7T1H

Crystal structure of CAB1 Pantothenate Kinase from Saccharomyces cerevisiae in complex with compound YU281445

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	Pantothenate kinase CAB1	polymer	375	41974.2	2	UniProt (Q04430) Pfam (PF03630) In PDB	Saccharomyces cerevisiae S288C	Coenzyme A biosynthesis protein 1,Pantothenic acid kinase CAB1
2	A	(8R)-2-{[(4-tert-butylphenyl)methyl]amino}-5-[(morpholin-4-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one	non-polymer		396.5	1	Chemie (E5B)
3	B	GLYCEROL	non-polymer		92.1	1	Chemie (GOL)
4		water	water		18.0	229	Chemie (HOH)

Sequence modifications

A, B: 1 - 367 (UniProt: Q04430)

PDB	External Database	Details
Met -7	-	initiating methionine
Ala -6	-	expression tag
His -5	-	expression tag
His -4	-	expression tag
His -3	-	expression tag
His -2	-	expression tag
His -1	-	expression tag
His 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	83948.4
Non-Polymers*	Number of molecules	2
	Total formula weight	488.6
All*	Total formula weight	84437.0

*Water molecules are not included.