6W3E

Structure of phosphorylated IRE1 in complex with G-0701

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)	Serine/threonine-protein kinase/endoribonuclease IRE1	polymer	431	49543.2	2	UniProt (O75460) Pfam (PF00069) Pfam (PF06479)	Homo sapiens (Human)	Endoplasmic reticulum-to-nucleus signaling 1,Inositol-requiring protein 1,hIRE1p,Ire1-alpha,IRE1a
2	C, D (A, B)	methyl ~{N}-[6-methyl-5-[3-[2-[[(3~{S})-piperidin-3-yl]amino]pyrimidin-4-yl]pyridin-2-yl]oxy-naphthalen-1-yl]carbamate	non-polymer		484.6	2	Chemie (SJV)

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	99086.4
Non-Polymers*	Number of molecules	2
	Total formula weight	969.1
All*	Total formula weight	100055.5

*Water molecules are not included.