6RIM

Crystal structure of the catalytic domain of the Weissela oryzae botulinum like toxin

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, D, E... (A, B, C, D, E...)	Putative botulinum-like toxin Wo	polymer	498	57295.8	8	UniProt (A0A069CUU9)	Weissella oryzae	BoNT/Wo
2	I, K, M, O, Q... (A, B, C, D, E...)	ZINC ION	non-polymer		65.4	8	Chemie (ZN)
3	J, L, N, P, R... (A, B, C, D, E...)	CALCIUM ION	non-polymer		40.1	8	Chemie (CA)
4	AA, BA, CA, DA, EA... (C, D, E, F, G...)	water	water		18.0	3413	Chemie (HOH)

Sequence modifications

A, B, C, D, E, F, G, H: 2 - 476 (UniProt: A0A069CUU9)

PDB	External Database	Details
Mse -21	-	initiating methionine
Gly -20	-	expression tag
Ser -19	-	expression tag
Ser -18	-	expression tag
His -17	-	expression tag
His -16	-	expression tag
His -15	-	expression tag
His -14	-	expression tag
His -13	-	expression tag
His -12	-	expression tag
Ser -11	-	expression tag
Ser -10	-	expression tag
Gly -9	-	expression tag
Leu -8	-	expression tag
Val -7	-	expression tag
Pro -6	-	expression tag
Arg -5	-	expression tag
Gly -4	-	expression tag
Ser -3	-	expression tag
His -2	-	expression tag
Mse -1	-	expression tag
Ala 0	-	expression tag
Ser 1	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	8
	Total formula weight	458366.5
Non-Polymers*	Number of molecules	16
	Total formula weight	843.9
All*	Total formula weight	459210.4

*Water molecules are not included.