[Bioperl-l] Parsing PDB entries in BioPerl
Ann Loraine
loraine@loraine.net
Tue, 13 Nov 2001 12:49:36 -0800 (PST)
> therefor I would want to ask you which data in a PDB entry you're
> typically intrested in and which questions you want to ask to such an
> object.
Dear Kris,
I'd be very interested in being able to parse out which residues are
post-translationally modified as well as which residues are involved in
catalysis - the active sites.
Any kind of feature information on one or more protein sequences would be
great. Seems like these could be abstracted into two types of features:
1. SingleSpanFeatures - features that refer to a 1-or-more residue spans
on a single chain
2. CompoundFeatures - groups of SingleSpanFeatures
(such as contact points across multiple chains)
Also, to model PDB files that describe a protein complex, you might want
to build a MultiMoleculeSeq, a container for multiple sequences, each of
which would be decorated with CompoundFeatures and SingleSpanFeatures.
Yours,
Ann