2026-08-01_00000410
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ligand
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9YBW
ARID1B ARID bound to compound B-2 ((2M)-2'-(morpholin-4-yl)-6-oxo-4-(trifluoromethyl)-1,6-dihydro[2,3'-bipyridine]-5-carbonitrile);
X-ray diffraction 1.88Å
Protein #1
120 residues (83% resolved)
Raw Sequence ...
GGEKITKVYELGNEPERKLWVDRYLTFMEERGSPVSSLPAVGKKPLDLFRLYVCVKEIGGLAQVNKNKKWRELATNLNVGTSSSAASSLKKQYIQYLFAFECKIERGEEPPPEVFSTGDT
Canonical Sequence ...
GGEKITKVYELGNEPERKLWVDRYLTFMEERGSPVSSLPAVGKKPLDLFRLYVCVKEIGGLAQVNKNKKWRELATNLNVGTSSSAASSLKKQYIQYLFAFECKIERGEEPPPEVFSTGDT
Non polymer #2
A1CUA
InChI=1S/C16H13F3N4O2/c17-16(18,19)12-8-13(22-15(24)11(12)9-20)10-2-1-3-21-14(10)23-4-6-25-7-5-23/h1-3,8H,4-7H2,(H,22,24)
InChI=1S/C16H13F3N4O2/c17-16(18,19)12-8-13(22-15(24)11(12)9-20)10-2-1-3-21-14(10)23-4-6-25-7-5-23/h1-3,8H,4-7H2,(H,22,24)
SMILES: c1cc(c(nc1)N2CCOCC2)C3=CC(=C(C(=O)N3)C#N)C(F)(F)F
c1cc(c(nc1)N2CCOCC2)C3=CC(=C(C(=O)N3)C#N)C(F)(F)F
Non polymer #3
ACT
InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1
InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1
SMILES: CC(=O)[O-]
CC(=O)[O-]
Non polymer #4
ZN
InChI=1S/Zn/q+2
InChI=1S/Zn/q+2
SMILES: [Zn+2]
[Zn+2]
Biounit #1
monomer
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