7I91

Crystal Structure of 13 bound to the PH domain of Btk

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 (A, B, C, D)	Tyrosine-protein kinase BTK	polymer	169	19966.9	4	UniProt (Q06187)	Homo sapiens (human)	Agammaglobulinemia tyrosine kinase,ATK,B-cell progenitor kinase,BPK,Bruton tyrosine kinase
2	E, H, J (A, B, C)	(6~{R})-6-(1-oxidanylpyridin-2-yl)-4,5,6,7-tetrahydro-1-benzofuran-3-carboxylic acid	non-polymer		260.3	3	Chemie (A1B6S)
3	F, I, K, M (A, B, C, D)	ZINC ION	non-polymer		65.4	4	Chemie (ZN) PubChem (32051)
4	G, L, N (A, C, D)	MAGNESIUM ION	non-polymer		24.3	3	Chemie (MG) PubChem (888)
5	O, P, Q, R (A, B, C, D)	water	water		18.0	200	Chemie (HOH)

Sequence modifications

A, B, C, D: 2 - 170 (UniProt: Q06187)

PDB	External Database	Details
Ser 145	Cys 145	conflict

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	79867.8
Non-Polymers*	Number of molecules	10
	Total formula weight	1115.3
All*	Total formula weight	80983.1

*Water molecules are not included.