8QS0

Acyl-ACP thioesterase from Lemna paucicostata in complex with a spirolactam

This is a non-PDB format compatible entry.

Summary for 8QS0

• Entry DOI: 10.2210/pdb8qs0/pdb
• Related: 8P8K 8QRT
• Descriptor: Acyl-acp thioesterase, (5~{S})-9-[[2,6-bis(fluoranyl)phenyl]methyl]-3-(3-methylthiophen-2-yl)-1-oxa-2,9-diazaspiro[4.5]dec-2-en-10-one (3 entities in total)
• Functional Keywords: inhibitor, herbicide, hydrolase
• Biological source: Lemna aequinoctialis
• Total number of polymer chains: 4
• Total formula weight: 148018.70

Authors

Freigang, J. (deposition date: 2023-10-10, release date: 2024-02-21)

• Primary citation: Asmus, E.,Barber, D.M.,Bojack, G.,Bollenbach-Wahl, B.,Brown, R.W.,Doller, U.,Freigang, J.,Gatzweiler, E.,Getachew, R.,Heinemann, I.,Hohmann, S.,Ko, K.Y.,Laber, B.,Lange, G.,Mattison, R.L.,Minn, K.,Muller, T.,Petry, T.,Reingruber, A.M.,Schmutzler, D.,Svejda, A.,Frackenpohl, J.; Discovery and Optimization of Spirocyclic Lactams that Inhibit Acyl-ACP Thioesterase.; Pest Manag Sci, 2024; PubMed: 38334233; DOI: 10.1002/ps.8015

Experimental method

X-RAY DIFFRACTION (2.3 Å)