5I96: Crystal Structure of Human Mitochondrial Isocitrate Dehydrogenase (IDH2) R140Q Mutant Homodimer in Complex with AG-221 (Enasidenib) Inhibitor

PDB ID: 5I96Download
MMDB ID: 147844
PDB Deposition Date: 2016/2/19
Updated in MMDB: 2023/10
Experimental Method:
x-ray diffraction
Resolution: 1.55  Å
Source Organism:
Similar Structures:
Biological Unit for 5I96: dimeric; determined by author and by software (PISA)
Molecular Components in 5I96
Label Count Molecule
Proteins (2 molecules)
2
Isocitrate Dehydrogenase [nadp], Mitochondrial
(Gene symbol: IDH2)
Molecule annotation
Chemicals and Non-standard biopolymers (14 molecules)
1
2
CALCIUM IONCALCIUM ION
2
5
GLYCEROLGLYCEROL
3
2
NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATENADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
4
2
SODIUM IONSODIUM ION
5
2
ACETATE IONACETATE ION
6
1
2-methyl-1-[(4-[6-(trifluoromethyl)pyridin-2-yl]-6-{[2-(trifluoromethyl)pyridin-4-yl]amino}-1,3,5-triazin-2-yl)amino]propan-2-ol2-methyl-1-[(4-[6-(trifluoromethyl)pyridin-2-yl]-6-{[2-(trifluoromethyl)pyridin-4-yl]amino}-1,3,5-triazin-2-yl)amino]propan-2-ol
* 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