4IXW

Halohydrin dehalogenase (HheC) bound to ethyl (2S)-oxiran-2-ylacetate

Summary for 4IXW

Entry DOI	10.2210/pdb4ixw/pdb
Related	4IXT 4IY1
Descriptor	Halohydrin dehalogenase, CHLORIDE ION, ethyl (2S)-oxiran-2-ylacetate, ... (4 entities in total)
Functional Keywords	thermostability, synergistic mutations, coupled mutations, proline-induced, backbone changes, enantioselectivity changes, directed evolution, protein engineering, short-chain dehydrogenase/reductase enzyme superfamily, cyanolysis, dehalogenase, atorvastatin synthesis, lyase
Biological source	Rhizobium radiobacter (Agrobacterium tumefaciens)
Total number of polymer chains	2
Total formula weight	56014.00
Authors	Floor, R.J.,Schallmey, M.,Hauer, B.,Breuer, M.,Jekel, P.A.,Wijma, H.J.,Dijkstra, B.W.,Janssen, D.B. (deposition date: 2013-01-28, release date: 2013-02-20, Last modification date: 2023-09-20)
Primary citation	Schallmey, M.,Floor, R.J.,Hauer, B.,Breuer, M.,Jekel, P.A.,Wijma, H.J.,Dijkstra, B.W.,Janssen, D.B. Biocatalytic and structural properties of a highly engineered halohydrin dehalogenase. Chembiochem, 14:870-881, 2013 Cited by PubMed: 23585096 DOI: 10.1002/cbic.201300005 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.47 Å)

Structure validation