2026-04-04_00000356
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ligand
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9Y8V
Crystal structure of the Kelch domain of human KLHL12 with compound 10q;
X-ray diffraction 1.27Å
Protein #1
295 residues (97% resolved)
Raw Sequence ...
GSHMGSANEVLLVVGGFGSQQSPIDVVEKYDPKTQEWSFLPSITRKRRYVASVSLHDRIYVIGGYDGRSRLSSVECLDYTADEDGVWYSVAPMNVRRGLAGATTLGDMIYVSGGFDGSRRHTSMERYDPNIDQWSMLGDMQTAREGAGLVVASGVIYCLGGYDGLNILNSVEKYDPHTGHWTNVTPMATKRSGAGVALLNDHIYVVGGFDGTAHLSSVEAYNIRTDSWTTVTSMTTPRCYVGATVLRGRLYAIAGYDGNSLLSSIECYDPIIDSWEVVTSMGTQRCDAGVCVLRE
Canonical Sequence ...
GSHMGSANEVLLVVGGFGSQQSPIDVVEKYDPKTQEWSFLPSITRKRRYVASVSLHDRIYVIGGYDGRSRLSSVECLDYTADEDGVWYSVAPMNVRRGLAGATTLGDMIYVSGGFDGSRRHTSMERYDPNIDQWSMLGDMQTAREGAGLVVASGVIYCLGGYDGLNILNSVEKYDPHTGHWTNVTPMATKRSGAGVALLNDHIYVVGGFDGTAHLSSVEAYNIRTDSWTTVTSMTTPRCYVGATVLRGRLYAIAGYDGNSLLSSIECYDPIIDSWEVVTSMGTQRCDAGVCVLRE
Non polymer #2
A1CTF
InChI=1S/C28H32Cl3N5O3S/c1-17-32-27-21(22-11-18(22)14-34-6-5-20(15-34)35-7-9-40(38,39)10-8-35)3-2-4-25(27)36(17)16-26(37)33-28-23(30)12-19(29)13-24(28)31/h2-4,12-13,18,20,22H,5-11,14-16H2,1H3,(H,33,37)/t18-,20+,22-/m1/s1
InChI=1S/C28H32Cl3N5O3S/c1-17-32-27-21(22-11-18(22)14-34-6-5-20(15-34)35-7-9-40(38,39)10-8-35)3-2-4-25(27)36(17)16-26(37)33-28-23(30)12-19(29)13-24(28)31/h2-4,12-13,18,20,22H,5-11,14-16H2,1H3,(H,33,37)/t18-,20+,22-/m1/s1
SMILES: Cc1nc2c(cccc2n1CC(=O)Nc3c(cc(cc3Cl)Cl)Cl)[C@@H]4C[C@@H]4CN5CC[C@@H](C5)N6CCS(=O)(=O)CC6
Cc1nc2c(cccc2n1CC(=O)Nc3c(cc(cc3Cl)Cl)Cl)[C@@H]4C[C@@H]4CN5CC[C@@H](C5)N6CCS(=O)(=O)CC6
Biounit #1
monomer
Download coordinates
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Model
Reference
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