5TIF

x-ray structure of acyl-CoA thioesterase I, TesA, triple mutant M141L/Y145K/L146K in complex with octanoic acid

Summary for 5TIF

Entry DOI	10.2210/pdb5tif/pdb
Related	5TIC 5tid 5tie
Descriptor	Acyl-CoA thioesterase I, OCTANOIC ACID (CAPRYLIC ACID), DI(HYDROXYETHYL)ETHER, ... (4 entities in total)
Functional Keywords	thioesterase, tesa, fatty acid, octanoic acid, hydrolase
Biological source	Escherichia coli
Total number of polymer chains	1
Total formula weight	20935.86
Authors	Thoden, J.B.,Holden, H.M.,Grisewood, M.J.,Hernandez Lozada, N.J.,Gifford, N.P.,Mendez-Perez, D.,Schoenberger, H.A.,Allan, M.F.,Pfleger, B.F.,Marines, C.D. (deposition date: 2016-10-02, release date: 2017-04-26, Last modification date: 2023-10-04)
Primary citation	Grisewood, M.J.,Hernandez Lozada, N.J.,Thoden, J.B.,Gifford, N.P.,Mendez-Perez, D.,Schoenberger, H.A.,Allan, M.F.,Floy, M.E.,Lai, R.Y.,Holden, H.M.,Pfleger, B.F.,Maranas, C.D. Computational Redesign of Acyl-ACP Thioesterase with Improved Selectivity toward Medium-Chain-Length Fatty Acids. ACS Catal, 7:3837-3849, 2017 Cited by PubMed: 29375928 DOI: 10.1021/acscatal.7b00408 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (0.97 Å)

Structure validation