3NZU

Structure-based Optimization of Pyrazolo -Pyrimidine and -Pyridine Inhibitors of PI3-Kinase

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit gamma isoform	polymer	954	109381.6	1	UniProt (P48736) Pfam (PF00794) Pfam (PF00792) Pfam (PF00613) Pfam (PF00454) In PDB	Homo sapiens (human)	PtdIns-3-kinase subunit gamma, PI3-kinase subunit gamma, PI3K-gamma, Phosphatidylinositol-4,5-bisphosphate 3-kinase 110 kDa catalytic subunit gamma, PtdIns-3-kinase subunit p110-gamma, p120-PI3K
2	A	6-(2H-indazol-4-yl)-1-methyl-N-[3-(methylsulfonyl)propyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine	non-polymer		385.4	1	Chemie (NZU)

Sequence modifications

A: 147 - 1094 (UniProt: P48736)

PDB	External Database	Details
His 1095	-	expression tag
His 1096	-	expression tag
His 1097	-	expression tag
His 1098	-	expression tag
His 1099	-	expression tag
His 1100	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	109381.6
Non-Polymers*	Number of molecules	1
	Total formula weight	385.4
All*	Total formula weight	109767.1

*Water molecules are not included.