[PyMOL] Breaking down PDB files

2004-06-01 Thread Tony Giannetti
Hey everyone, I know I should be past this, but I can't seem to figure out how to do this. I have a couple of crystal structures that contain multiple copies in the asymmetric unit, and I would like to superimpose each copy to see what the differences are. One way is to break the PDB file

Re: [PyMOL] Breaking down PDB files

2004-06-01 Thread Michael George Lerner
I think that PyMOL can only align different objects, not different selections. There may be a more elegant way, but .. If your chains are A,B,C..H, try this from the PyMOL prompt to create different objects: for c in 'A B C D E F G H'.split():cmd.create(c+'_chain','chain '+c) and this to align

[PyMOL] pymol 0.95 vs Fedora Core 2

2004-06-01 Thread Jack Howarth
Has anyone successfully built pymol 0.95 under Fedora Core 2? Are there any particular tricks? My first attempt of just editing Rules.make to change python2.2 to python2.3 allowed the compilation to finish but I get the following run-time error... Exception in thread Thread-1: Traceback (most

Re: [PyMOL] Breaking down PDB files

2004-06-01 Thread Matt Franklin
Tony Giannetti wrote: Hey everyone, I know I should be past this, but I can't seem to figure out how to do this. I have a couple of crystal structures that contain multiple copies in the asymmetric unit, and I would like to superimpose each copy to see what the differences are. One way is

[PyMOL] extra bonds

2004-06-01 Thread Nat Echols
I know this has come up before and I can't remember what the solution was. PyMOL is drawing bonds between the protein I'm interested in, the ATP analog, and the bound metal ions, presumably because the metals are close enough to the protein and analog for bonds to be autodetected. Is there a way