8EQZ

Crystal structure of pregnane X receptor ligand binding domain complexed with T0901317 analog T0-C6

Summary for 8EQZ

Entry DOI	10.2210/pdb8eqz/pdb
Related	8E3N
Descriptor	Nuclear receptor subfamily 1 group I member 2, N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-N-hexylbenzenesulfonamide (3 entities in total)
Functional Keywords	nuclear receptor, transcription factor, metabolism, antibiotic, transcription
Biological source	Homo sapiens (human)
Total number of polymer chains	2
Total formula weight	81651.42
Authors	Huber, A.D.,Poudel, S.,Seetharaman, J.,Miller, D.J.,Lin, W.,Li, Y.,Chen, T. (deposition date: 2022-10-11, release date: 2023-03-15, Last modification date: 2023-10-25)
Primary citation	Lin, W.,Huber, A.D.,Poudel, S.,Li, Y.,Seetharaman, J.,Miller, D.J.,Chen, T. Structure-guided approach to modulate small molecule binding to a promiscuous ligand-activated protein. Proc.Natl.Acad.Sci.USA, 120:e2217804120-e2217804120, 2023 Cited by PubMed: 36848571 DOI: 10.1073/pnas.2217804120 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.37 Å)

Structure validation