Ensemble refinement of protein crystal structures in PHENIX
Ensemble refinement of protein crystal structures in PHENIX
Ensemble refinement of protein crystal structures in PHENIX
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Inhibitor b<strong>in</strong>d<strong>in</strong>g to HIV protease <br />
apo-‐protease (2PC0) <br />
complex with JE-‐2147 (1KZK) <br />
Compara=ve analysis <strong>of</strong> atomic flexibility: <br />
-‐ Isomorphous <strong>crystal</strong>s elim<strong>in</strong>ate differences due to Xtal contacts <br />
-‐ Non-‐isomorphous <strong>crystal</strong>s allow evalua=on <strong>of</strong> Xtal contact <br />
effects