8AGK

Botulinum neurotoxin subtype A6 cell binding domain in complex with GD1a ganglioside

This is a non-PDB format compatible entry.

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	AAA	Bont/A1	polymer	433	50681.6	1	UniProt (C9WWY7) Pfam (PF07953) Pfam (PF07951) In PDB	Clostridium botulinum str. Iwanei E	Botulinum neurotoxin type A
2	BBB	N-acetyl-alpha-neuraminic acid-(2-3)-beta-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose-(1-4)-alpha-D-galactopyranose-(1-4)-alpha-D-glucopyranose	branched		998.9	1	In PDB
3	AAA	1,2-ETHANEDIOL	non-polymer		62.1	5	Chemie (EDO)
4	AAA	DI(HYDROXYETHYL)ETHER	non-polymer		106.1	3	Chemie (PEG)
5		water	water		18.0	197	Chemie (HOH)

Sequence modifications

AAA: 871 - 1296 (UniProt: C9WWY7)

PDB	External Database	Details
Met 864	-	initiating methionine
His 865	-	expression tag
His 866	-	expression tag
His 867	-	expression tag
His 868	-	expression tag
His 869	-	expression tag
His 870	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	50681.6
Branched	Number of molecules	1
	Total formula weight	998.9
Non-Polymers*	Number of molecules	8
	Total formula weight	628.7
All*	Total formula weight	52309.2

*Water molecules are not included.