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Hi Henry,<br>
<br>
first off you don't need to use insertion codes to do what you are
trying to do.<br>
<br>
Second, it looks like this scenario is described in section 5 here
(page 42):<br>
<br>
"13 typical occupancy refinement scenarios and available options in
phenix.refine"<br>
<a class="moz-txt-link-freetext" href="https://www.phenix-online.org/newsletter/CCN_2015_07.pdf">https://www.phenix-online.org/newsletter/CCN_2015_07.pdf</a><br>
<br>
Please let me know if this is not your case, or it is still not
clear, or you need help with this anyway..<br>
<br>
Good luck,<br>
Pavel<br>
<br>
<div class="moz-cite-prefix">On 10/17/16 11:05, Christian Roth
wrote:<br>
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<p><font face="Arial">Hi Henry,</font></p>
<p><font face="Arial">have you created a proper constraint group
including both compounds as described in the manual under
special cases for occupancy refingement? That should work, I
presume. <br>
</font></p>
<p><font face="Arial"><br>
Cheers</font></p>
<p><font face="Arial">Christian</font></p>
<p><font face="Arial"><br>
</font></p>
<div class="moz-cite-prefix">Am 15.10.2016 um 22:15 schrieb van
den Bedem, Henry:<br>
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<p class="MsoNormal"><span style="font-size:11.0pt">Hi:<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt"><o:p>�</o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt">I�m
refining a site where there�s two compounds, each at
partial occupancy. I modeled that using alt codes and
insertion codes combined, like this<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt"><o:p>�</o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt">ATOM��
6500� CA ACYS B 101B<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt">ATOM��
6490� CA BXXX B 101A<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt"><o:p>�</o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt">How can I
constrain the occupancies so that they sum to unity? I
tried several option, but the distinct insertions seem to
refine independently. Sorry if a similar question has been
posted before, but I could not find a solution searching
phenixbb.<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt"><o:p>�</o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt">Thanks!<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt"><o:p>�</o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt">Henry</span><br>
</p>
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