Fig. 6: Structure of ehSMOX containing the ligand JNJ-1289 and HDX-MS of the complex.
From: Structure of human spermine oxidase in complex with a highly selective allosteric inhibitor
a Structure of ehSMOX in ribbon representation. The FAD cofactor is shown in yellow, MDL72527 in orange and the ligand JNJ-1289 is shown in magenta sticks; the loop in front of the substrate-binding pocket is in purple color. b HDX-MS signatures differences between hSMOX and hSMOX bound to JNJ-1289 overlaid onto a putty representation (areas with increased diameter correlate with higher B-factors) of ehSMOX; decreased deuterium uptake upon JNJ-1289 binding, is depicted with a color spectrum from cyan to blue with increased protection.
