4B42

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 (G3XCK4) Pfam (PF00483) UniProt (by SIFTS) (Q9HU22)	PSEUDOMONAS AERUGINOSA
2	E, H, K, N (A, B, C, D)	N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-methyl-benzamide	non-polymer		316.4	4	Chemie (942)
3	F, I, L, O (A, B, C, D)	CHLORIDE ION	non-polymer		35.5	4	Chemie (CL)
4	G, J, M, P (A, B, C, D)	2-(N-MORPHOLINO)-ETHANESULFONIC ACID	non-polymer		195.2	4	Chemie (MES)
5	Q, R, S, T (A, B, C, D)	water	water		18.0	218	Chemie (HOH)

Sequence modifications

A, B, C, D: 1 - 293 (UniProt: G3XCK4)

PDB	External Database	Details
His -9	-	expression tag
His -8	-	expression tag
His -7	-	expression tag
His -6	-	expression tag
His -5	-	expression tag
His -4	-	expression tag
Gly -3	-	expression tag
Ser -2	-	expression tag
Met -1	-	expression tag
Ala 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	134656.5
Non-Polymers*	Number of molecules	12
	Total formula weight	2188.2
All*	Total formula weight	136844.7

*Water molecules are not included.