3MZ6

Crystal structure of D101L Fe2+ HDAC8 complexed with M344

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Histone deacetylase 8	polymer	389	43230.1	1	UniProt (Q9BY41) Pfam (PF00850) In PDB	Homo sapiens (human)	HD8
2	A	FE (II) ION	non-polymer		55.8	1	Chemie (FE2)
3	A	POTASSIUM ION	non-polymer		39.1	2	Chemie (K)
4	A	4-(dimethylamino)-N-[7-(hydroxyamino)-7-oxoheptyl]benzamide	non-polymer		307.4	1	Chemie (B3N)
5		water	water		18.0	156	Chemie (HOH)

Sequence modifications

A: 1 - 377 (UniProt: Q9BY41)

PDB	External Database	Details
Leu 101	Asp 101	engineered mutation
Ile 378	-	expression tag
Glu 379	-	expression tag
Gly 380	-	expression tag
Arg 381	-	expression tag
Gly 382	-	expression tag
Ser 383	-	expression tag
His 384	-	expression tag
His 385	-	expression tag
His 386	-	expression tag
His 387	-	expression tag
His 388	-	expression tag
His 389	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	43230.1
Non-Polymers*	Number of molecules	4
	Total formula weight	441.4
All*	Total formula weight	43671.5

*Water molecules are not included.