allpy: 5091fef2ad88 lib/sequence.py

allpy

view lib/sequence.py @ 101:5091fef2ad88

lib::MonomerType operator== consider only one letter code align -- additional check of monomer equality fix bug with missing __ne__ where __eq__ present

author	boris <bnagaev@gmail.com>
date	Thu, 21 Oct 2010 00:39:57 +0400
parents	3d40d7b9a123
children	7a87d55efc17 6e2152b2f286

line source

1 #!/usr/bin/python

2 import monomer

3 from Bio.PDB import PDBParser, CaPPBuilder

4 from Bio.Seq import Seq

5 from allpy_pdb import Pdb

7 cappbuilder = CaPPBuilder()

9 class Sequence(object):

10 """

11 Mandatory data:

12 * name -- str with the name of sequence

13 * description -- str with description of the sequence

14 * monomers -- list of monomer objects (aminoacids or nucleotides)

15 * pdb_chain -- list of Bio.PDB.Chain's

17 TODO: class Protein: container of multiple Sequences,

18 class ProteinMononer: container of multiple Monomers

19 """

20 def __init__(self, name, monomers, description=""):

21 self.name = name

22 self.description = description

23 self.monomers = monomers

25 def __len__(self):

26 return len(self.monomers)

28 def __str__(self):

29 return ''.join([monomer.monomer_type.code1 for monomer in self.monomers])

31 def __eq__(self, other):

32 return len(self) == len(other) and \

33 all([a==b for a, b in zip(self.monomers, other.monomers)])

35 def __ne__(self, other):

36 return not (self == other)

38 def pdb_chain_add(self, pdb_file, pdb_id, pdb_chain, pdb_model=0):

39 """

40 Reads Pdb chain from file

41 and align each Monomer with PDB.Residue (TODO)

42 """

43 name = Pdb.std_id(pdb_id, pdb_chain, pdb_model)

44 self.pdb_chain = PDBParser().get_structure(name, pdb_file)[pdb_model][pdb_chain]

45 peptide = cappbuilder.build_peptides(self.pdb_chain)

46 sequence = str(peptide[0].get_sequence()) # TRU?

47 print sequence

48 # FIXME: align and map