[Chimera-users] PDB file format for movie
Eric Pettersen
pett at cgl.ucsf.edu
Mon Feb 5 10:36:05 PST 2007
Hi Mingfeng,
Chimera's original PDB-parsing code was quite strict for exact
format adherence. Over time, I have made it more forgiving in many
ways, but right now you're getting caught by one of it's remaining
strictures: according to the PDB format spec, the model number of a
MODEL record has to be in columns 11-14. In your example the model
numbers start in column 7. This problem will be fixed in the next
snapshot, which we will be working on putting out next week.
Also, as Elaine pointed out, you need to use ENDMDL records instead
of END records.
--Eric
Eric Pettersen
UCSF Computer Graphics Lab
pett at cgl.ucsf.edu
http://www.cgl.ucsf.edu
On Feb 5, 2007, at 8:08 AM, Mingfeng Yang wrote:
> Dear Chimera users and developers,
>
> I'd like to use chimera to view the motions of a protein. If all
> the snapshots are to be saved in a single PDB file, what's the
> correct format for them?
>
> I tried the following, but chimera complained that a single
> structure is included only.
>
> Thanks,
> Mingfeng
> ------------------
> MODEL 1
> ATOM 1 N ALA 1 -4.564 -7.956 -6.531 1.00
> 0.00 N
> ATOM 2 CA ALA 1 -5.237 -8.746 -5.532 1.00
> 0.00 C
> ATOM 3 C ALA 1 -4.360 -9.172 -4.378 1.00
> 0.00 C
> ...
> ATOM 81 HN ALA 10 0.195 11.398 3.736 1.00
> 0.00 H
> END
> MODEL 2
> ATOM 1 N ALA 1 - 5.031 -8.234 -5.174 1.00
> 0.00 N
> ....
> END
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