3CKE

Crystal structure of aristolochene synthase in complex with 12,13-difluorofarnesyl diphosphate

Summary for 3CKE

Entry DOI	10.2210/pdb3cke/pdb
Related	3BNX 3BNY
Descriptor	Aristolochene synthase, CHLORIDE ION, (2E,6E)-12-fluoro-11-(fluoromethyl)-3,7-dimethyldodeca-2,6,10-trien-1-yl trihydrogen diphosphate, ... (8 entities in total)
Functional Keywords	substrate binding, metal ion binding, catalysis, conformational changes, lyase
Biological source	Aspergillus terreus
Total number of polymer chains	4
Total formula weight	147858.16
Authors	Shishova, E.Y.,Yu, F.,Miller, D.J.,Faraldos, J.A.,Zhao, Y.,Coates, R.M.,Allemann, R.K.,Cane, D.E.,Christianson, D.W. (deposition date: 2008-03-14, release date: 2008-04-01, Last modification date: 2023-08-30)
Primary citation	Shishova, E.Y.,Yu, F.,Miller, D.J.,Faraldos, J.A.,Zhao, Y.,Coates, R.M.,Allemann, R.K.,Cane, D.E.,Christianson, D.W. X-ray Crystallographic Studies of Substrate Binding to Aristolochene Synthase Suggest a Metal Ion Binding Sequence for Catalysis. J.Biol.Chem., 283:15431-15439, 2008 Cited by PubMed: 18385128 DOI: 10.1074/jbc.M800659200 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.4 Å)

Structure validation