6ZEX

Keap1 kelch domain bound to a small molecule fragment

Summary for 6ZEX

Entry DOI	10.2210/pdb6zex/pdb
Descriptor	Kelch-like ECH-associated protein 1, DIMETHYL SULFOXIDE, 5-cyclopropyl-1-phenyl-pyrazole-4-carboxylic acid, ... (4 entities in total)
Functional Keywords	keap1, nrf2, oxidative stress, small molecule complex, peptide binding protein
Biological source	Mus musculus (House mouse)
Total number of polymer chains	1
Total formula weight	34059.34
Authors	Narayanan, D.,Bach, A.,Gajhede, M. (deposition date: 2020-06-16, release date: 2021-04-14, Last modification date: 2024-01-24)
Primary citation	Pallesen, J.S.,Narayanan, D.,Tran, K.T.,Solbak, S.M.O.,Marseglia, G.,Sorensen, L.M.E.,Hoj, L.J.,Munafo, F.,Carmona, R.M.C.,Garcia, A.D.,Desu, H.L.,Brambilla, R.,Johansen, T.N.,Popowicz, G.M.,Sattler, M.,Gajhede, M.,Bach, A. Deconstructing Noncovalent Kelch-like ECH-Associated Protein 1 (Keap1) Inhibitors into Fragments to Reconstruct New Potent Compounds. J.Med.Chem., 64:4623-4661, 2021 Cited by PubMed: 33818106 DOI: 10.1021/acs.jmedchem.0c02094 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.98 Å)

Structure validation