8W3W

Crystal structure of IRAK4 in complex with compound 4

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	A, B, C, D	Interleukin-1 receptor-associated kinase 4	polymer	323	36584.0	4	UniProt (Q9NWZ3) Pfam (PF07714) In PDB	Homo sapiens (human)	IRAK-4,Renal carcinoma antigen NY-REN-64
2	A, B, C, D	7-methoxy-1-{[(2S)-5-oxopyrrolidin-2-yl]methoxy}isoquinoline-6-carboxamide	non-polymer		315.3	4	Chemie (A1AFO)
3		water	water		18.0	596	Chemie (HOH)

Sequence modifications

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

PDB	External Database	Details
Met 138	-	initiating methionine
His 139	-	expression tag
His 140	-	expression tag
His 141	-	expression tag
His 142	-	expression tag
His 143	-	expression tag
His 144	-	expression tag
Gly 145	-	expression tag
Gly 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	4
	Total formula weight	146336.1
Non-Polymers*	Number of molecules	4
	Total formula weight	1261.3
All*	Total formula weight	147597.4

*Water molecules are not included.