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. Author manuscript; available in PMC: 2021 Mar 26.
Published in final edited form as: J Med Chem. 2020 Mar 6;63(6):3227–3237. doi: 10.1021/acs.jmedchem.9b01980

Figure 3.

Figure 3.

Binding modes of I-BRD9, TP-472, and bromosporine in BRD7 and BRD9. (A) Cocrystal structure of I-BRD9 in BRD7 (PDB 6V17) and (B) in BRD9 (PDB 6V1B). (C) Superposition of both structures. (D–F) Same as (A–C) for TP-472 (PDB 6V16 and 6V14). (G–I) Same as (A–C) for bromosporine (PDB 6V1H and 5IGM). Except for the BRD9-bromosporine complex, all structures were determined experimentally (Supporting Information Table S3). 2Fo – Fc and Fo – Fc electron density maps are shown in Figure S3 and S4.