9RMF

Soluble epoxide hydrolase in complex with AK188

This is a non-PDB format compatible entry.

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)	Bifunctional epoxide hydrolase 2	polymer	367	41951.1	2	UniProt (P34913) Pfam (PF00561)	Homo sapiens (human)
2	C, D, E, F, G... (A, B)	1,2-ETHANEDIOL	non-polymer		62.1	12	Chemie (EDO)
3	J, P (A, B)	1-[4-(1-adamantyl)phenyl]-3-(1-ethanoylpiperidin-4-yl)urea	non-polymer		395.5	2	Chemie (A1JPF)
4	Q, R (A, B)	water	water		18.0	275	Chemie (HOH)

Sequence modifications

A, B: 25 - 358 (UniProt: P34913)

PDB	External Database	Details
Met 1	-	initiating methionine
Gly 2	-	expression tag
Ser 3	-	expression tag
Ser 4	-	expression tag
His 5	-	expression tag
His 6	-	expression tag
His 7	-	expression tag
His 8	-	expression tag
His 9	-	expression tag
His 10	-	expression tag
Ser 11	-	expression tag
Ser 12	-	expression tag
Gly 13	-	expression tag
Leu 14	-	expression tag
Val 15	-	expression tag
Pro 16	-	expression tag
Arg 17	-	expression tag
Gly 18	-	expression tag
Ser 19	-	expression tag
His 20	-	expression tag
Met 21	-	expression tag
Ala 22	-	expression tag
Ser 23	-	expression tag
Met 24	-	expression tag
Leu 359	-	expression tag
Leu 360	-	expression tag
Glu 361	-	expression tag
His 362	-	expression tag
His 363	-	expression tag
His 364	-	expression tag
His 365	-	expression tag
His 366	-	expression tag
His 367	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	83902.2
Non-Polymers*	Number of molecules	14
	Total formula weight	1535.9
All*	Total formula weight	85438.1

*Water molecules are not included.