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Re: [modeller_usage] database with PIR format, help



Quiliano Mesa, Miguel Angel wrote:
I have several sequences in FASTA format so I would like to do the
same process such as the basic tutorial with the database "95.pir",
my question is... how to convert to PIR format.. should I use a
program for this? there is a program for this? anyone have a scritp?
Converting the file formats is straightforward - simply read in the 
FASTA file with alignment.read() or (better) sequence_db.read() - see 
http://salilab.org/modeller/9v7/manual/node369.html - and then write out 
with alignment.write() or (better) sequence_db.write(). But that only 
solves part of your problem - PIR format contains more information than 
FASTA format (the header line contains the name of the corresponding PDB 
file and the range of residues to read). Since Modeller cannot invent 
this information from nothing, you will have to fill in this extra 
information yourself. If you have the original PDB files corresponding 
to these sequences, it may be easier just to rebuild your sequence 
database in PIR format starting from the PDBs. See 
http://salilab.org/modeller/wiki/Rebuilding%20sequence%20databases for 
an example.
	Ben Webb, Modeller Caretaker
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