RE: [PyMOL] 1pit.pdb

2003-01-12 Thread DeLano, Warren
Jack, What are all those extra "Q" atoms in the pdb file? They look to me like compromise/placeholder coordinates for NMR-equivalent hydrogens...or something like that. To get a reasonable picture, you can get rid of the extra bonds with unbond elem q*,all or just nuke the "Q" atoms alto

[PyMOL] 1pit.pdb

2003-01-12 Thread Jack Howarth
Under linux does anyone else see the following? If one loads in the 1pit.pdb from the MOLMOL data files, the resulting structure seems to have extra bonds drawn in the side chains. For example phe's seem to have all the opposing carbons in the rings interconnected through the center of the ring