Ligand clusters for UniProt code Q9HU22

Ligand clusters for Q9HU22: Glucose-1-phosphate thymidylyltransferase from Pseudomonas aeruginosa (strain ATCC 15692 / DSM 22644 / CIP 104116 / JCM 14847 / LMG 12228 / 1C / PRS 101 / PAO1)

		5 ligand clusters Cluster 1. 15 ligand types 16 ligands Cluster 2. 1 ligand type 12 ligands Cluster 3. 1 ligand type 1 ligand Cluster 4. 1 ligand type 1 ligand Cluster 5. 1 ligand type 13 ligands
Representative protein: 4b2xA

Structures

PDB		Schematic diagram
4b2xA
4b4bA
5fuhA
3zlkA
3zllA
		more ...

Cluster 1 contains 15 ligand types

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Ligand		Description
		1. Ligand: GOL × 2 glycerin Glycerol PDB codes: 3zll(A), 4b3u(A).
		2. Ligand: 4WF × 1 5-Azanyl-6-Oxidanyl-1-(Phenylmethyl)pyrimidine-2,4- Dione PDB code: 3zll(A).
		3. Ligand: BZ0 × 1 N-(6-Amino-1-Benzyl-2,4-Dioxo-1,2,3,4- Tetrahydropyrimidin-5-Yl)benzamide PDB code: 4b2w(A).
		4. Ligand: DH5 × 1 N-(6-Amino-1-(4-Bromo-3-Methylbenzyl)-2,4-Dioxo-1,2,3, 4-Tetrahydropyrimidin-5-Yl)-N- Methylbenzenesulfonamide PDB code: 5fu8(A).
		5. Ligand: FKH × 1 N-(6-Amino-1-(3-Methylbenzyl)-2,4-Dioxo-1,2,3,4- Tetrahydropyrimidin-5-Yl)-N- Methylbenzenesulfonamide PDB code: 5fu0(A).
		6. Ligand: GJB × 1 1-(2-Phenylethyl)pyrimidine-2,4,6(1h,3h,5h)-Trione PDB code: 4b4b(A).
		7. Ligand: HKX × 1 N-[6-Amino-1-(3-Bromobenzyl)-2,4-Dioxo-1,2,3, 4-Tetrahydropyrimidin-5-Yl]-N- Methylbenzenesulfonamide PDB code: 5fuh(A).
		8. Ligand: HNR × 1 N-(6-Amino-1-Butyl-2,4-Dioxo-1,2,3,4- Tetrahydropyrimidin-5-Yl)-N-Methyl-Benzenesulfonamide PDB code: 4arw(A).
		9. Ligand: JWT × 1 N-(6-Amino-1-Benzyl-2,4-Dioxo-1,2,3,4- Tetrahydropyrimidin-5-Yl)-4-Fluoro-N- Methylbenzenesulfonamide PDB code: 4b4m(A).
		10. Ligand: KDT × 1 N-(6-Amino-1-(4-Bromobenzyl)-2,4-Dioxo-1,2,3,4- Tetrahydropyrimidin-5-Yl)-N- Methylbenzenesulfonamide PDB code: 5ftv(A).
		11. Ligand: LD6 × 1 N-(6-Amino-1-(3-Fluorobenzyl)-2,4-Dioxo-1,2,3,4- Tetrahydropyrimidin-5-Yl)-N- Methylbenzenesulfonamide PDB code: 5fye(A).
		12. Ligand: NIQ × 1 6-Amino-1-Butyl-5-(Cyclopentylamino)pyrimidine-2,4(1h, 3h)-Dione PDB code: 4b2x(A).
		13. Ligand: NWL × 1 6-Amino-1-Benzyl-5-(Ethylamino)pyrimidine-2,4(1h,3h)- Dione PDB code: 4b3u(A).
		14. Ligand: P3I × 1 N-(6-Amino-1-(2-Bromobenzyl)-2,4-Dioxo-1,2,3,4- Tetrahydropyrimidin-5-Yl)-N- Methylbenzenesulfonamide PDB code: 5fts(A).
		15. Ligand: Y46 × 1 N-(6-Amino-1-Benzyl-2,4-Dioxo-1,2,3,4- Tetrahydropyrimidin-5-Yl)benzenesulfonamide PDB code: 3zlk(A).

Cluster 2 contains 1 ligand type

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Ligand		Description
		1. Ligand: MES × 12 2-(N-Morpholino)-Ethanesulfonic acid PDB codes: 3zll(A), 4arw(A), 4b2w(A), 4b3u(A), 4b4b(A), 4b4m(A), 5fts(A), 5ftv(A), 5fu0(A), 5fu8(A), 5fuh(A), 5fye(A).

Cluster 3 contains 1 ligand type

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Ligand		Description
		1. Ligand: GOL × 1 glycerin Glycerol PDB code: 3zll(A).

Cluster 4 contains 1 ligand type

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Ligand		Description
		1. Ligand: GOL × 1 glycerin Glycerol PDB code: 5fuh(A).

Cluster 5 contains 1 ligand type

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Ligand		Description
_Cl		1. Metal: _CL × 13 PDB codes: 3zlk(A), 3zll(A), 4b2w(A), 4b2x(A), 4b3u(A), 4b4b(A), 4b4m(A), 5fts(A), 5ftv(A), 5fu0(A), 5fu8(A), 5fuh(A), 5fye(A).