2026-10-31_00000479|ligand|21OJ

Crystal Structure of the second bromodomain of human BRD4 BD2 in complex with the covalent inhibitor; X-ray diffraction 2.60Å
Protein #1 113 residues (99% resolved)

SKVSEQLKCCSGILKEMFAKKHAAYAWPFYKPVDVEALGLHDYCDIIKHPMDMSTIKSKLEAREYRDAQEFGADVRLMFSNCYKYNPPDHEVVAMARKLQDVFEMRFAKMPDE

SKVSEQLKCCSGILKEMFAKKHAAYAWPFYKPVDVEALGLHDYCDIIKHPMDMSTIKSKLEAREYRDAQEFGADVRLMFSNCYKYNPPDHEVVAMARKLQDVFEMRFAKMPDE
Non polymer #2 A1E3W

InChI=1S/C33H37N3O6/c1-8-11-34-31(38)27-15-25-26(16-36(7)32(39)29(25)35-27)24-14-22(33(5,6)40)9-10-28(24)42-30-20(3)12-23(13-21(30)4)41-18-19(2)17-37/h1,9-10,12-16,19,35,37,40H,11,17-18H2,2-7H3,(H,34,38)/t19-/m0/s1

Cc1cc(cc(c1Oc2ccc(cc2C3=CN(C(=O)c4c3cc([nH]4)C(=O)NCC#C)C)C(C)(C)O)C)OC[C@@H](C)CO
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Reference