4X4J

Structural and Functional Studies of BexE: Insights into Oxidation During BE-7585A Biosynthesis

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)	Putative oxygenase	polymer	507	53664.1	2	UniProt (D7RFJ3) Pfam (PF01494) Pfam (PF21274)	Amycolatopsis orientalis subsp. vinearia
2	C, D, F (A, B)	SULFATE ION	non-polymer		96.1	3	Chemie (SO4)
3	E, G (A, B)	FLAVIN-ADENINE DINUCLEOTIDE	non-polymer		785.5	2	Chemie (FAD)
4	H, I (A, B)	water	water		18.0	58	Chemie (HOH)

Sequence modifications

A, B: 1 - 487 (UniProt: D7RFJ3)

PDB	External Database	Details
Met -19	-	initiating methionine
Gly -18	-	expression tag
Ser -17	-	expression tag
Ser -16	-	expression tag
His -15	-	expression tag
His -14	-	expression tag
His -13	-	expression tag
His -12	-	expression tag
His -11	-	expression tag
His -10	-	expression tag
Ser -9	-	expression tag
Ser -8	-	expression tag
Gly -7	-	expression tag
Leu -6	-	expression tag
Val -5	-	expression tag
Pro -4	-	expression tag
Arg -3	-	expression tag
Gly -2	-	expression tag
Ser -1	-	expression tag
His 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	107328.2
Non-Polymers*	Number of molecules	5
	Total formula weight	1859.3
All*	Total formula weight	109187.5

*Water molecules are not included.