4HYS

Crystal structure of JNK1 in complex with JIP1 peptide and 4-(4-Indazol-1-yl-pyrimidin-2-ylamino)-cyclohexan

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Mitogen-activated protein kinase 8	polymer	369	42588.2	1	UniProt (A1L4K2) Pfam (PF00069) UniProt (by SIFTS) (P45983)	Homo sapiens (human)	Mitogen-activated protein kinase 8 isoform JNK1 beta2, Mitogen-activated protein kinase 8, isoform CRA_d, cDNA FLJ77387, highly similar to Homo sapiens mitogen-activated protein kinase 8 (MAPK8), transcript variant 4, mRNA
2	B (B)	C-Jun-amino-terminal kinase-interacting protein 1	polymer	11	1345.6	1	UniProt (Q9UQF2)	Homo sapiens	JIP-1, JNK-interacting protein 1, Islet-brain 1, IB-1, JNK MAP kinase scaffold protein 1, Mitogen-activated protein kinase 8-interacting protein 1
3	C (A)	trans-4-{[4-(1H-indazol-1-yl)pyrimidin-2-yl]amino}cyclohexanol	non-polymer		309.4	1	Chemie (1BJ)
4	D (A)	water	water		18.0	39	Chemie (HOH)

Sequence modifications

A: 1 - 363 (UniProt: A1L4K2)

PDB	External Database	Details
His 364	-	expression tag
His 365	-	expression tag
His 366	-	expression tag
His 367	-	expression tag
His 368	-	expression tag
His 369	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	43933.8
Non-Polymers*	Number of molecules	1
	Total formula weight	309.4
All*	Total formula weight	44243.2

*Water molecules are not included.