3OQ1

Crystal Structure of 11beta-Hydroxysteroid Dehydrogenase-1 (11b-HSD1) in Complex with Diarylsulfone Inhibitor

Summary for 3OQ1

• Entry DOI: 10.2210/pdb3oq1/pdb
• Descriptor: Corticosteroid 11-beta-dehydrogenase isozyme 1, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 3-(2-fluoroethyl)-4-({4-[(2S)-1,1,1-trifluoro-2-hydroxypropan-2-yl]phenyl}sulfonyl)benzonitrile, ... (4 entities in total)
• Functional Keywords: oxidoreductase, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor
• Biological source: Homo sapiens (human)
• Cellular location: Endoplasmic reticulum membrane; Single-pass type II membrane protein: P28845
• Total number of polymer chains: 4
• Total formula weight: 131926.62

Authors

Wang, Z.,Sudom, A.,Walker, N.P. (deposition date: 2010-09-02, release date: 2011-07-20, Last modification date: 2024-02-21)

• Primary citation: Yan, X.,Wang, Z.,Sudom, A.,Cardozo, M.,DeGraffenreid, M.,Di, Y.,Fan, P.,He, X.,Jaen, J.C.,Labelle, M.,Liu, J.,Ma, J.,McMinn, D.,Miao, S.,Sun, D.,Tang, L.,Tu, H.,Ursu, S.,Walker, N.,Ye, Q.,Powers, J.P.; The synthesis and SAR of novel diarylsulfone 11beta-HSD1 inhibitors; Bioorg.Med.Chem.Lett., 20:7071-7075, 2010; PubMed: 20971000; DOI: 10.1016/j.bmcl.2010.09.097

Experimental method

X-RAY DIFFRACTION (2.6 Å)