7P58

Pyrazole Carboxylic Acid Inhibitors of KEAP1:NRF2 interaction

Summary for 7P58

Entry DOI	10.2210/pdb7p58/pdb
Descriptor	Kelch-like ECH-associated protein 1, DIMETHYL SULFOXIDE, CHLORIDE ION, ... (5 entities in total)
Functional Keywords	protein ubiquitination, protein-protein interaction, oxidative stress, protein binding
Biological source	Mus musculus (Mouse)
Total number of polymer chains	1
Total formula weight	35756.30
Authors	Davies, T.G. (deposition date: 2021-07-14, release date: 2021-11-17, Last modification date: 2021-11-24)
Primary citation	Norton, D.,Bonnette, W.G.,Callahan, J.F.,Carr, M.G.,Griffiths-Jones, C.M.,Heightman, T.D.,Kerns, J.K.,Nie, H.,Rich, S.J.,Richardson, C.,Rumsey, W.,Sanchez, Y.,Verdonk, M.L.,Willems, H.M.G.,Wixted, W.E.,Wolfe 3rd, L.,Woolford, A.J.,Wu, Z.,Davies, T.G. Fragment-Guided Discovery of Pyrazole Carboxylic Acid Inhibitors of the Kelch-like ECH-Associated Protein 1: Nuclear Factor Erythroid 2 Related Factor 2 (KEAP1:NRF2) Protein-Protein Interaction. J.Med.Chem., 64:15949-15972, 2021 Cited by PubMed: 34705450 DOI: 10.1021/acs.jmedchem.1c01351 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.886 Å)

Structure validation