Is there a way to select a sphere of residues in the phenix.superpose_pdbs command, analogous to the "around" syntax in cns? I tried "within" and "around" in phenix.superpose_pdbs but got "Atom selection syntax error". Thanks. Jack Tanner John J. Tanner Professor of Biochemistry and Chemistry University of Missouri-Columbia 125 Chemistry Building Columbia, MO 65211 email: [email protected]mailto:[email protected] phone: 573-884-1280 fax: 573-882-2754 http://faculty.missouri.edu/~tannerjj/tannergroup/tanner.html
John
Here is the atom selection page
http://www.phenix-online.org/documentation/reference/atom_selections.html
and here is an example.
within(5, (nucleotide or peptide) backbone)
Contact me if you have any more trouble.
Cheers
Nigel
On Fri, Jun 27, 2014 at 6:03 AM, Tanner, John J.
Is there a way to select a sphere of residues in the phenix.superpose_pdbs command, analogous to the "around" syntax in cns? I tried "within" and "around" in phenix.superpose_pdbs but got "Atom selection syntax error".
Thanks.
Jack Tanner
John J. Tanner Professor of Biochemistry and Chemistry University of Missouri-Columbia 125 Chemistry Building Columbia, MO 65211 email: [email protected] phone: 573-884-1280 fax: 573-882-2754 http://faculty.missouri.edu/~tannerjj/tannergroup/tanner.html
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On Fri, Jun 27, 2014 at 10:45 AM, Nigel Moriarty
Here is the atom selection page
http://www.phenix-online.org/documentation/reference/atom_selections.html
and here is an example.
within(5, (nucleotide or peptide) backbone)
That won't work in phenix.superpose_pdbs (or the atom selection tool in the GUI) because the "within" syntax depends on the full geometry restraints setup (which is slower and therefore not used in these contexts). This has been annoying me for a while, so I will look into changing it. -Nat
participants (3)
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Nathaniel Echols
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Nigel Moriarty
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Tanner, John J.