6HKQ: Human GPX4 in complex with covalent Inhibitor ML162 (S enantiomer)

PDB ID: 6HKQDownload
MMDB ID: 185790
PDB Deposition Date: 2018/9/7
Updated in MMDB: 2025/12
Experimental Method:
x-ray diffraction
Resolution: 1.54  Å
Source Organism:
Similar Structures:
Biological Unit for 6HKQ: monomeric; determined by author and by software (PISA)
Molecular Components in 6HKQ
Label Count Molecule
Protein (1 molecule)
1
Phospholipid Hydroperoxide Glutathione Peroxidase
(Gene symbol: GPX4)
Molecule annotation
Chemicals and Non-standard biopolymers (5 molecules)
1
1
(2~{S})-2-[2-chloranylethanoyl-(3-chloranyl-4-methoxy-phenyl)amino]-~{N}-(2-phenylethyl)-2-thiophen-2-yl-ethanamide(2~{S})-2-[2-chloranylethanoyl-(3-chloranyl-4-methoxy-phenyl)amino]-~{N}-(2-phenylethyl)-2-thiophen-2-yl-ethanamide
2
1
SULFATE IONSULFATE ION
3
1
1,2-ETHANEDIOL1,2-ETHANEDIOL
4
2
DIMETHYL SULFOXIDEDIMETHYL SULFOXIDE
* Click molecule labels to explore molecular sequence information.
Citing MMDB
Madej T, Lanczycki CJ, Zhang D, Thiessen PA, Geer RC, Marchler-Bauer A, Bryant SH. " MMDB and VAST+: tracking structural similarities between macromolecular complexes. Nucleic Acids Res. 2014 Jan; 42(Database issue):D297-303