6VYA

Crystal structure of NotF in complex with brevianamide F and DMSPP

Summary for 6VYA

• Entry DOI: 10.2210/pdb6vya/pdb
• Descriptor: Deoxybrevianamide E synthase notF, (3S,8aS)-3-(1H-indol-3-ylmethyl)hexahydropyrrolo[1,2-a]pyrazine-1,4-dione, DIMETHYLALLYL S-THIOLODIPHOSPHATE (3 entities in total)
• Functional Keywords: fungal indole prenyltransferase, transferase
• Biological source: Aspergillus sp.
• Total number of polymer chains: 24
• Total formula weight: 1305064.66

Authors

Dan, Q.,Smith, J.L. (deposition date: 2020-02-25, release date: 2021-02-03, Last modification date: 2023-10-25)

• Primary citation: Kelly, S.P.,Shende, V.V.,Flynn, A.R.,Dan, Q.,Ye, Y.,Smith, J.L.,Tsukamoto, S.,Sigman, M.S.,Sherman, D.H.; Data Science-Driven Analysis of Substrate-Permissive Diketopiperazine Reverse Prenyltransferase NotF: Applications in Protein Engineering and Cascade Biocatalytic Synthesis of (-)-Eurotiumin A.; J.Am.Chem.Soc., 144:19326-19336, 2022; PubMed: 36223664; DOI: 10.1021/jacs.2c06631

Experimental method

X-RAY DIFFRACTION (3 Å)