5CGA

Structure of Hydroxyethylthiazole kinase ThiM from Staphylococcus aureus in complex with substrate analog 2-(1,3,5-trimethyl-1H-pyrazole-4-yl)ethanol

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, D, E... (A, B, C, E, F...)	Hydroxyethylthiazole kinase	polymer	277	29808.8	6	UniProt (Q6GEY3) Pfam (PF02110)	Staphylococcus aureus MRSA252	4-methyl-5-beta-hydroxyethylthiazole kinase,Thz kinase
2	G, I, K, M, O... (A, B, C, E, F...)	2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethanol	non-polymer		154.2	6	Chemie (KP6)
3	H, J, L, N (A, B, C, E)	MAGNESIUM ION	non-polymer		24.3	4	Chemie (MG)
4	Q, R, S, T, U... (A, B, C, E, F...)	water	water		18.0	486	Chemie (HOH)

Sequence modifications

A, B, C, E, F, H: 1 - 263 (UniProt: Q6GEY3)

PDB	External Database	Details
Glu 264	-	expression tag
Asn 265	-	expression tag
Leu 266	-	expression tag
Tyr 267	-	expression tag
Gln 268	-	expression tag
Gln 269	-	expression tag
Ser 270	-	expression tag
Gly 271	-	expression tag
His 272	-	expression tag
His 273	-	expression tag
His 274	-	expression tag
His 275	-	expression tag
His 276	-	expression tag
His 277	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	6
	Total formula weight	178852.5
Non-Polymers*	Number of molecules	10
	Total formula weight	1022.5
All*	Total formula weight	179875.0

*Water molecules are not included.