2026-07-11_00000144|ligand|9RTP

Crystal structure of NUDT7 in complex with a novel inhibitor; X-ray diffraction 1.47Å
Protein #1 222 residues (84% resolved)

SMLDDAKARLRKYDIGGKYSHLPYNKYSVLLPLVAKEGKLHLLFTVRSEKLRRAPGEVCFPGGKRDPTDMDDAATALREAQEEVGLRPHQVEVVCCLVPCLIDTDTLITPFVGLIDHNFQAQPNPAEVKDVFLVPLAYFLHPQVHDQHYVTRLGHRFINHIFEYTNPEDGVTYQIKGMTANLAVLVAFIILEKKPTFEVQFNLNDVLASSEELFLKVHKKAT

SMLDDAKARLRKYDIGGKYSHLPYNKYSVLLPLVAKEGKLHLLFTVRSEKLRRAPGEVCFPGGKRDPTDMDDAATALREAQEEVGLRPHQVEVVCCLVPCLIDTDTLITPFVGLIDHNFQAQPNPAEVKDVFLVPLAYFLHPQVHDQHYVTRLGHRFINHIFEYTNPEDGVTYQIKGMTANLAVLVAFIILEKKPTFEVQFNLNDVLASSEELFLKVHKKAT
Non polymer #2 A1JJG

InChI=1S/C21H23ClN2O2/c1-14-8-9-16(11-19(14)20-7-4-10-24(20)15(2)25)12-21(26)23-18-6-3-5-17(22)13-18/h3,5-6,8-9,11,13,20H,4,7,10,12H2,1-2H3,(H,23,26)/t20-/m0/s1

Cc1ccc(cc1[C@@H]2CCCN2C(=O)C)CC(=O)Nc3cccc(c3)Cl
Non polymer #3 ACT

InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1

CC(=O)[O-]
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Reference