7VWM

Crystal Structure of the Y53F/N55A/I116V mutant of LEH

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B, C, D (A, B, C, D)	Limonene-1,2-epoxide hydrolase	polymer	155	17290.4	4	UniProt (Q9ZAG3) Pfam (PF07858)	Rhodococcus erythropolis
2	E, J, K (A, C, D)	DI(HYDROXYETHYL)ETHER	non-polymer		106.1	3	Chemie (PEG)
3	F, H, I (A, B)	1,2-ETHANEDIOL	non-polymer		62.1	3	Chemie (EDO)
4	G, L (B, D)	GLYCEROL	non-polymer		92.1	2	Chemie (GOL)
5	M, N, O, P (A, B, C, D)	water	water		18.0	621	Chemie (HOH)

Sequence modifications

A, B, C, D: 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
Phe 53	Tyr 53	engineered mutation
Ala 55	Asn 55	engineered mutation
Val 116	Ile 116	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	69161.6
Non-Polymers*	Number of molecules	8
	Total formula weight	688.8
All*	Total formula weight	69850.4

*Water molecules are not included.