8PNU

Cryo-EM structure of styrene oxide isomerase bound to benzylamine inhibitor

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, G, H... (G, H, I, A, B...)	Styrene oxide isomerase	polymer	183	19680.9	6	UniProt (O50216)	Pseudomonas sp. VLB120
2	D, E, F, J, K... (J, K, L, D, E...)	Nanobody	polymer	129	14055.5	6		Vicugna pacos
3	M, O, Q, S, U... (G, H, I, A, B...)	BENZYLAMINE	non-polymer		107.2	6	Chemie (ABN)
4	N, P, R, T, V... (H, I, B, C)	PROTOPORPHYRIN IX CONTAINING FE	non-polymer		616.5	6	Chemie (HEM)
5	AA, BA, CA, DA, EA... (I, J, K, L, A...)	water	water		18.0	264	Chemie (HOH)

Sequence modifications

G, H, I, A, B, C: 1 - 169 (UniProt: O50216)

PDB	External Database	Details
Met -13	-	initiating methionine
Gly -12	-	expression tag
Ser -11	-	expression tag
Ser -10	-	expression tag
His -9	-	expression tag
His -8	-	expression tag
His -7	-	expression tag
His -6	-	expression tag
His -5	-	expression tag
His -4	-	expression tag
Ser -3	-	expression tag
Gln -2	-	expression tag
Asp -1	-	expression tag
Pro 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	12
	Total formula weight	202418.0
Non-Polymers*	Number of molecules	12
	Total formula weight	4341.8
All*	Total formula weight	206759.9

*Water molecules are not included.