5WIY
Kelch domain of human Keap1 bound to small molecule inhibitor fragment: 4-amino-1,7-dihydro-6H-pyrazolo[3,4-d]pyrimidine-6-thione
Summary for 5WIY
Entry DOI | 10.2210/pdb5wiy/pdb |
Descriptor | Kelch-like ECH-associated protein 1, SULFATE ION, 4-amino-1,7-dihydro-6H-pyrazolo[3,4-d]pyrimidine-6-thione, ... (4 entities in total) |
Functional Keywords | scaffold, inhibitor, fragment, transcription, transcription-inhibitor complex, transcription/inhibitor |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 2 |
Total formula weight | 74253.73 |
Authors | Carolan, J.P.,Lynch, A.J.,Allen, K.N. (deposition date: 2017-07-20, release date: 2018-09-26, Last modification date: 2023-10-04) |
Primary citation | Zhong, M.,Lynch, A.,Muellers, S.N.,Jehle, S.,Luo, L.,Hall, D.R.,Iwase, R.,Carolan, J.P.,Egbert, M.,Wakefield, A.,Streu, K.,Harvey, C.M.,Ortet, P.C.,Kozakov, D.,Vajda, S.,Allen, K.N.,Whitty, A. Interaction Energetics and Druggability of the Protein-Protein Interaction between Kelch-like ECH-Associated Protein 1 (KEAP1) and Nuclear Factor Erythroid 2 Like 2 (Nrf2). Biochemistry, 59:563-581, 2020 Cited by PubMed: 31851823DOI: 10.1021/acs.biochem.9b00943 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.23 Å) |
Structure validation
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