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Hi Everybody here,
I am new to the modelling world and have
successfully installed Modeller v6.2 onto windows2000 PC. Got the tutorial to
run fine. started modelling my protein. A series of errors I managed to sort
out, using the manual, practical article, the FAQ and this list's archive.
However, I have had to send in this somewhat simple problem that may have been
addressed several times on the list but I have failed to figure out how to get
out of it.
I am trying first to align two sequences using
align2d like so:
READ_MODEL FILE = '1eqk.pdb' SEQUENCE_TO_ALI ALIGN_CODES = '1eqkA' READ_ALIGNMENT FILE = 'PapCys.ali', ALIGN_CODES = 'PapCys', ADD_SEQUENCE = ON ALIGN2D WRITE_ALIGNMENT FILE='PapCys-1eqk.ali', ALIGNMENT_FORMAT = 'PIR' WRITE_ALIGNMENT FILE='PapCys-1eqk.pap', ALIGNMENT_FORMAT = 'PAP' Then I get the following error message: iatmcls_286W MODEL atom not classified: ALA:OT1 ALA iatmcls_286W MODEL atom not classified: ALA:OT2 ALA I have checked all lib files and ALA seems well defined, However, I belive there may be a problem in the ieqk.pdb file which have not touched sine downloading from the PDB database. Can anybody help Andrew
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