[Date Prev][Date Next][Thread Prev][Thread Next][Date Index][Thread Index]
Re: [modeller_usage] exploding GTP
- To: Jonathan Winger <wingerj AT berkeley.edu>
- Subject: Re: [modeller_usage] exploding GTP
- From: Modeller Caretaker <modeller-care@ucsf.edu>
- Date: Tue, 09 Oct 2007 11:18:33 -0700
- Cc: modeller_usage@listsrv.ucsf.edu
Jonathan Winger wrote:
When modeling GTP and metal ions into my protein, using a template
with 2 metal ions and an ATP analog, the GTP atoms end up
disconnected from each other and scattered around the active site,
and one of the two metals is launched out of the protein. What can I
do to fix this?
What Modeller version are you using? What do your input scripts/PDB
files/alignments look like?
Ben Webb, Modeller Caretaker
--
modeller-care@ucsf.edu http://www.salilab.org/modeller/
Modeller mail list: http://salilab.org/mailman/listinfo/modeller_usage