8SVS

Crystal structure of pregnane X receptor ligand binding domain in complex with SJPYT-328

Summary for 8SVS

• Entry DOI: 10.2210/pdb8svs/pdb
• Descriptor: Nuclear receptor subfamily 1 group I member 2, Nuclear receptor coactivator 1 fusion protein,Nuclear receptor coactivator 1, (1P)-N-(5-tert-butyl-2-{[(3S)-hexan-3-yl]oxy}phenyl)-1-(2,4-dimethoxy-5-methylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide (3 entities in total)
• Functional Keywords: pregnane x receptor (pxr), promiscuous ligand-activated protein, nuclear receptor subfamily 1, transcriptional regulator, drug metabolism, transcription
• Biological source: Homo sapiens (human); More
• Total number of polymer chains: 2
• Total formula weight: 80808.57

Authors

Garcia-Maldonado, E.,Huber, A.D.,Nithianantham, S.,Miller, D.J.,Chen, T. (deposition date: 2023-05-17, release date: 2024-05-15)

• Primary citation: Garcia-Maldonado, E.,Huber, A.D.,Chai, S.C.,Nithianantham, S.,Li, Y.,Wu, J.,Poudel, S.,Miller, D.J.,Seetharaman, J.,Chen, T.; Chemical manipulation of an activation/inhibition switch in the nuclear receptor PXR; Nat Commun, 2024

Experimental method

X-RAY DIFFRACTION (2.68 Å)