8F5F

human branched chain ketoacid dehydrogenase kinase in complex with inhibitors

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	[3-methyl-2-oxobutanoate dehydrogenase [lipoamide]] kinase, mitochondrial	polymer	388	44251.6	2	UniProt (O14874) Pfam (PF10436) Pfam (PF02518) In PDB	Homo sapiens (human)	Branched-chain alpha-ketoacid dehydrogenase kinase,BCKD-kinase,BCKDHKIN
2	A, B	ADENOSINE-5'-DIPHOSPHATE	non-polymer		427.2	2	Chemie (ADP)
3	A, B	MAGNESIUM ION	non-polymer		24.3	2	Chemie (MG)
4	A, B	(2P)-2-[(4P)-4-{6-[(1-ethylcyclopropyl)methoxy]pyridin-3-yl}-1,3-thiazol-2-yl]benzoic acid	non-polymer		380.5	2	Chemie (XGG)
5	A, B	SULFATE ION	non-polymer		96.1	2	Chemie (SO4)
6		water	water		18.0	13	Chemie (HOH)

Sequence modifications

A, B: 1 - 382 (UniProt: O14874)

PDB	External Database	Details
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	2
	Total formula weight	88503.3
Non-Polymers*	Number of molecules	8
	Total formula weight	1856.1
All*	Total formula weight	90359.3

*Water molecules are not included.