3WN4

Crystal structure of human TLR8 in complex with DS-877

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Toll-like receptor 8	polymer	811	92835.4	1	UniProt (Q9NR97) Pfam (PF13855)	Homo sapiens (human)
2	B (B)	alpha-D-mannopyranose-(1-3)-[alpha-D-mannopyranose-(2-6)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose	branched		910.8	1
3	C, D (C, D)	beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose	branched		586.5	2
4	E (A)	2-butylfuro[2,3-c]quinolin-4-amine	non-polymer		240.3	1	Chemie (D87)
5	F, G, H, I, J... (A)	2-acetamido-2-deoxy-beta-D-glucopyranose	non-polymer		221.2	9	Chemie (NAG)
6	O (A)	water	water		18.0	472	Chemie (HOH)

Sequence modifications

A: 27 - 827 (UniProt: Q9NR97)

PDB	External Database	Details
Arg 23	-	expression tag
Ser 24	-	expression tag
Pro 25	-	expression tag
Trp 26	-	expression tag
Glu 828	-	expression tag
Phe 829	-	expression tag
Leu 830	-	expression tag
Val 831	-	expression tag
Pro 832	-	expression tag
Arg 833	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	92835.4
Branched	Number of molecules	3
	Total formula weight	2083.9
Non-Polymers*	Number of molecules	10
	Total formula weight	2231.2
All*	Total formula weight	97150.4

*Water molecules are not included.