Yes, I was giving wrong data labels and could find the correct one using the command given. <div><br></div><div>Thanks a lot</div><div>Subhani<br><br><div class="gmail_quote">On Wed, Feb 15, 2012 at 10:38 AM, Nathaniel Echols <span dir="ltr"><<a href="mailto:nechols@lbl.gov">nechols@lbl.gov</a>></span> wrote:<br>
<blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex"><div class="HOEnZb"><div class="h5">On Wed, Feb 15, 2012 at 8:31 AM, Subhani Bandara <<a href="mailto:ramssb17@gmail.com">ramssb17@gmail.com</a>> wrote:<br>
> I used qFIT to fix the alternative conformations of my protein with a<br>
> chelator complex, by submitting a PDB file and a mtz file. But it gave<br>
> following error. What could be the reason for this.<br>
>><br>
>> ___Run time error messages (if any):___<br>
>> xyz.pdb mtz.rfl FP SIGFP<br>
>> Sorry: No matching array: refinement.input.xray_data.labels=FP,SIGFP<br>
<br>
</div></div>This is really a question for Henry van den Bedem (qFit author) -<br>
fortunately, he's also on this list. Are you certain you entered the<br>
correct data labels? You can view your options by running this<br>
command:<br>
<br>
iotbx.reflection_file_reader data.mtz<br>
<br>
-Nat<br>
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