4B4G

Pseudomonas aeruginosa RmlA in complex with allosteric inhibitor

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 (A, B, C, D)	GLUCOSE-1-PHOSPHATE THYMIDYLYLTRANSFERASE	polymer	303	33664.1	4	UniProt (Q9HU22) Pfam (PF00483)	PSEUDOMONAS AERUGINOSA
2	E, G, J, M (A, B, C, D)	N-(6-amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-N-methylbutane-1-sulfonamide	non-polymer		366.4	4	Chemie (KKT)
3	F, H, L, N (A, B, C, D)	CHLORIDE ION	non-polymer		35.5	4	Chemie (CL)
4	I, K (B, C)	2-(N-MORPHOLINO)-ETHANESULFONIC ACID	non-polymer		195.2	2	Chemie (MES)
5	O, P, Q, R (A, B, C, D)	water	water		18.0	160	Chemie (HOH)

Sequence modifications

A, B, C, D: 1 - 293 (UniProt: Q9HU22)

PDB	External Database	Details
His -10	-	expression tag
His -9	-	expression tag
His -8	-	expression tag
His -7	-	expression tag
His -6	-	expression tag
His -5	-	expression tag
Gly -4	-	expression tag
Ser -3	-	expression tag
Met -2	-	expression tag
Ala -1	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	134656.5
Non-Polymers*	Number of molecules	10
	Total formula weight	1998.0
All*	Total formula weight	136654.5

*Water molecules are not included.