2026-04-04_00000351
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ligand
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9Y8Q
Crystal structure of the Kelch domain of human KLHL12 with compound 9e;
X-ray diffraction 1.20Å
Protein #1
295 residues (97% resolved)
Raw Sequence ...
GSHMGSANEVLLVVGGFGSQQSPIDVVEKYDPKTQEWSFLPSITRKRRYVASVSLHDRIYVIGGYDGRSRLSSVECLDYTADEDGVWYSVAPMNVRRGLAGATTLGDMIYVSGGFDGSRRHTSMERYDPNIDQWSMLGDMQTAREGAGLVVASGVIYCLGGYDGLNILNSVEKYDPHTGHWTNVTPMATKRSGAGVALLNDHIYVVGGFDGTAHLSSVEAYNIRTDSWTTVTSMTTPRCYVGATVLRGRLYAIAGYDGNSLLSSIECYDPIIDSWEVVTSMGTQRCDAGVCVLRE
Canonical Sequence ...
GSHMGSANEVLLVVGGFGSQQSPIDVVEKYDPKTQEWSFLPSITRKRRYVASVSLHDRIYVIGGYDGRSRLSSVECLDYTADEDGVWYSVAPMNVRRGLAGATTLGDMIYVSGGFDGSRRHTSMERYDPNIDQWSMLGDMQTAREGAGLVVASGVIYCLGGYDGLNILNSVEKYDPHTGHWTNVTPMATKRSGAGVALLNDHIYVVGGFDGTAHLSSVEAYNIRTDSWTTVTSMTTPRCYVGATVLRGRLYAIAGYDGNSLLSSIECYDPIIDSWEVVTSMGTQRCDAGVCVLRE
Non polymer #2
A1CTO
InChI=1S/C20H22Cl2N4O2/c1-11(2)28-10-13-7-14(21)19(15(22)8-13)24-17(27)9-26-16-6-4-5-12(3)18(16)25-20(26)23/h4-8,11H,9-10H2,1-3H3,(H2,23,25)(H,24,27)
InChI=1S/C20H22Cl2N4O2/c1-11(2)28-10-13-7-14(21)19(15(22)8-13)24-17(27)9-26-16-6-4-5-12(3)18(16)25-20(26)23/h4-8,11H,9-10H2,1-3H3,(H2,23,25)(H,24,27)
SMILES: Cc1cccc2c1nc(n2CC(=O)Nc3c(cc(cc3Cl)COC(C)C)Cl)N
Cc1cccc2c1nc(n2CC(=O)Nc3c(cc(cc3Cl)COC(C)C)Cl)N
Biounit #1
monomer
Download coordinates
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Model
Reference
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