8AUM

OPR3 Y190F variant in complex with ethyl (Z)-2-(hydroxyimino)-3-oxopentanoate

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 (2~{Z})-2-hydroxyimino-3-oxidanylidene-pentanoate	non-polymer		173.2	2	Chemie (O8I)
4	A	GLYCEROL	non-polymer		92.1	1	Chemie (GOL)
5	A	TETRAETHYLENE GLYCOL	non-polymer		194.2	2	Chemie (PG4)
6	A	DI(HYDROXYETHYL)ETHER	non-polymer		106.1	2	Chemie (PEG)
7		water	water		18.0	645	Chemie (HOH)

Sequence modifications

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

PDB	External Database	Details
Phe 190	Tyr 190	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	9
	Total formula weight	1951.8
All*	Total formula weight	91206.7

*Water molecules are not included.