9GJS

ERAP1 in complex with 1-[2-(6-bromo-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)acetamido]-4,4-difluorocyclohexane-1-carboxylic acid

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 (A)	Endoplasmic reticulum aminopeptidase 1	polymer	922	105371.4	1	UniProt (Q9NZ08) Pfam (PF17900) Pfam (PF01433) Pfam (PF11838)	Homo sapiens (human)	ARTS-1,Adipocyte-derived leucine aminopeptidase,A-LAP,Aminopeptidase PILS,Puromycin-insensitive leucyl-specific aminopeptidase,PILS-AP,Type 1 tumor necrosis factor receptor shedding aminopeptidase regulator
2	B (A)	ZINC ION	non-polymer		65.4	1	Chemie (ZN)
3	C, D (A)	PHOSPHATE ION	non-polymer		95.0	2	Chemie (PO4)
4	E, F, G, H, I... (A)	1,2-ETHANEDIOL	non-polymer		62.1	6	Chemie (EDO)
5	K, L (A)	1-[2-(6-bromanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]-4,4-bis(fluoranyl)cyclohexane-1-carboxylic acid	non-polymer		447.2	2	Chemie (A1IMJ)
6	M (A)	water	water		18.0	1037	Chemie (HOH)

Sequence modifications

A: 1 - 485 (UniProt: Q9NZ08)

PDB	External Database	Details
Gln 70	Asn 70	conflict
Gln 154	Asn 154	conflict
Gln 414	Asn 414	conflict

A: 514 - 941 (UniProt: Q9NZ08)

PDB	External Database	Details
Gly 511	-	linker
Ser 512	-	linker
Gly 513	-	linker
Arg 528	Lys 528	conflict
Gln 760	Asn 760	conflict
Glu 942	-	expression tag
Asn 943	-	expression tag
Leu 944	-	expression tag
Tyr 945	-	expression tag
Phe 946	-	expression tag
Gln 947	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	105371.4
Non-Polymers*	Number of molecules	11
	Total formula weight	1522.2
All*	Total formula weight	106893.6

*Water molecules are not included.