2026-06-13_00000122|ligand|9P33

Crystal structure of the Bromo domain 1 in human Bromodomain Containing Protein 4 with a compound; X-ray diffraction 1.01Å
Protein #1 127 residues (99% resolved)

SMNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQPVDAVKLNLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNCYIYNKPGDDIVLMAEALEKLFLQKINELPTEE

SMNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQPVDAVKLNLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNCYIYNKPGDDIVLMAEALEKLFLQKINELPTEE
Non polymer #2 A1C7T

InChI=1S/C28H28F3N5O2/c1-16(2)19-5-4-17(3)24(12-19)38-27-33-11-10-21(35-27)26-25(18-6-8-20(9-7-18)28(29,30)31)34-15-36(26)22-13-32-14-23(22)37/h4-12,15-16,22-23,32,37H,13-14H2,1-3H3/t22-,23-/m0/s1

Cc1ccc(cc1Oc2nccc(n2)c3c(ncn3[C@H]4CNC[C@@H]4O)c5ccc(cc5)C(F)(F)F)C(C)C
Non polymer #3 A1C7U

InChI=1S/C28H28F3N5O2/c1-16(2)19-5-4-17(3)24(12-19)38-27-33-11-10-21(35-27)26-25(18-6-8-20(9-7-18)28(29,30)31)34-15-36(26)22-13-32-14-23(22)37/h4-12,15-16,22-23,32,37H,13-14H2,1-3H3/t22-,23+/m1/s1

Cc1ccc(cc1Oc2nccc(n2)c3c(ncn3[C@@H]4CNC[C@@H]4O)c5ccc(cc5)C(F)(F)F)C(C)C
Non polymer #4 A1CGX

InChI=1S/C28H28F3N5O2/c1-16(2)19-5-4-17(3)24(12-19)38-27-33-11-10-21(35-27)26-25(18-6-8-20(9-7-18)28(29,30)31)34-15-36(26)22-13-32-14-23(22)37/h4-12,15-16,22-23,32,37H,13-14H2,1-3H3/t22-,23-/m1/s1

Cc1ccc(cc1Oc2nccc(n2)c3c(ncn3[C@@H]4CNC[C@H]4O)c5ccc(cc5)C(F)(F)F)C(C)C
Non polymer #5 EDO

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

C(CO)O
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