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. Author manuscript; available in PMC: 2022 Nov 23.
Published in final edited form as: J Med Chem. 2022 Jan 10;65(3):2342–2360. doi: 10.1021/acs.jmedchem.1c01779

Figure 5.

Figure 5.

(A) Cocrystal structure of 32 with BRD4 (PDB 7R9C). The structured waters are shown as red spheres. The dimethyl-ethylamino group forms a hydrogen bond with Asn140 and Asp144 via a structured water. Hydrogen bonds are shown in yellow dash. (B) Backbone overlay of BRD4 D1 bound to H4 K5ac,K8ac (PBD 3UVW, violet) and bound to 32 (PDB 7R9C, gray).