8PKW
Kelch domain of KEAP1 in complex with a ortho-dimethylbenzene linked cyclic peptide 5 (ortho-WRCDPETaEC).
Summary for 8PKW
| Entry DOI | 10.2210/pdb8pkw/pdb |
| Descriptor | Kelch-like ECH-associated protein 1, CP5, SULFATE 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 | 71307.05 |
| 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: 37917529DOI: 10.1021/acs.jcim.3c01337 PDB entries with the same primary citation |
| Experimental method | X-RAY DIFFRACTION (1.54 Å) |
Structure validation
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