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2. We will now use pymol to load a pdb file and color some residues.
a. Load the pdb file
f.
g. Now rotate the protein around its vertical axis to view the active site.
h. Save your work as a pymol session (this will allow you to resume where
you left off).
> save 1BNA.pse
i.
j.
Exit pymol.
> quit
k. To resume, restart pymol and type > load 1BNA.pse from the
command-line (or open the file using the menu >file>open).
PyMol scripts
1. The commands used above can be placed in a script which can then be invoked
to repeat these actions. For instance, type the following commands on each line
of a file called color-activesite.pml
load 1BNA.pdb
show spheres
select waters, resn HOH