6NW4

Evolution of a computationally designed Kemp eliminase

Summary for 6NW4

Entry DOI	10.2210/pdb6nw4/pdb
Descriptor	Indole-3-glycerol phosphate synthase, SULFATE ION, 6-NITROBENZOTRIAZOLE, ... (4 entities in total)
Functional Keywords	kemp elimination, evolution, biosynthetic protein
Biological source	Saccharolobus solfataricus (strain ATCC 35092 / DSM 1617 / JCM 11322 / P2) (Sulfolobus solfataricus)
Total number of polymer chains	1
Total formula weight	29072.30
Authors	Bunzel, A.,Mittl, P.,Hilvert, D. (deposition date: 2019-02-06, release date: 2019-07-24, Last modification date: 2024-01-24)
Primary citation	Bunzel, H.A.,Kries, H.,Marchetti, L.,Zeymer, C.,Mittl, P.R.E.,Mulholland, A.J.,Hilvert, D. Emergence of a Negative Activation Heat Capacity during Evolution of a Designed Enzyme. J.Am.Chem.Soc., 141:11745-11748, 2019 Cited by PubMed: 31282667 DOI: 10.1021/jacs.9b02731 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (3 Å)

Structure validation