4QGF

S.aureus TMK in complex with the potent inhibitor compound 38, 2-(3-CHLOROPHENOXY)-3-METHOXY-4-{(1R)-1-[(3S)-3-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)PIPERIDIN-1-YL]PROPYL}BENZOIC ACID

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	Thymidylate kinase	polymer	205	23454.6	2	UniProt (Q6GJI9) Pfam (PF02223) In PDB	Staphylococcus aureus subsp. aureus	dTMP kinase
2	A, B	2-(3-chlorophenoxy)-3-methoxy-4-{(1R)-1-[(3S)-3-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)piperidin-1-yl]propyl}benzoic acid	non-polymer		528.0	2	Chemie (32B)
3		water	water		18.0	299	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	46909.2
Non-Polymers*	Number of molecules	2
	Total formula weight	1056.0
All*	Total formula weight	47965.2

*Water molecules are not included.