5Z1D

MAP2K7 C276S mutant-inhibitor

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Dual specificity mitogen-activated protein kinase kinase 7	polymer	324	36982.8	1	UniProt (O14733) Pfam (PF00069) In PDB	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	A	N-[3-(6-methyl-1H-indazol-3-yl)phenyl]prop-2-enamide	non-polymer		277.3	1	Chemie (95U)
3	A	4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID	non-polymer		238.3	1	Chemie (EPE)
4		water	water		18.0	101	Chemie (HOH)

Sequence modifications

A: 119 - 435 (UniProt: O14733)

PDB	External Database	Details
Met 118	-	initiating methionine
Ser 276	Cys 260	conflict
His 436	-	expression tag
His 437	-	expression tag
His 438	-	expression tag
His 439	-	expression tag
His 440	-	expression tag
His 441	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	36982.8
Non-Polymers*	Number of molecules	2
	Total formula weight	515.6
All*	Total formula weight	37498.5

*Water molecules are not included.