6HKQ

Human GPX4 in complex with covalent Inhibitor ML162 (S enantiomer)

Summary for 6HKQ

• Entry DOI: 10.2210/pdb6hkq/pdb
• Related: 6HN3
• Descriptor: Phospholipid hydroperoxide glutathione peroxidase, (2~{S})-2-[2-chloranylethanoyl-(3-chloranyl-4-methoxy-phenyl)amino]-~{N}-(2-phenylethyl)-2-thiophen-2-yl-ethanamide, SULFATE ION, ... (6 entities in total)
• Functional Keywords: anti-oxidatve defense system, covalent inhibitor, oxidoreductase
• Biological source: Homo sapiens (human)
• Total number of polymer chains: 1
• Total formula weight: 21158.03

Authors

Hillig, R.C.,Moosmayer, D.,Hilpmann, A.,Hoffmann, L.,Schnirch, L.,Eaton, J.K.,Badock, V.,Gradl, S. (deposition date: 2018-09-07, release date: 2020-04-01, Last modification date: 2022-12-07)

• Primary citation: Moosmayer, D.,Hilpmann, A.,Hoffmann, J.,Schnirch, L.,Zimmermann, K.,Badock, V.,Furst, L.,Eaton, J.K.,Viswanathan, V.S.,Schreiber, S.L.,Gradl, S.,Hillig, R.C.; Crystal structures of the selenoprotein glutathione peroxidase 4 in its apo form and in complex with the covalently bound inhibitor ML162.; Acta Crystallogr D Struct Biol, 77:237-248, 2021; PubMed: 33559612; DOI: 10.1107/S2059798320016125

Experimental method

X-RAY DIFFRACTION (1.54 Å)