6F3I

IRAK4 IN COMPLEX WITH 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 (A, B)	Interleukin-1 receptor-associated kinase 4	polymer	322	36528.1	2	UniProt (Q9NWZ3) Pfam (PF07714)	Homo sapiens (Human)	IRAK-4,Renal carcinoma antigen NY-REN-64
2	C, E (A, B)	(3~{R})-3-[4-[[4-(4-ethanoylpiperazin-1-yl)cyclohexyl]amino]pyrrolo[2,1-f][1,2,4]triazin-5-yl]butanamide	non-polymer		427.5	2	Chemie (CKN)
3	D (B)	SULFATE ION	non-polymer		96.1	1	Chemie (SO4)
4	F, G (A, B)	water	water		18.0	111	Chemie (HOH)

Sequence modifications

A, B: 154 - 460 (UniProt: Q9NWZ3)

PDB	External Database	Details
Met 139	-	initiating methionine
His 140	-	expression tag
His 141	-	expression tag
His 142	-	expression tag
His 143	-	expression tag
His 144	-	expression tag
His 145	-	expression tag
His 146	-	expression tag
Glu 147	-	expression tag
Asn 148	-	expression tag
Leu 149	-	expression tag
Tyr 150	-	expression tag
Phe 151	-	expression tag
Gln 152	-	expression tag
Gly 153	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	73056.2
Non-Polymers*	Number of molecules	3
	Total formula weight	951.1
All*	Total formula weight	74007.3

*Water molecules are not included.