8PKX

Kelch domain of KEAP1 in complex with a ortho-dimethylbenzene linked cyclic peptide 11 (ortho-WRCNPETaEC).

Summary for 8PKX

Entry DOI	10.2210/pdb8pkx/pdb
Descriptor	Kelch-like ECH-associated protein 1, CP11, CHLORIDE ION, ... (9 entities in total)
Functional Keywords	peptide inhibitor, inhibitor complex, cyclic peptide, ubiquitin ligase, nrf2, protein binding
Biological source	Homo sapiens (human) More
Total number of polymer chains	3
Total formula weight	71604.84
Authors	Braun, M.B.,Bischof, L.,Hartmann, M.D. (deposition date: 2023-06-27, release date: 2023-11-15, Last modification date: 2023-12-13)
Primary citation	Fonseca Lopez, F.,Miao, J.,Damjanovic, J.,Bischof, L.,Braun, M.B.,Ling, Y.,Hartmann, M.D.,Lin, Y.S.,Kritzer, J.A. Computational Prediction of Cyclic Peptide Structural Ensembles and Application to the Design of Keap1 Binders. J.Chem.Inf.Model., 63:6925-6937, 2023 Cited by PubMed: 37917529 DOI: 10.1021/acs.jcim.3c01337 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.79 Å)

Structure validation