2025-10-04_00000082
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ligand
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9GW8
Human PPAR-gamma ligand binding domain in complex with LW75;
X-ray diffraction 2.20Å
Protein #1
275 residues (96% resolved)
Raw Sequence ...
GSHMESADLRALAKHLYDSYIKSFPLTKAKARAILTGKTTDKSPFVIYDMNSLMMGEDKIKFKHITPLQEQSKEVAIRIFQGCQFRSVEAVQEITEYAKSIPGFVNLDLNDQVTLLKYGVHEIIYTMLASLMNKDGVLISEGQGFMTREFLKSLRKPFGDFMEPKFEFAVKFNALELDDSDLAIFIAVIILSGDRPGLLNVKPIEDIQDNLLQALELQLKLNHPESSQLFAKLLQKMTDLRQIVTEHVQLLQVIKKTETDMSLHPLLQEIYKDLY
Canonical Sequence ...
GSHMESADLRALAKHLYDSYIKSFPLTKAKARAILTGKTTDKSPFVIYDMNSLMMGEDKIKFKHITPLQEQSKEVAIRIFQGCQFRSVEAVQEITEYAKSIPGFVNLDLNDQVTLLKYGVHEIIYTMLASLMNKDGVLISEGQGFMTREFLKSLRKPFGDFMEPKFEFAVKFNALELDDSDLAIFIAVIILSGDRPGLLNVKPIEDIQDNLLQALELQLKLNHPESSQLFAKLLQKMTDLRQIVTEHVQLLQVIKKTETDMSLHPLLQEIYKDLY
Non polymer #2
A1IRG
InChI=1S/C30H17Cl2F3N2O6/c31-17-8-10-22-19(12-17)26(36-37(22)28(38)25-20(30(33,34)35)4-2-5-21(25)32)18-9-7-15(29(39)40)11-24(18)41-13-16-3-1-6-23-27(16)43-14-42-23/h1-12H,13-14H2,(H,39,40)
InChI=1S/C30H17Cl2F3N2O6/c31-17-8-10-22-19(12-17)26(36-37(22)28(38)25-20(30(33,34)35)4-2-5-21(25)32)18-9-7-15(29(39)40)11-24(18)41-13-16-3-1-6-23-27(16)43-14-42-23/h1-12H,13-14H2,(H,39,40)
SMILES: c1cc(c2c(c1)OCO2)COc3cc(ccc3c4c5cc(ccc5n(n4)C(=O)c6c(cccc6Cl)C(F)(F)F)Cl)C(=O)O
c1cc(c2c(c1)OCO2)COc3cc(ccc3c4c5cc(ccc5n(n4)C(=O)c6c(cccc6Cl)C(F)(F)F)Cl)C(=O)O
Biounit #1
homo-dimer
Download coordinates
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Model
Reference
100%