Re: [modeller_usage] HETATM MSE records

On 6/25/12 10:33 AM, Thomas Gaillard wrote: > I have noticed that some HETATM records are read by Modeller and > automatically handled as corresponding standard residues (for example > MSE -> MET)

Actually MSE -> MET is the only such translation done.

> I would like to know if you could suggest a way to disable this > behaviour and really ignore all HETATM records.

Unfortunately there isn't any way to do that - it is hardcoded into the PDB reader. Why do you want to treat MSE as HETATMs anyway? There may be a better way to achieve your goal.

Ben Webb, Modeller Caretaker