3F07

Crystal Structure Analysis of Human HDAC8 complexed with APHA in a new monoclinic crystal form

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B, C (A, B, C)	Histone deacetylase 8	polymer	388	43174.9	3	UniProt (Q9BY41) Pfam (PF00850)	Homo sapiens (Human)	HD8
2	D, G, I, M (A, B, C)	ZINC ION	non-polymer		65.4	4	Chemie (ZN)
3	E, F, J, K, N... (A, B, C)	POTASSIUM ION	non-polymer		39.1	6	Chemie (K)
4	H, L (A, B)	(2E)-N-hydroxy-3-[1-methyl-4-(phenylacetyl)-1H-pyrrol-2-yl]prop-2-enamide	non-polymer		284.3	2	Chemie (AGE)
5	P, Q, R (A, B, C)	water	water		18.0	14	Chemie (HOH)

Sequence modifications

A, B, C: 1 - 377 (UniProt: Q9BY41)

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

Contents of the asymmetric unit

Polymers	Number of chains	3
	Total formula weight	129524.8
Non-Polymers*	Number of molecules	12
	Total formula weight	1064.8
All*	Total formula weight	130589.7

*Water molecules are not included.