9SQE

PaMurU in complex with Mg2+ cofactor and UDPNAM/Diphosphate products

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 (C, A, B)	N-acetylmuramate alpha-1-phosphate uridylyltransferase	polymer	239	26078.4	3	UniProt (Q9I5U0) Pfam (PF00483)	Pseudomonas aeruginosa	MurNAc-1P uridylyltransferase,MurNAc-alpha-1P uridylyltransferase
2	D, I, N (C, A, B)	DIPHOSPHATE	non-polymer		173.9	3	Chemie (DPO) PubChem (644102)
3	E, J, O (C, A, B)	(2R)-2-{[(2R,3R,4R,5S,6R)-3-(acetylamino)-2-{[(S)-{[(R)-{[(2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}-5-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl]oxy}propanoic acid	non-polymer		679.4	3	Chemie (EPZ)
4	F, K, P (C, A, B)	DI(HYDROXYETHYL)ETHER	non-polymer		106.1	3	Chemie (PEG) PubChem (8117)
5	G, H, L, M, Q... (C, A, B)	MAGNESIUM ION	non-polymer		24.3	6	Chemie (MG) PubChem (888)
6	S, T, U (C, A, B)	water	water		18.0	408	Chemie (HOH)

Sequence modifications

C, A, B: 1 - 224 (UniProt: Q9I5U0)

PDB	External Database	Details
Met -14	-	initiating methionine
His -13	-	expression tag
His -12	-	expression tag
His -11	-	expression tag
His -10	-	expression tag
His -9	-	expression tag
His -8	-	expression tag
Glu -7	-	expression tag
Phe -6	-	expression tag
Ser -5	-	expression tag
Gln -4	-	expression tag
Gln -3	-	expression tag
Asp -2	-	expression tag
Ser -1	-	expression tag
Asp 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	3
	Total formula weight	78235.2
Non-Polymers*	Number of molecules	15
	Total formula weight	3024.3
All*	Total formula weight	81259.4

*Water molecules are not included.