2025-11-15_00000070|ligand|9HBM

Crystal structure of human NUDT14 in complex with a potent inhibitor (MA-955-10); X-ray diffraction 1.83Å
Protein #1 223 residues (99% resolved)

SMERIEGASVGRCAASPYLRPLTLHYRQNGAQKSWDFMKTHDSVTVLLFNSSRRSLVLVKQFRPAVYAGEVERRFPGSLAAVDQDGPRELQPALPGSAGVTVELCAGLVDQPGLSLEEVACKEAWEECGYHLAPSDLRRVATYWSGVGLTGSRQTMFYTEVTDAQRSGPGGGLVEEGELIEVVHLPLEGAQAFADDPDIPKTLGVIFGVSWFLSQVAPNLDLQ

SMERIEGASVGRCAASPYLRPLTLHYRQNGAQKSWDFMKTHDSVTVLLFNSSRRSLVLVKQFRPAVYAGEVERRFPGSLAAVDQDGPRELQPALPGSAGVTVELCAGLVDQPGLSLEEVACKEAWEECGYHLAPSDLRRVATYWSGVGLTGSRQTMFYTEVTDAQRSGPGGGLVEEGELIEVVHLPLEGAQAFADDPDIPKTLGVIFGVSWFLSQVAPNLDLQ
Non polymer #2 A1ITN

InChI=1S/C20H26N6O/c1-13(2)27-16-6-4-14(5-7-16)18-17-19(21)22-12-23-20(17)26(24-18)15-8-10-25(3)11-9-15/h4-7,12-13,15H,8-11H2,1-3H3,(H2,21,22,23)

CC(C)Oc1ccc(cc1)c2c3c(ncnc3n(n2)C4CCN(CC4)C)N
Non polymer #3 MG

InChI=1S/Mg/q+2

[Mg+2]
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Reference