6PLG

Crystal structure of human PHGDH complexed with Compound 15

Summary for 6PLG

• Entry DOI: 10.2210/pdb6plg/pdb
• Descriptor: D-3-phosphoglycerate dehydrogenase, (2S)-(4-{3-[(4,5-dichloro-1-methyl-1H-indole-2-carbonyl)amino]oxetan-3-yl}phenyl)(pyridin-3-yl)acetic acid, D-MALATE (3 entities in total)
• Functional Keywords: dehydrogenase, serine metabolism, oxidoreductase, oxidoreductase-inhibitor complex, oxidoreductase/inhibitor
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 8
• Total formula weight: 273665.40

Authors

Olland, A.,Lakshminarasimhan, D.,White, A.,Suto, R.K. (deposition date: 2019-06-30, release date: 2019-07-24, Last modification date: 2019-09-04)

• Primary citation: Mullarky, E.,Xu, J.,Robin, A.D.,Huggins, D.J.,Jennings, A.,Noguchi, N.,Olland, A.,Lakshminarasimhan, D.,Miller, M.,Tomita, D.,Michino, M.,Su, T.,Zhang, G.,Stamford, A.W.,Meinke, P.T.,Kargman, S.,Cantley, L.C.; Inhibition of 3-phosphoglycerate dehydrogenase (PHGDH) by indole amides abrogates de novo serine synthesis in cancer cells.; Bioorg.Med.Chem.Lett., 29:2503-2510, 2019; PubMed: 31327531; DOI: 10.1016/j.bmcl.2019.07.011

Experimental method

X-RAY DIFFRACTION (2.93 Å)