That's an NMR structure so does not have a unit cell. Makes one
wonder if it/they should have a CRYST1 card at all!
-Tom
Sent from a tiny virtual keyboard.
On Dec 24, 2009, at 11:27 PM, jaime.prilu...@weizmann.ac.il wrote:
Jmol (11.5.35 and 11.8.9) can't open PDB 3irj,
reporting this
According to Thomas Stout thomasjst...@gmail.com:
That's an NMR structure so does not have a unit cell. Makes one
wonder if it/they should have a CRYST1 card at all!
-Tom
Thank you for pointing this out.
According to http://www.wwpdb.org/documentation/format23/sect8.html
it's valid to have
This is fixed for Jmol 11.9.13 and Jmol 11.8.15
On Fri, Dec 25, 2009 at 1:27 AM, jaime.prilu...@weizmann.ac.il wrote:
Jmol (11.5.35 and 11.8.9) can't open PDB 3irj,
reporting this error:
script ERROR: Error reading file at line 192:
CRYST11.0001.0001.000 0.00 0.00 0.00
Jmol (11.5.35 and 11.8.9) can't open PDB 3irj,
reporting this error:
script ERROR: Error reading file at line 192:
CRYST11.0001.0001.000 0.00 0.00 0.00 P 1 1
cannot invert matrix
Jaim
--
Dr Jaime Prilusky |
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