Extended Data Fig. 8: Structural characterization of inhibited BH32, OE1.2 and OE1.3.
From: Design and evolution of an enzyme with a non-canonical organocatalytic mechanism
A global superposition of BH32-inhibited (purple), OE1.2-inhibited (blue) and OE1.3-inhibited (green) structures performed using ICM Pro. The r.m.s.d. values (backbone atoms), derived from the global superposition are calculated separately for the core and cap domains and are reported in the table. BH32-inhibited and OE1.2-inhibited structures retain similar domain orientations, whereas OE1.3 undergoes a reorientation of the cap domain upon inhibition with 2-bromoacetophenone.
