8V9I

1-deoxy-D-xylulose 5-phosphate synthase (DXPS) from Deinococcus radiodurans with D-phenylalanine-derived triazole acetylphosphonate (D-PheTrAP) bound

This is a non-PDB format compatible entry.

Summary for 8V9I

• Entry DOI: 10.2210/pdb8v9i/pdb
• Descriptor: 1-deoxy-D-xylulose-5-phosphate synthase, 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-{(1S)-1-[(S)-(2-{1-[(1R)-1-carboxy-2-phenylethyl]-1H-1,2,3-triazol-4-yl}ethoxy)(hydroxy)phosphoryl]-1-hydroxyethyl}-5-(2-{[(S)-hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium, MAGNESIUM ION, ... (6 entities in total)
• Functional Keywords: 1-deoxy-d-xylulose 5-phosphate synthase, dxps, thiamine diphosphate, thiamine pyrophosphate, thdp, tpp, the mep pathway, transferase, transferase-inhibitor complex, transferase/inhibitor
• Biological source: Deinococcus radiodurans
• Total number of polymer chains: 2
• Total formula weight: 141843.93

Authors

Chen, P.Y.-T.,Drennan, C.L. (deposition date: 2023-12-08, release date: 2024-04-24)

• Primary citation: Coco, L.B.,Toci, E.M.,Chen, P.Y.,Drennan, C.L.,Freel Meyers, C.L.; Potent Inhibition of E. coli DXP Synthase by a gem -Diaryl Bisubstrate Analog.; Acs Infect Dis., 10:1312-1326, 2024; PubMed: 38513073; DOI: 10.1021/acsinfecdis.3c00734

Experimental method

X-RAY DIFFRACTION (1.981 Å)