2026-04-04_00000350
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ligand
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9Y8O
Crystal structure of the Kelch domain of human KLHL12 with compound 9c;
X-ray diffraction 1.29Å
Protein #1
295 residues (97% resolved)
Raw Sequence ...
GSHMGSANEVLLVVGGFGSQQSPIDVVEKYDPKTQEWSFLPSITRKRRYVASVSLHDRIYVIGGYDGRSRLSSVECLDYTADEDGVWYSVAPMNVRRGLAGATTLGDMIYVSGGFDGSRRHTSMERYDPNIDQWSMLGDMQTAREGAGLVVASGVIYCLGGYDGLNILNSVEKYDPHTGHWTNVTPMATKRSGAGVALLNDHIYVVGGFDGTAHLSSVEAYNIRTDSWTTVTSMTTPRCYVGATVLRGRLYAIAGYDGNSLLSSIECYDPIIDSWEVVTSMGTQRCDAGVCVLRE
Canonical Sequence ...
GSHMGSANEVLLVVGGFGSQQSPIDVVEKYDPKTQEWSFLPSITRKRRYVASVSLHDRIYVIGGYDGRSRLSSVECLDYTADEDGVWYSVAPMNVRRGLAGATTLGDMIYVSGGFDGSRRHTSMERYDPNIDQWSMLGDMQTAREGAGLVVASGVIYCLGGYDGLNILNSVEKYDPHTGHWTNVTPMATKRSGAGVALLNDHIYVVGGFDGTAHLSSVEAYNIRTDSWTTVTSMTTPRCYVGATVLRGRLYAIAGYDGNSLLSSIECYDPIIDSWEVVTSMGTQRCDAGVCVLRE
Non polymer #2
A1CTM
InChI=1S/C24H20Cl2N4O3/c1-14-6-5-9-19-22(14)29-24(27)30(19)12-21(32)28-23-17(25)10-15(11-18(23)26)20(31)13-33-16-7-3-2-4-8-16/h2-11H,12-13H2,1H3,(H2,27,29)(H,28,32)
InChI=1S/C24H20Cl2N4O3/c1-14-6-5-9-19-22(14)29-24(27)30(19)12-21(32)28-23-17(25)10-15(11-18(23)26)20(31)13-33-16-7-3-2-4-8-16/h2-11H,12-13H2,1H3,(H2,27,29)(H,28,32)
SMILES: Cc1cccc2c1nc(n2CC(=O)Nc3c(cc(cc3Cl)C(=O)COc4ccccc4)Cl)N
Cc1cccc2c1nc(n2CC(=O)Nc3c(cc(cc3Cl)C(=O)COc4ccccc4)Cl)N
Biounit #1
monomer
Download coordinates
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Model
Reference
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