5V82

PIM1 kinase in complex with Cpd17 (1-(6-(4,4-difluoropiperidin-3-yl)pyridin-2-yl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine)

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Serine/threonine-protein kinase pim-1	polymer	299	34447.1	1	UniProt (P11309) Pfam (PF00069) In PDB	Homo sapiens (Human)
2	A	1-{6-[(3R)-4,4-difluoropiperidin-3-yl]pyridin-2-yl}-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine	non-polymer		407.4	1	Chemie (96Y)
3		water	water		18.0	142	Chemie (HOH)

Sequence modifications

A: 29 - 313 (UniProt: P11309)

PDB	External Database	Details
Met 28	-	initiating methionine
Lys 314	-	expression tag
Leu 315	-	expression tag
Ala 316	-	expression tag
Ala 317	-	expression tag
Ala 318	-	expression tag
Leu 319	-	expression tag
Glu 320	-	expression tag
His 321	-	expression tag
His 322	-	expression tag
His 323	-	expression tag
His 324	-	expression tag
His 325	-	expression tag
His 326	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	34447.1
Non-Polymers*	Number of molecules	1
	Total formula weight	407.4
All*	Total formula weight	34854.6

*Water molecules are not included.