That file was straight from the RCSB.
On 01/17/12 13:50, Roberts, Sue A - (suer) wrote:
Hi Dave
I think you need P -1, not P 1-
(or, perhaps -P 1)
look in the ccp4 syminfo.lib file for notation.
I have used coot with centrosymmetric space groups.
Sue
On Jan 17, 2012, at 11:19 AM, David Schuller wrote:
Welcome to Coot. 0.6.2 (revision 3566) [with guile 1.8.8 embedded]
[with python 2.7.2 embedded]
Installed via yum: coot-0.6.2-8.20110715svn3566.fc16.x86_64
On Fedora 16 Linux
I am trying to view a PDB file with a centrosymmetric space group. It
doesn't seem to be working:
In the file:
CRYST1 29.302 23.215 23.184 72.96 90.60 90.60 P 1- 4
In the COOT log:
Reading coordinate file: ****.pdb
PDB file ****.pdb has been read.
No Spacegroup found for this PDB file
Cell: 29.302 23.215 23.184 72.96 90.6 90.6
...
No Symmetry for this model
==========================
Either COOT does not support centrosymmetric space groups, or else it is
not reading the space group identification properly from the standard
CRYST1 line.
--
=======================================================================
All Things Serve the Beam
=======================================================================
David J. Schuller
modern man in a post-modern world
MacCHESS, Cornell University
[email protected]
Dr. Sue A. Roberts
Dept. of Chemistry and Biochemistry
University of Arizona
1041 E. Lowell St., Tucson, AZ 85721
Phone: 520 621 8171
[email protected]
http://www.biochem.arizona.edu/xray
Sample disclaimer text
--
=======================================================================
All Things Serve the Beam
=======================================================================
David J. Schuller
modern man in a post-modern world
MacCHESS, Cornell University
[email protected]
