我尝试在Python中编写蛋白质序列的理论胰蛋白酶切割代码。胰蛋白酶的切割规则是:在R或K之后,但不在P之前(即胰蛋白酶在每个K或R之后切割蛋白质序列,除非(K或R)后面跟着一个P)。
示例:序列MVPPPPSRGGAAKPGQLGRSLGPLLLLLRPEEPEDGDREICSESK的切割(cut)应产生以下4个序列(肽):
MVPPPPSR
GGAAKPGQLGR
SLGPLLLLLRPEEPEDGDR
EICSESK 请注意,在第二个肽中K之后没有裂解(因为P在K之后),并且在第三个肽中在R之后没有裂解(因为P在R之后)。
我用Python编写了这段代码,但它不能很好地工作。有没有更有意义地实现这个正则表达式的方法?
# Open the file and read it line by line.
myprotein = open(raw_input('Enter input filename: '),'r')
if os.path.exists("trypsin_digest.txt"):
os.remove("trypsin_digest.txt")
outfile = open("trypsin_digest.txt",'w+')
for line in myprotein:
protein = line.rstrip()
protein = re.sub('(?<=[RK])(?=[^P])','', protein)
for peptide in protein:
outfile.write(peptide)
print 'results written to:\n', os.getcwd() +'\ trypsin_digest.txt'这就是我是如何让它为我工作的
myprotein = open(raw_input('Enter input filename: '),'r')
my_protein = []
for protein in myprotein:
myprotein = protein.rstrip('\n')
my_protein.append(myprotein)
my_pro = (''.join(my_protein))
#cleaves sequence
peptides = re.sub(r'(?<=[RK])(?=[^P])','\n', my_pro)
print peptides蛋白质序列:
MVPPPPSRGGAAKPGQLGRSLGPLLLLLRPEEPEDGDREICSESK MVPPPPSRGGAAKPGQLGRSLGPLLLLLRPEEPEDGDREICSESK
输出(胰蛋白酶裂解位点)或肽
MVPPPPSR
GGAAKPGQLGR
SLGPLLLLLRPEEPEDGDR
EICSESK
MVPPPPSR
GGAAKPGQLGR
SLGPLLLLLRPEEPEDGDR
EICSESK
MVPPPPSR
GGAAKPGQLGR
SLGPLLLLLRPEEPEDGDR
EICSESK
发布于 2011-05-30 00:26:12
正则表达式很好,但这里有一个使用常规python的解决方案。由于您要在基中寻找子序列,因此将其构建为生成器是有意义的,因为生成器会生成片段。
example = 'MVPPPPSRGGAAKPGQLGRSLGPLLLLLRPEEPEDGDREICSESK'
def trypsin(bases):
sub = ''
while bases:
k, r = bases.find('K'), bases.find('R')
cut = min(k, r)+1 if k > 0 and r > 0 else max(k, r)+1
sub += bases[:cut]
bases = bases[cut:]
if not bases or bases[0] != 'P':
yield sub
sub = ''
print list(trypsin(example))发布于 2011-05-30 00:13:40
稍微修改一下你的正则表达式就可以编辑了:
在您的评论中,您提到一个文件中有多个序列(让我们称其为sequences.dat):
$ cat sequences.dat
MVPPPPSRGGAAKPGQLGRSLGPLLLLLRPEEPEDGDREICSESK
MVPPPPSRGGAAKPGQLGRSLGPLLLLLRPEEPEDGDREICSESK
MVPPPPSRGGAAKPGQLGRSLGPLLLLLRPEEPEDGDREICSESK
>>> with open('sequences.dat') as f:
s = f.read()
>>> print(s)
MVPPPPSRGGAAKPGQLGRSLGPLLLLLRPEEPEDGDREICSESK
MVPPPPSRGGAAKPGQLGRSLGPLLLLLRPEEPEDGDREICSESK
MVPPPPSRGGAAKPGQLGRSLGPLLLLLRPEEPEDGDREICSESK
>>> protein = re.sub(r'(?<=[RK])(?=[^P])','\n', s, re.DOTALL)
>>> protein.split()
['MVPPPPSR', 'GGAAKPGQLGR', 'SLGPLLLLLRPEEPEDGDR', 'EICSESK', 'MVPPPPSR', 'GGAAKPGQLGR', 'SLGPLLLLLRPEEPEDGDR', 'EICSESK', 'MVPPPPSR', 'GGAAKPGQLGR', 'SLGPLLLLLRPEEPEDGDR', 'EICSESK']
>>> print protein
MVPPPPSR
GGAAKPGQLGR
SLGPLLLLLRPEEPEDGDR
EICSESK
MVPPPPSR
GGAAKPGQLGR
SLGPLLLLLRPEEPEDGDR
EICSESK
MVPPPPSR
GGAAKPGQLGR
SLGPLLLLLRPEEPEDGDR
EICSESK发布于 2011-05-30 00:16:40
我相信下面的regexp将会如您所描述的那样:
([KR]?[^P].*?[KR](?!P))下面是来自pythonregexp的结果
>>> regex = re.compile("([KR]?[^P].*?[KR](?!P))")
>>> r = regex.search(string)
>>> r
<_sre.SRE_Match object at 0xb1a9f49eb4111980>
>>> regex.match(string)
<_sre.SRE_Match object at 0xb1a9f49eb4102980>
# List the groups found
>>> r.groups()
(u'MVPPPPSR',)
# List the named dictionary objects found
>>> r.groupdict()
{}
# Run findall
>>> regex.findall(string)
[u'MVPPPPSR', u'GGAAKPGQLGR', u'SLGPLLLLLRPEEPEDGDR', u'EICSESK']https://stackoverflow.com/questions/6168727
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