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Structure of PDB 8fhe Chain B Binding Site BS02

Receptor Information >8fhe Chain B (length=262) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure] QLNPESADLRALAKHLYDSYIKSFPLTKAKARAILTGKTTDKSPFVIYDM NSLMMGEDKKEVAIRIFQGCQFRSVEAVQEITEYAKSIPGFVNLDLNDQV TLLKYGVHEIIYTMLASLMNKDGVLISEGQGFMTREFLKSLRKPFGDFME PKFEFAVKFNALELDDSDLAIFIAVIILSGDRPGLLNVKPIEDIQDNLLQ ALELQLKLNHPESSQLFAKLLQKMTDLRQIVTEHVQLLQVIKKTETDMSL HPLLQEIYKDLY

Ligand information Ligand ID GW9 InChI InChI=1S/C13H9ClN2O3/c14-12-7-6-10(16(18)19)8-11(12)13(17)15-9-4-2-1-3-5-9/h1-8H,(H,15,17) InChIKey DNTSIBUQMRRYIU-UHFFFAOYSA-N SMILES Software SMILES CACTVS 3.341 [O-][N+](=O)c1ccc(Cl)c(c1)C(=O)Nc2ccccc2 OpenEye OEToolkits 1.5.0 c1ccc(cc1)NC(=O)c2cc(ccc2Cl)[N+](=O)[O-] ACDLabs 10.04 O=C(c1cc(ccc1Cl)[N+]([O-])=O)Nc2ccccc2 Formula C13 H9 Cl N2 O3 Name 2-chloro-5-nitro-N-phenylbenzamide ChEMBL CHEMBL375270 DrugBank DB07863 ZINC ZINC000000039173 PDB chain 8fhe Chain B Residue 501 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

Receptor-Ligand Complex Structure Global view Local view Structure summary [Spin on] [Spin off] [Reset] [High quality] [Low quality] [White background] [Black background] [Spin on] [Spin off] [Reset] [High quality] [Low quality] [White background] [Black background] PDB 8fhe Crystal structure of PPARgamma ligand-binding domain in complex with N-CoR peptide and GW9662 Resolution 1.8 Å Binding residue (original residue number in PDB) F282 C285 Q286 H323 F363 K367 H449 Y473 L476 Y477 Binding residue (residue number reindexed from 1) F67 C70 Q71 H108 F148 K152 H234 Y258 L261 Y262 Annotation score 1

Enzymatic activity Enzyme Commision number ?

Gene Ontology Molecular Function GO:0003677 DNA binding GO:0004879 nuclear receptor activity

	Biological Process
GO:0006355	regulation of DNA-templated transcription

	Cellular Component
GO:0005634	nucleus

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