8F86

SIRT6 bound to an H3K9Ac nucleosome

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, E (A, E)	Histone H3.2	polymer	135	15271.9	2	UniProt (P84233) Pfam (PF00125)	Xenopus laevis (African clawed frog)
2	B, F (B, F)	Histone H4	polymer	102	11263.2	2	UniProt (P62799) Pfam (PF15511)	Xenopus laevis (African clawed frog)
3	C, G (C, G)	Histone H2A type 1	polymer	129	13978.2	2	UniProt (P06897) Pfam (PF00125) Pfam (PF16211)	Xenopus laevis (African clawed frog)
4	D, H (D, H)	Histone H2B	polymer	122	13524.8	2	UniProt (P02281) Pfam (PF00125)	Xenopus laevis (African clawed frog)	H2B1.1
5	I (I)	DNA (148-MER)	polymer	185	57400.6	1		synthetic construct
6	J (J)	DNA (148-MER)	polymer	185	56831.2	1		synthetic construct
7	K (K)	NAD-dependent protein deacylase sirtuin-6	polymer	355	39152.9	1	UniProt (Q8N6T7) Pfam (PF02146)	Homo sapiens (human)	NAD-dependent protein deacetylase sirtuin-6,Protein mono-ADP-ribosyltransferase sirtuin-6,Regulatory protein SIR2 homolog 6,hSIRT6,SIR2-like protein 6
8	L (A)	[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [(3aR,5R,6R,6aR)-6-hydroxytetrahydro-2H-furo[2,3-d][1,3]oxathiol-5-yl]methyl dihydrogen diphosphate (non-preferred name)	non-polymer		587.4	1	Chemie (ZSL)
9	M (K)	ZINC ION	non-polymer		65.4	1	Chemie (ZN)

Sequence modifications

A, E: 1 - 135 (UniProt: P84233)

PDB	External Database	Details
Ala 102	Gly 103	conflict
Ala 110	Cys 111	conflict

C, G: 1 - 129 (UniProt: P06897)

PDB	External Database	Details
Arg 99	Gly 100	conflict
Ser 123	Ala 124	conflict

D, H: 1 - 122 (UniProt: P02281)

PDB	External Database	Details
Thr 29	Ser 33	variant

K: 2 - 355 (UniProt: Q8N6T7)

PDB	External Database	Details
Cys 1	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	11
	Total formula weight	261460.8
Non-Polymers*	Number of molecules	2
	Total formula weight	652.8
All*	Total formula weight	262113.6

*Water molecules are not included.