3GL0

Crystal structure of dicamba monooxygenase bound to 3,6 dichlorosalicylic acid (DCSA)

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	DdmC	polymer	349	38641.7	3	UniProt (Q5S3I3) Pfam (PF00355) Pfam (PF19112) In PDB	Stenotrophomonas maltophilia (Pseudomonas maltophilia)	dicamba monooxygenase
2	A, B, C	FE2/S2 (INORGANIC) CLUSTER	non-polymer		175.8	3	Chemie (FES)
3	A, B	FE (III) ION	non-polymer		55.8	2	Chemie (FE)
4	A, B	3,6-dichloro-2-hydroxybenzoic acid	non-polymer		207.0	2	Chemie (HXX)
5	A, B	OXYGEN MOLECULE	non-polymer		32.0	2	Chemie (OXY)
6	A, B, C	1,2-ETHANEDIOL	non-polymer		62.1	10	Chemie (EDO)
7		water	water		18.0	924	Chemie (HOH)

Sequence modifications

A, B, C: 3 - 340 (UniProt: Q5S3I3)

PDB	External Database	Details
Met 1	-	insertion
Ala 2	-	insertion
Arg 341	-	insertion
Leu 342	-	expression tag
Glu 343	-	expression tag
His 344	-	expression tag
His 345	-	expression tag
His 346	-	expression tag
His 347	-	expression tag
His 348	-	expression tag
His 349	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	3
	Total formula weight	115925.1
Non-Polymers*	Number of molecules	19
	Total formula weight	1737.8
All*	Total formula weight	117662.9

*Water molecules are not included.