5LW1

Crystal structure of DARPin-DARPin rigid fusion, variant DD_232_11_D12 in complex JNK1a1 and JIP1 peptide

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, D, G	DD_232_11_D12	polymer	326	35249.0	3		synthetic construct
2	B, E, H	Mitogen-activated protein kinase 8	polymer	373	43154.9	3	UniProt (P45983) Pfam (PF00069) In PDB	Homo sapiens (Human)	MAPK 8,JNK-46,Stress-activated protein kinase 1c,SAPK1c,Stress-activated protein kinase JNK1,c-Jun N-terminal kinase 1
3	C, F, I	C-Jun-amino-terminal kinase-interacting protein 1	polymer	11	1345.6	3	UniProt (Q9UQF2) In PDB	Homo sapiens	JNK-interacting protein 1,Islet-brain 1,IB-1,JNK MAP kinase scaffold protein 1,Mitogen-activated protein kinase 8-interacting protein 1
4	L	Pepstatin	polymer	6	685.9	1	BIRD (PRD_000557)	synthetic construct
5	E, G, H, A, I...	SULFATE ION	non-polymer		96.1	24	Chemie (SO4)
6	H, B, E	ADENOSINE	non-polymer		267.2	3	Chemie (ADN)

Sequence modifications

B, E, H: 2 - 363 (UniProt: P45983)

PDB	External Database	Details
Met -9	-	initiating methionine
Arg -8	-	expression tag
Gly -7	-	expression tag
Ser -6	-	expression tag
His -5	-	expression tag
His -4	-	expression tag
His -3	-	expression tag
His -2	-	expression tag
His -1	-	expression tag
His 0	-	expression tag
Gly 1	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	10
	Total formula weight	239934.2
Non-Polymers*	Number of molecules	27
	Total formula weight	3107.2
All*	Total formula weight	243041.4

*Water molecules are not included.