7OF8

Keap1 kelch domain bound to a small molecule fragment

Summary for 7OF8

Entry DOI	10.2210/pdb7of8/pdb
Descriptor	Kelch-like ECH-associated protein 1, (2~{S})-2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoic acid (3 entities in total)
Functional Keywords	keap1, nrf2, oxidative stress, small molecule complex, maybridge, peptide binding protein
Biological source	Mus musculus (Mouse)
Total number of polymer chains	1
Total formula weight	33582.56
Authors	Narayanan, D.,Bach, A.,Gajhede, M. (deposition date: 2021-05-04, release date: 2022-11-02, Last modification date: 2024-01-31)
Primary citation	Narayanan, D.,Tran, K.T.,Pallesen, J.S.,Solbak, S.M.O.,Qin, Y.,Mukminova, E.,Luchini, M.,Vasilyeva, K.O.,Gonzalez Chichon, D.,Goutsiou, G.,Poulsen, C.,Haapanen, N.,Popowicz, G.M.,Sattler, M.,Olagnier, D.,Gajhede, M.,Bach, A. Development of Noncovalent Small-Molecule Keap1-Nrf2 Inhibitors by Fragment-Based Drug Discovery. J.Med.Chem., 65:14481-14526, 2022 Cited by PubMed: 36263945 DOI: 10.1021/acs.jmedchem.2c00830 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.78 Å)

Structure validation