[AMBER] Map function for custom residue to generate distace restraints?

From: Bongkeun Kim <bkim.chem.ucsb.edu>
Date: Mon, 06 Dec 2010 16:21:02 -0800

Hello,

I tried to generate the distance restraint between graphite surface
and the peptide. I got a error after running
makeDIST_RST -upb 7col.dist -pdb 2hbs.pdb -rst RST.dist
------------------------------------------------------------
ERROR no map function for C GRA :data= 1365 ARG CD 654 GRA C 60.

in the 7col.dist file, I have
---------------------------------------
1365 ARG CD 654 GRA C 60.0
-----------------------------

How do I have map function for carbon from GRA residue made by antechamber?
Bongkeun Kim




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Received on Mon Dec 06 2010 - 16:30:02 PST
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