2025-10-04_00000084
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ligand
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9GWB
Human PPAR-gamma ligand binding domain in complex with LW69;
X-ray diffraction 2.20Å
Protein #1
275 residues (96% resolved)
Raw Sequence ...
GSHMESADLRALAKHLYDSYIKSFPLTKAKARAILTGKTTDKSPFVIYDMNSLMMGEDKIKFKHITPLQEQSKEVAIRIFQGCQFRSVEAVQEITEYAKSIPGFVNLDLNDQVTLLKYGVHEIIYTMLASLMNKDGVLISEGQGFMTREFLKSLRKPFGDFMEPKFEFAVKFNALELDDSDLAIFIAVIILSGDRPGLLNVKPIEDIQDNLLQALELQLKLNHPESSQLFAKLLQKMTDLRQIVTEHVQLLQVIKKTETDMSLHPLLQEIYKDLY
Canonical Sequence ...
GSHMESADLRALAKHLYDSYIKSFPLTKAKARAILTGKTTDKSPFVIYDMNSLMMGEDKIKFKHITPLQEQSKEVAIRIFQGCQFRSVEAVQEITEYAKSIPGFVNLDLNDQVTLLKYGVHEIIYTMLASLMNKDGVLISEGQGFMTREFLKSLRKPFGDFMEPKFEFAVKFNALELDDSDLAIFIAVIILSGDRPGLLNVKPIEDIQDNLLQALELQLKLNHPESSQLFAKLLQKMTDLRQIVTEHVQLLQVIKKTETDMSLHPLLQEIYKDLY
Non polymer #2
A1IPZ
InChI=1S/C28H21Cl2F3N2O5/c29-17-5-7-22-19(13-17)25(34-35(22)26(36)24-20(28(31,32)33)2-1-3-21(24)30)18-6-4-16(27(37)38)12-23(18)40-14-15-8-10-39-11-9-15/h1-7,12-13,15H,8-11,14H2,(H,37,38)
InChI=1S/C28H21Cl2F3N2O5/c29-17-5-7-22-19(13-17)25(34-35(22)26(36)24-20(28(31,32)33)2-1-3-21(24)30)18-6-4-16(27(37)38)12-23(18)40-14-15-8-10-39-11-9-15/h1-7,12-13,15H,8-11,14H2,(H,37,38)
SMILES: c1cc(c(c(c1)Cl)C(=O)n2c3ccc(cc3c(n2)c4ccc(cc4OCC5CCOCC5)C(=O)O)Cl)C(F)(F)F
c1cc(c(c(c1)Cl)C(=O)n2c3ccc(cc3c(n2)c4ccc(cc4OCC5CCOCC5)C(=O)O)Cl)C(F)(F)F
Biounit #1
homo-dimer
Download coordinates
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Model
Reference
100%