6JTU

Crystal structure of MHETase from Ideonella sakaiensis

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 (A, B, C)	Mono(2-hydroxyethyl) terephthalate hydrolase	polymer	613	64178.0	3	UniProt (A0A0K8P8E7) Pfam (PF07519)	Ideonella sakaiensis	MHETase
2	D, J, R (A, B, C)	CALCIUM ION	non-polymer		40.1	3	Chemie (CA)
3	E, K, L, M, N... (A, B, C)	GLYCEROL	non-polymer		92.1	10	Chemie (GOL)
4	F, Q, V (A, B, C)	ACETATE ION	non-polymer		59.0	3	Chemie (ACT)
5	G (A)	FORMIC ACID	non-polymer		46.0	1	Chemie (FMT)
6	H, I (A)	1,2-ETHANEDIOL	non-polymer		62.1	2	Chemie (EDO)
7	W, X, Y (A, B, C)	water	water		18.0	718	Chemie (HOH)

Sequence modifications

A, B, C: 17 - 603 (UniProt: A0A0K8P8E7)

PDB	External Database	Details
Met -9	-	initiating methionine
Met -8	-	expression tag
Ile -7	-	expression tag
Thr -6	-	expression tag
Leu -5	-	expression tag
Arg -4	-	expression tag
Lys -3	-	expression tag
Leu -2	-	expression tag
Pro -1	-	expression tag
Leu 0	-	expression tag
Ala 1	-	expression tag
Val 2	-	expression tag
Ala 3	-	expression tag
Val 4	-	expression tag
Ala 5	-	expression tag
Ala 6	-	expression tag
Gly 7	-	expression tag
Val 8	-	expression tag
Met 9	-	expression tag
Ser 10	-	expression tag
Ala 11	-	expression tag
Gln 12	-	expression tag
Ala 13	-	expression tag
Met 14	-	expression tag
Ala 15	-	expression tag
Met 16	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	3
	Total formula weight	192534.0
Non-Polymers*	Number of molecules	19
	Total formula weight	1388.5
All*	Total formula weight	193922.5

*Water molecules are not included.