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

PDB ID: 5I96
Gene source organism: Homo sapiens
Expression organism: Spodoptera frugiperda Deposition date: 2016-02-19
Classification: OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR
Keywords: IDH, IDH2, enasidenib, AG-221, IDH2 AG-221, ICD-M, IDP NADP(+)-specific ICDH Oxalosuccinate decarboxylase, OXIDOREDUCTASE-OXIDOREDUCTASE INHIBITOR complex
Technique: X-RAY DIFFRACTION
Assembly: 1
Resolution: 1.55
R-value: 0.1632
Metal site idBound amino acidsBound ligands IDs
5I96-CA-1 D2S1 ASP A.314 ASP B.291 HOH A.603 HOH A.605 HOH A.830 HOH A.932 SER A.317
5I96-CA-2 D3 ASP A.291 ASP B.314 ASP B.318 HOH B.705 HOH B.720 HOH B.782