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. 2020 Jun 24;11(1):156–180. doi: 10.1016/j.apsb.2020.06.003

Figure 4.

Figure 4

Binding mode analysis of 19d, RVX-208 and Olaparib. (A) and (B) Binding mode of 19d and RVX-208 in the BD1 domain of BRD4. BRD4 (PDB code: 4MR4) was shown in green. (C) and (D) Binding mode of 19d and RVX-208 in the BD2 domain of BRD4. BRD4 (PDB code: 5UOO) was shown in green. (E) and (F) Binding mode of 19d and Olaparib in the active site of PARP1. PARP1 (PDB code: 5DS3) was shown in cyan. The carbon atoms of 19d were colored in orange, while RVX-208 and Olaparib were colored in white. The oxygen atoms were colored in red and nitrogen atoms in blue. Hydrogen bonds were indicated with dashed lines.