8AUN

OPR3 Y370F variant in complex with ethyl (Z)-2-(hydroxyimino)-3-oxobutanoate

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	12-oxophytodienoate reductase 3	polymer	404	44627.5	2	UniProt (Q9FEW9) Pfam (PF00724) In PDB	Solanum lycopersicum (tomato)	12-oxophytodienoate-10,11-reductase 3,OPDA-reductase 3,LeOPR3
2	A, B	FLAVIN MONONUCLEOTIDE	non-polymer		456.3	2	Chemie (FMN)
3	A, B	ethyl (2Z)-2-hydroxyimino-3-oxidanylidene-butanoate	non-polymer		159.1	2	Chemie (L9I)
4	A, B	1,2-ETHANEDIOL	non-polymer		62.1	7	Chemie (EDO)
5	A	TRIETHYLENE GLYCOL	non-polymer		150.2	1	Chemie (PGE)
6	B	DI(HYDROXYETHYL)ETHER	non-polymer		106.1	1	Chemie (PEG)
7		water	water		18.0	638	Chemie (HOH)

Sequence modifications

A, B: 1 - 396 (UniProt: Q9FEW9)

PDB	External Database	Details
Phe 370	Tyr 370	engineered mutation
Leu 397	-	expression tag
Glu 398	-	expression tag
His 399	-	expression tag
His 400	-	expression tag
His 401	-	expression tag
His 402	-	expression tag
His 403	-	expression tag
His 404	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	89254.9
Non-Polymers*	Number of molecules	13
	Total formula weight	1921.7
All*	Total formula weight	91176.7

*Water molecules are not included.