2026-05-16_00000318|ligand|9T9I

Crystal structure of human CHD1 tandem chromodomain in complex with the ethoxyquinoline-based inhibitor 2s; X-ray diffraction 1.55Å
Protein #1 174 residues (100% resolved)

EFETIERFMDCRIGRKGATGATTTIYAVEADGDPNAGFEKNKEPGEIQYLIKWKGWSHIHNTWETEETLKQQNVRGMKKLDNYKKKDQETKRWLKNASPEDVEYYNCQQELTDDLHKQYQIVERIIAHSNQKSAAGYPDYYCKWQGLPYSECSWEDGALISKKFQACIDEYFSR

EFETIERFMDCRIGRKGATGATTTIYAVEADGDPNAGFEKNKEPGEIQYLIKWKGWSHIHNTWETEETLKQQNVRGMKKLDNYKKKDQETKRWLKNASPEDVEYYNCQQELTDDLHKQYQIVERIIAHSNQKSAAGYPDYYCKWQGLPYSECSWEDGALISKKFQACIDEYFSR
Non polymer #2 A1JUS

InChI=1S/C41H52N8O3/c1-3-51-37-13-14-38-39(25-37)44-41(26-40(38)43-34-15-19-47(20-16-34)28-32-7-5-4-6-8-32)48-21-17-33(18-22-48)42-27-31-9-11-36(12-10-31)52-30-35-29-49(46-45-35)23-24-50-2/h4-14,25-26,29,33-34,42H,3,15-24,27-28,30H2,1-2H3,(H,43,44)

CCOc1ccc2c(c1)nc(cc2NC3CCN(CC3)Cc4ccccc4)N5CCC(CC5)NCc6ccc(cc6)OCc7cn(nn7)CCOC
Non polymer #3 EDO

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

C(CO)O
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Reference