8W0R

Human EBP complexed with compound 1

This is a non-PDB format compatible entry.

Summary for 8W0R

• Entry DOI: 10.2210/pdb8w0r/pdb
• EMDB information: 43712
• Descriptor: 3-beta-hydroxysteroid-Delta(8),Delta(7)-isomerase, 1-methyl-1'-[(oxan-4-yl)methyl]-5-(trifluoromethyl)spiro[indole-2,4'-piperidin]-3(1H)-one (2 entities in total)
• Functional Keywords: emopamil-binding protein isomerization protein structure complex, structural protein, isomerase-inhibitor complex, isomerase/inhibitor
• Biological source: Homo sapiens (human)
• Total number of polymer chains: 2
• Total formula weight: 55608.58

Authors

Sun, D.,Masureel, M. (deposition date: 2024-02-14, release date: 2024-06-19)

• Primary citation: Dorel, R.,Sun, D.,Carruthers, N.,Castanedo, G.M.,Ung, P.M.,Factor, D.C.,Li, T.,Baumann, H.,Janota, D.,Pang, J.,Salphati, L.,Meklemburg, R.,Korman, A.J.,Harper, H.E.,Stubblefield, S.,Payandeh, J.,McHugh, D.,Lang, B.T.,Tesar, P.J.,Dere, E.,Masureel, M.,Adams, D.J.,Volgraf, M.,Braun, M.G.; Discovery and Optimization of Selective Brain-Penetrant EBP Inhibitors that Enhance Oligodendrocyte Formation.; J.Med.Chem., 67:4819-4832, 2024; PubMed: 38470227; DOI: 10.1021/acs.jmedchem.3c02396

Experimental method

ELECTRON MICROSCOPY (2.8 Å)