2026-05-16_00000314|ligand|9T9E

Crystal structure of human CHD1 tandem chromodomain in complex with the ethoxyquinoline-based inhibitor 2b; X-ray diffraction 1.70Å
Protein #1 174 residues (99% resolved)

EFETIERFMDCRIGRKGATGATTTIYAVEADGDPNAGFEKNKEPGEIQYLIKWKGWSHIHNTWETEETLKQQNVRGMKKLDNYKKKDQETKRWLKNASPEDVEYYNCQQELTDDLHKQYQIVERIIAHSNQKSAAGYPDYYCKWQGLPYSECSWEDGALISKKFQACIDEYFSR

EFETIERFMDCRIGRKGATGATTTIYAVEADGDPNAGFEKNKEPGEIQYLIKWKGWSHIHNTWETEETLKQQNVRGMKKLDNYKKKDQETKRWLKNASPEDVEYYNCQQELTDDLHKQYQIVERIIAHSNQKSAAGYPDYYCKWQGLPYSECSWEDGALISKKFQACIDEYFSR
Non polymer #2 A1JUQ

InChI=1S/C28H39N5O/c1-4-34-24-11-12-25-26(19-24)31-28(29-15-8-16-32(2)3)20-27(25)30-23-13-17-33(18-14-23)21-22-9-6-5-7-10-22/h5-7,9-12,19-20,23H,4,8,13-18,21H2,1-3H3,(H2,29,30,31)

CCOc1ccc2c(c1)nc(cc2NC3CCN(CC3)Cc4ccccc4)NCCCN(C)C
Non polymer #3 DMS

InChI=1S/C2H6OS/c1-4(2)3/h1-2H3

CS(=O)C
Download coordinates
Reference