6J3P

Crystal structure of the human GCN5 bromodomain in complex with compound (R,R)-36n

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	Histone acetyltransferase KAT2A	polymer	135	16001.3	2	UniProt (Q92830) Pfam (PF00439) In PDB	Homo sapiens (Human)	General control of amino acid synthesis protein 5-like 2,Histone acetyltransferase GCN5,hGCN5,Histone succinyltransferase KAT2A,Lysine acetyltransferase 2A,STAF97
2	A, B	2-{[(3R,5R)-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methylpiperidin-3-yl]amino}-3-methyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one	non-polymer		395.5	2	Chemie (B8O)
3		water	water		18.0	286	Chemie (HOH)

Sequence modifications

A, B: 726 - 837 (UniProt: Q92830)

PDB	External Database	Details
Met 703	-	initiating methionine
His 704	-	expression tag
His 705	-	expression tag
His 706	-	expression tag
His 707	-	expression tag
His 708	-	expression tag
His 709	-	expression tag
Ser 710	-	expression tag
Ser 711	-	expression tag
Gly 712	-	expression tag
Val 713	-	expression tag
Asp 714	-	expression tag
Leu 715	-	expression tag
Gly 716	-	expression tag
Thr 717	-	expression tag
Glu 718	-	expression tag
Asn 719	-	expression tag
Leu 720	-	expression tag
Tyr 721	-	expression tag
Phe 722	-	expression tag
Gln 723	-	expression tag
Ser 724	-	expression tag
Met 725	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	32002.6
Non-Polymers*	Number of molecules	2
	Total formula weight	790.9
All*	Total formula weight	32793.5

*Water molecules are not included.