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[modeller_usage] Re: modeller_usage Digest, Vol 3, Issue 36





> Message: 4
> Date: Tue, 30 Mar 2004 16:55:59 -0500
> From: "Clemens Steegborn" <>
> Subject: [modeller_usage] problem reading alignment file
> To:
> Message-ID: <>
> Content-Type: text/plain; charset="us-ascii"; format=flowed
>
>
> Hi,
>
> I'm using the WINDOWS version of MODELLER6v2
>
> I get the following error when reading the template and alignment files:
>
>  >
>  >TOP_________>   121  107 CHECK_ALIGNMENT
>  >
>  >check_a_343_> >> BEGINNING OF COMMAND
>  >openf5__224_> Open       11  OLD  SEQUENTIAL  myt.atm
>  >rdabrk__290E> Number of residues in the alignment and  pdb files are
> different:      433      392
>  >              For alignment entry:        1
>  >recover____E> ERROR_STATUS >= STOP_ON_ERROR:        1       1
>  >
>
> the problem seems to be that MODELLER doesn't understand the gap residue
> '-', as it also
> doesn't understand '/' (using '/' gives an error stating it doesn't know
> this residue)!
>
> I tried including a link called RESTYP_LIB to restyp.lib in the libs.lib
> file, but that didn't help.
>
> Any suggestions would be appreciated!
>


Hi, Clemens,

Weird. It is not clear why would you have to modify your libs.lib file, since normally it contains the setting for RESTYP_LIB? Do you have your own customized restyp.lib at a different location?

I assume your *LIB settings in libs.lib are more or less similar (like in the default setting). If that is the case and if RESTYP_LIB setting would be incorrect, then other library settings would cause problems as well.

I wonder if you can send your input files (.pdb, .ali, libs.lib and restyp.lib).

Azat

A.Ya.Badretdinov, PhD,
Sr. Scientist
x5728
http://intranet.accelrys.com/~azat

 
> Clemens
>
>
>
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> End of modeller_usage Digest, Vol 3, Issue 36
> *********************************************