3P8K

Crystal Structure of a putative carbon-nitrogen family hydrolase from Staphylococcus aureus

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (A, B)	Hydrolase, carbon-nitrogen family	polymer	281	32354.2	2	UniProt (Q5HEG7) UniProt (by SIFTS) (A0A0H2WXM0)	Staphylococcus aureus subsp. aureus COL	carbon-nitrogen family hydrolase
2	C (A)	2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL	non-polymer		122.1	1	Chemie (TRS)
3	D, J, K, L (A)	CHLORIDE ION	non-polymer		35.5	4	Chemie (CL)
4	E, F, M (A, B)	DI(HYDROXYETHYL)ETHER	non-polymer		106.1	3	Chemie (PEG)
5	G, H (A)	TRIETHYLENE GLYCOL	non-polymer		150.2	2	Chemie (PGE)
6	I (A)	GLYCEROL	non-polymer		92.1	1	Chemie (GOL)
7	N, O (A, B)	water	water		18.0	555	Chemie (HOH)

Sequence modifications

A, B: 2 - 261 (UniProt: Q5HEG7)

PDB	External Database	Details
Mse -19	-	expression tag
Gly -18	-	expression tag
Ser -17	-	expression tag
Ser -16	-	expression tag
His -15	-	expression tag
His -14	-	expression tag
His -13	-	expression tag
His -12	-	expression tag
His -11	-	expression tag
His -10	-	expression tag
Ser -9	-	expression tag
Ser -8	-	expression tag
Gly -7	-	expression tag
Leu -6	-	expression tag
Val -5	-	expression tag
Pro -4	-	expression tag
Arg -3	-	expression tag
Gly -2	-	expression tag
Ser -1	-	expression tag
His 0	-	expression tag
Mse 1	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	64708.5
Non-Polymers*	Number of molecules	11
	Total formula weight	974.8
All*	Total formula weight	65683.2

*Water molecules are not included.