str(assembly) for assembly in INSDC_assembly_level])
core_assembly_level = ", ".join([str(assembly) for assembly in core_assembly_level])
return INSDC_assembly_level, core_assembly_level
|