6QHO

Dual specificity mitogen-activated protein kinase kinase 7 in complex with pyrazolopyrimidine 1a

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Dual specificity mitogen-activated protein kinase kinase 7	polymer	318	36146.9	1	UniProt (O14733) Pfam (PF00069)	Homo sapiens (Human)	MAPKK 7,JNK-activating kinase 2,MAPK/ERK kinase 7,MEK 7,Stress-activated protein kinase kinase 4,SAPKK4,c-Jun N-terminal kinase kinase 2,JNKK 2
2	B (A)	1-[(3~{R})-3-(4-azanylpyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl]propan-1-one	non-polymer		274.3	1	Chemie (J3H)
3	C (A)	water	water		18.0	7	Chemie (HOH)

Sequence modifications

A: 127 - 424 (UniProt: O14733)

PDB	External Database	Details
Met 107	-	initiating methionine
Gly 108	-	expression tag
His 109	-	expression tag
His 110	-	expression tag
His 111	-	expression tag
His 112	-	expression tag
His 113	-	expression tag
His 114	-	expression tag
Ser 115	-	expression tag
Ala 116	-	expression tag
Lys 117	-	expression tag
Gln 118	-	expression tag
Thr 119	-	expression tag
Gly 120	-	expression tag
Tyr 121	-	expression tag
Leu 122	-	expression tag
Thr 123	-	expression tag
Ile 124	-	expression tag
Gly 125	-	expression tag
Gly 126	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	36146.9
Non-Polymers*	Number of molecules	1
	Total formula weight	274.3
All*	Total formula weight	36421.2

*Water molecules are not included.