2026-03-21_00000141
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ligand
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9QG3
Human PPAR-gamma ligand binding domain in complex with LW129;
X-ray diffraction 2.30Å
Protein #1
275 residues (95% resolved)
Raw Sequence ...
GSHMESADLRALAKHLYDSYIKSFPLTKAKARAILTGKTTDKSPFVIYDMNSLMMGEDKIKFKHITPLQEQSKEVAIRIFQGCQFRSVEAVQEITEYAKSIPGFVNLDLNDQVTLLKYGVHEIIYTMLASLMNKDGVLISEGQGFMTREFLKSLRKPFGDFMEPKFEFAVKFNALELDDSDLAIFIAVIILSGDRPGLLNVKPIEDIQDNLLQALELQLKLNHPESSQLFAKLLQKMTDLRQIVTEHVQLLQVIKKTETDMSLHPLLQEIYKDLY
Canonical Sequence ...
GSHMESADLRALAKHLYDSYIKSFPLTKAKARAILTGKTTDKSPFVIYDMNSLMMGEDKIKFKHITPLQEQSKEVAIRIFQGCQFRSVEAVQEITEYAKSIPGFVNLDLNDQVTLLKYGVHEIIYTMLASLMNKDGVLISEGQGFMTREFLKSLRKPFGDFMEPKFEFAVKFNALELDDSDLAIFIAVIILSGDRPGLLNVKPIEDIQDNLLQALELQLKLNHPESSQLFAKLLQKMTDLRQIVTEHVQLLQVIKKTETDMSLHPLLQEIYKDLY
Non polymer #2
A1I6T
InChI=1S/C29H16Cl2F4N2O4/c30-16-9-12-22-19(13-16)25(36-37(22)27(38)23-20(29(33,34)35)7-4-8-21(23)31)18-11-10-17(28(39)40)24(32)26(18)41-14-15-5-2-1-3-6-15/h1-13H,14H2,(H,39,40)
InChI=1S/C29H16Cl2F4N2O4/c30-16-9-12-22-19(13-16)25(36-37(22)27(38)23-20(29(33,34)35)7-4-8-21(23)31)18-11-10-17(28(39)40)24(32)26(18)41-14-15-5-2-1-3-6-15/h1-13H,14H2,(H,39,40)
SMILES: c1ccc(cc1)COc2c(ccc(c2F)C(=O)O)c3c4cc(ccc4n(n3)C(=O)c5c(cccc5Cl)C(F)(F)F)Cl
c1ccc(cc1)COc2c(ccc(c2F)C(=O)O)c3c4cc(ccc4n(n3)C(=O)c5c(cccc5Cl)C(F)(F)F)Cl
Biounit #1
homo-dimer
Download coordinates
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Model
Reference
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