6BKH

BTK complex with compound 11

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Tyrosine-protein kinase BTK	polymer	287	33878.7	1	UniProt (Q06187) Pfam (PF07714)	Homo sapiens (Human)	Agammaglobulinemia tyrosine kinase,ATK,B-cell progenitor kinase,BPK,Bruton tyrosine kinase
2	B, C, D, E (A)	SULFATE ION	non-polymer		96.1	4	Chemie (SO4)
3	F (A)	N-[2-(hydroxymethyl)-3-{5-[(5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-yl)amino]-6-oxo-1,6-dihydropyridazin-3-yl}phenyl]-1-benzothiophene-2-carboxamide	non-polymer		527.6	1	Chemie (DVD)
4	G (A)	water	water		18.0	203	Chemie (HOH)

Sequence modifications

A: 393 - 657 (UniProt: Q06187)

PDB	External Database	Details
Met 392	-	initiating methionine
Asn 658	-	expression tag
Leu 659	-	expression tag
Tyr 660	-	expression tag
Phe 661	-	expression tag
Gln 662	-	expression tag
Gly 663	-	expression tag
Glu 664	-	expression tag
Glu 665	-	expression tag
Tyr 666	-	expression tag
Met 667	-	expression tag
Pro 668	-	expression tag
Thr 669	-	expression tag
Glu 670	-	expression tag
His 671	-	expression tag
His 672	-	expression tag
His 673	-	expression tag
His 674	-	expression tag
His 675	-	expression tag
His 676	-	expression tag
His 677	-	expression tag
His 678	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	33878.7
Non-Polymers*	Number of molecules	5
	Total formula weight	911.8
All*	Total formula weight	34790.6

*Water molecules are not included.