3VNH

Crystal Structure of Keap1 Soaked with Synthetic Small Molecular

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Kelch-like ECH-associated protein 1	polymer	309	33825.7	1	UniProt (Q14145) Pfam (PF01344) In PDB	Homo sapiens (human)	Cytosolic inhibitor of Nrf2, INrf2, Kelch-like protein 19
2	A	2-(3-((3-(5-(furan-2-yl)-1,3,4-oxadiazol-2-yl)ureido)methyl)phenoxy)acetic acid	non-polymer		358.3	1	Chemie (FUU)
3		water	water		18.0	247	Chemie (HOH)

Sequence modifications

A: 0 - 288 (UniProt: Q14145)

PDB	External Database	Details
Gly -20	-	expression tag
Ser -19	-	expression tag
Ser -18	-	expression tag
His -17	-	expression tag
His -16	-	expression tag
His -15	-	expression tag
His -14	-	expression tag
His -13	-	expression tag
His -12	-	expression tag
Ser -11	-	expression tag
Ser -10	-	expression tag
Gly -9	-	expression tag
Leu -8	-	expression tag
Val -7	-	expression tag
Pro -6	-	expression tag
Arg -5	-	expression tag
Gly -4	-	expression tag
Ser -3	-	expression tag
His -2	-	expression tag
Met -1	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	33825.7
Non-Polymers*	Number of molecules	1
	Total formula weight	358.3
All*	Total formula weight	34184.0

*Water molecules are not included.