Doesn't mmdb read the 'old' lines from syminfo.lib?
In which case, H 3 2 should work.
H32 without spaces clearly won't, and I don't think such a symbol would
be present in a modern (remediated) PDB file.
symbol ccp4 155
symbol Hall ' R 3 2"'
symbol xHM 'R 3 2 :H'
symbol old 'H 3 2'
Eleanor Dodson wrote:
Paul Emsley wrote:
James Whittle wrote:
Hi-
I'm trying for the first time to work with a structure in spacegroup
H32. Coot reads the CRYST card, but when I build a helix, or look at
a H32 PDB entry, the symmetry mates appear squished. I know there is
some discussion about handling this spacegroup: do I need to change
the CRYST line to get the structure to display correctly?
<chuckle> what timing :-)
OK, so the answer is that Coot does not support such a spacegroup
symbol. You need to specify it as "R 3 2 :H".
Paul
Paul - you have to fix this - until such time as PDB depositions return
such a symbol. At the moment they have H32
E
