[chimerax-users] Option Include non-water HETATM in Modeller Comparative

[Eric Pettersen]

Hi Marta,
	Thanks for reporting this problem.  I have opened a ticket for the issue: #3814 (HETATM not passed through to Modeller when requested) <https://www.rbvi.ucsf.edu/trac/ChimeraX/ticket/3814>.  Hopefully we will have it fixed in the next day or two.

--Eric

	Eric Pettersen
	UCSF Computer Graphics Lab

> On Oct 9, 2020, at 10:45 AM, Marta Martinez <mmmtnez at cnb.csic.es> wrote:
> 
> 
> Hi all,
> 
> I am running a very simple example in Modeller Comparative (a small alignment including the template structure and the target sequence to model). Since the template harbors a HEME group, I decided to select the Advanced option "Include non-water molecules HETATM residues from template". However, no one of the retrieved models contains the HEME group. Does anyone know what could be happening?
> 
> 
> Thanks in advance: MARTA
> -- 
> Marta Martinez Gonzalez
> 
> Biocomputing Unit (Lab B13)
> National Center for Biotechnology-CSIC
> Darwin, 3. Campus de la Universidad Autonoma de Madrid
> 28049 Madrid. Spain
> Tel:+34 915854510 Fax:+34 913720112
> E-mail: mmmtnez at cnb.csic.es
> 
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