2026-10-31_00000749|ligand|9T15

Crystal structure of human BRD4-BD1 bromodomain in complex with compound 662; X-ray diffraction 1.21Å
Protein #1 148 residues (85% resolved)

MHHHHHHSSGVDLGTENLYFQSMNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQPVDAVKLNLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNCYIYNKPGDDIVLMAEALEKLFLQKINELPTEE

MHHHHHHSSGVDLGTENLYFQSMNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQPVDAVKLNLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNCYIYNKPGDDIVLMAEALEKLFLQKINELPTEE
Non polymer #2 A1JSY

InChI=1S/C12H14N2O4/c15-8-2-3-9(10(16)6-8)14-12(18)5-7-1-4-11(17)13-7/h2-3,6-7,15-16H,1,4-5H2,(H,13,17)(H,14,18)/t7-/m1/s1

c1cc(c(cc1O)O)NC(=O)C[C@H]2CCC(=O)N2
Non polymer #3 EDO

InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2

C(CO)O
Non polymer #4 FMT

InChI=1S/CH2O2/c2-1-3/h1H,(H,2,3)

C(=O)O
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Reference