Dear Nat,

No LigandFit does not crash but when I try phenix.refine directly from the summary it does not succeed. I added the mtz file to run refinement but it gives some error message and submits bug report.

Best regards,

Bishwa 




On Mar 30, 2013, at 11:51 PM, Nathaniel Echols wrote:

On Sat, Mar 30, 2013 at 1:42 PM,  <[email protected]> wrote:
ligand bound. Could it be the reason? As stated earlier I can see the density
for the ligand. Also, I tried "Ligandfit" and "ligandidentifier" in PHENIX.
They too failed.

We received your bug reports for the ligand identification - I'll make
sure they are passed on to the appropriate person.  I didn't see
anything for LigandFit though.  Does it crash, or does it simply miss
the desired location and place the ligand elsewhere?  If you're
willing to send us the input files (off-list!), we may have a better
answer for why it's failing.

-Nat
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