8FUM

AibH1H2 metalated with Fe in the presence of Tris

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, C, E, G (A, C, E, G)	Amidohydrolase	polymer	392	43992.1	4	UniProt (A0A402C2V4) Pfam (PF04909)	Rhodococcus wratislaviensis NBRC 100605
2	B, F, H (B, F, H)	Amidohydrolase	polymer	378	42288.2	3	UniProt (A0A402C2Q3) Pfam (PF04909)	Rhodococcus wratislaviensis NBRC 100605
3	D (D)	Amidohydrolase	polymer	378	42272.2	1	UniProt (A0A402C2Q3) Pfam (PF04909)	Rhodococcus wratislaviensis NBRC 100605
4	AA, I, J, MA, N... (E, A, G, B, C)	TETRAETHYLENE GLYCOL	non-polymer		194.2	7	Chemie (PG4)
5	CA, JA, K, KA, OA... (E, F, A, G, B...)	FE (III) ION	non-polymer		55.8	12	Chemie (FE)
6	DA, EA, FA, L, LA... (E, A, F, G, B...)	MAGNESIUM ION	non-polymer		24.3	14	Chemie (MG)
7	GA, HA, IA, O, SA... (F, B, H, D)	2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL	non-polymer		122.1	7	Chemie (TRS)
8	BA (E)	DI(HYDROXYETHYL)ETHER	non-polymer		106.1	1	Chemie (PEG)
9	AB, BB, CB, DB, EB... (D, E, F, G, H...)	water	water		18.0	2136	Chemie (HOH)

Sequence modifications

A, C, E, G: 13 - 385 (UniProt: A0A402C2V4)

PDB	External Database	Details
Met -6	-	expression tag
Gly -5	-	expression tag
His -4	-	expression tag
His -3	-	expression tag
His -2	-	expression tag
His -1	-	expression tag
His 0	-	expression tag
His 1	-	expression tag
Ser 2	-	expression tag
Gly 3	-	expression tag
Glu 4	-	expression tag
Asn 5	-	expression tag
Leu 6	-	expression tag
Tyr 7	-	expression tag
Phe 8	-	expression tag
Gln 9	-	expression tag
Ser 10	-	expression tag
Gly 11	-	expression tag
Gly 12	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	8
	Total formula weight	345105.3
Non-Polymers*	Number of molecules	41
	Total formula weight	3331.1
All*	Total formula weight	348436.4

*Water molecules are not included.