4XMB

Crystal structure of 2,2'-(naphthalene-1,4-diylbis(((4-methoxyphenyl)sulfonyl)azanediyl))diacetamide bound to human Keap1 Kelch domain

Summary for 4XMB

Entry DOI	10.2210/pdb4xmb/pdb
Descriptor	Kelch-like ECH-associated protein 1, 2,2'-(naphthalene-1,4-diylbis(((4-methoxyphenyl)sulfonyl)azanediyl))diacetamide (3 entities in total)
Functional Keywords	nrf2 activators, cul3, cullin3, btb, protein binding
Biological source	Homo sapiens (Human)
Cellular location	Cytoplasm: Q14145
Total number of polymer chains	1
Total formula weight	32267.05
Authors	Luciano, J.P.,Ryuzoji, A.F.,Mesecar, A.D. (deposition date: 2015-01-14, release date: 2015-09-30, Last modification date: 2023-09-27)
Primary citation	Jain, A.D.,Potteti, H.,Richardson, B.G.,Kingsley, L.,Luciano, J.P.,Ryuzoji, A.F.,Lee, H.,Krunic, A.,Mesecar, A.D.,Reddy, S.P.,Moore, T.W. Probing the structural requirements of non-electrophilic naphthalene-based Nrf2 activators. Eur.J.Med.Chem., 103:252-268, 2015 Cited by PubMed: 26363505 DOI: 10.1016/j.ejmech.2015.08.049 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.428 Å)

Structure validation