5YAO

The complex structure of SZ529 and expoxid

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (A, B)	Limonene-1,2-epoxide hydrolase	polymer	155	17319.3	2	UniProt (Q9ZAG3) Pfam (PF07858)	Rhodococcus erythropolis (Arthrobacter picolinophilus)
2	C (A)	(1R,5S)-6-oxabicyclo[3.1.0]hexane	non-polymer		84.1	1	Chemie (3ZS)
3	D, E (A, B)	SODIUM ION	non-polymer		23.0	2	Chemie (NA)
4	F, G (A, B)	water	water		18.0	24	Chemie (HOH)

Sequence modifications

A, B: 2 - 149 (UniProt: Q9ZAG3)

PDB	External Database	Details
Met -5	-	initiating methionine
His -4	-	expression tag
His -3	-	expression tag
His -2	-	expression tag
His -1	-	expression tag
His 0	-	expression tag
His 1	-	expression tag
Val 32	Met 32	engineered mutation
Val 78	Met 78	engineered mutation
Val 80	Ile 80	engineered mutation
Phe 114	Leu 114	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	34638.6
Non-Polymers*	Number of molecules	3
	Total formula weight	130.1
All*	Total formula weight	34768.7

*Water molecules are not included.