9ETY

KEAP1 in complex with compound 25

This is a non-PDB format compatible entry.

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (A, B)	Kelch-like ECH-associated protein 1	polymer	189	21337.3	2	UniProt (Q14145) Pfam (PF00651)	Homo sapiens (human)	Cytosolic inhibitor of Nrf2,INrf2,Kelch-like protein 19
2	C, G (A, B)	2-[[5-[(2~{R})-2,4-dimethyl-3-oxidanylidene-piperazin-1-yl]-2,3-dihydro-1,3-thiazol-4-yl]sulfonyl]benzenecarbonitrile	non-polymer		378.5	2	Chemie (A1H7T)
3	D, E, F, H (A, B)	1,2-ETHANEDIOL	non-polymer		62.1	4	Chemie (EDO)
4	I (B)	PHOSPHATE ION	non-polymer		95.0	1	Chemie (PO4)
5	J, K (A, B)	water	water		18.0	95	Chemie (HOH)

Sequence modifications

A, B: 48 - 213 (UniProt: Q14145)

PDB	External Database	Details
Met 25	-	initiating methionine
His 26	-	expression tag
His 27	-	expression tag
His 28	-	expression tag
His 29	-	expression tag
His 30	-	expression tag
His 31	-	expression tag
Ser 32	-	expression tag
Ser 33	-	expression tag
Gly 34	-	expression tag
Val 35	-	expression tag
Asp 36	-	expression tag
Leu 37	-	expression tag
Gly 38	-	expression tag
Thr 39	-	expression tag
Glu 40	-	expression tag
Asn 41	-	expression tag
Leu 42	-	expression tag
Tyr 43	-	expression tag
Phe 44	-	expression tag
Gln 45	-	expression tag
Ser 46	-	expression tag
Met 47	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	42674.7
Non-Polymers*	Number of molecules	7
	Total formula weight	1100.2
All*	Total formula weight	43774.9

*Water molecules are not included.