3OIB

Crystal structure of a putative ACYL-COA Dehydrogenase from mycobacterium smegmatis, Iodide soak

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	Acyl-CoA dehydrogenase	polymer	403	43179.6	2	UniProt (A0R3J1) Pfam (PF02771) Pfam (PF02770) Pfam (PF00441) Pfam (PF08028) In PDB	Mycobacterium smegmatis
2	A, B	SODIUM ION	non-polymer		23.0	2	Chemie (NA)
3	B, A, I	IODIDE ION	non-polymer		126.9	30	Chemie (IOD)
4	B, A	1,2-ETHANEDIOL	non-polymer		62.1	2	Chemie (EDO)
5	B, A	DIHYDROFLAVINE-ADENINE DINUCLEOTIDE	non-polymer		787.6	2	Chemie (FDA)
6		water	water		18.0	665	Chemie (HOH)

Sequence modifications

A, B: 22 - 403 (UniProt: A0R3J1)

PDB	External Database	Details
Met 1	-	expression tag
Ala 2	-	expression tag
His 3	-	expression tag
His 4	-	expression tag
His 5	-	expression tag
His 6	-	expression tag
His 7	-	expression tag
His 8	-	expression tag
Met 9	-	expression tag
Gly 10	-	expression tag
Thr 11	-	expression tag
Leu 12	-	expression tag
Glu 13	-	expression tag
Ala 14	-	expression tag
Gln 15	-	expression tag
Thr 16	-	expression tag
Gln 17	-	expression tag
Gly 18	-	expression tag
Pro 19	-	expression tag
Gly 20	-	expression tag
Ser 21	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	86359.2
Non-Polymers*	Number of molecules	36
	Total formula weight	5552.4
All*	Total formula weight	91911.5

*Water molecules are not included.