select ligands, (byres gmp expand 5 and psd) selects whole residues from molecule psd within 5 A from gmp
aaron.b.mil...@gsk.com wrote:
Hello, I am somewhat new to PYMOL and was trying to create a selection of atoms. What I need to do is select all atoms of a protein that are within 5 angstroms of an inhibitor (the protein and inhibitor are separate molecules). I cannot figure out how to do this from the examples in the manual. I will want to use this selection to make a surface of the selection afterward. Thanks, Aaron Aaron B. Miller Computational Chemist GlaxoSmithKline R & D Five Moore Drive, North M1407 RTP, NC 27709-3398 (919) 483-6069 Fax (919) 315-0430 aaron.b.mil...@gsk.com ------------------------------------------------------- This sf.net email is sponsored by:ThinkGeek Welcome to geek heaven. http://thinkgeek.com/sf _______________________________________________ PyMOL-users mailing list PyMOL-users@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/pymol-users
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