Ligand clusters for UniProt code Q6GJI9

Ligand clusters for Q6GJI9: Thymidylate kinase from Staphylococcus aureus (strain MRSA252)

1 ligand cluster


Cluster 1. 8 ligand types 8 ligands

Representative protein: 4qg7A

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Ligand

Description

1. Ligand: 0Y5 × 1

4-{[(3s)-3-(5-Methyl-2,4-Dioxo-3,4-Dihydropyrimidin- 1(2h)-Yl)piperidin-1-Yl]methyl}-2-[3-
(Trifluoromethyl)phenoxy]benzoic acid

PDB code: 4gsy(A).

2. Ligand: 16T × 1

1-[(3s)-1-{[3-(3-Chlorophenoxy)-4- Hydroxyphenyl]sulfonyl}piperidin-3-Yl]-5- Methylpyrimidine-
2,4(1h,3h)-Dione

PDB code: 4hld(A).

3. Ligand: 31Z × 1

2-(3-Chlorophenoxy)-3-Fluoro-4-{[(3s)-3-(5-Methyl-2,4- Dioxo-3,4-Dihydropyrimidin-1(2h)-
Yl)piperidin-1- Yl]methyl}benzoic acid

PDB code: 4qga(A).

4. Ligand: 32B × 1

2-(3-Chlorophenoxy)-3-Methoxy-4-{(1r)-1-[(3s)-3-(5- Methyl-2,4-Dioxo-3,4-Dihydropyrimidin-1(2h)-
Yl) piperidin-1-Yl]propyl}benzoic acid

PDB code: 4qgf(A).

5. Ligand: 32C × 1

2-(3-Chlorophenoxy)-3-Fluoro-4-{(1r)-3-Methyl-1-[(3s)- 3-(5-Methyl-2,4-Dioxo-3,4-Dihydropyrimidin-
1(2h)-Yl) piperidin-1-Yl]butyl}benzoic acid

PDB code: 4qgg(A).

6. Ligand: 32E × 1

2-(3-Chlorophenoxy)-3-Fluoro-4-{(1s)-3-Methyl-1-[(3s)- 3-(5-Methyl-2,4-Dioxo-3,4-Dihydropyrimidin-
1(2h)-Yl) piperidin-1-Yl]butyl}benzoic acid

PDB code: 4qgh(A).

7. Ligand: 32K × 1

2-(3-Chlorophenoxy)-3-Methoxy-4-{[(3s)-3-(5-Methyl-2,4- Dioxo-3,4-Dihydropyrimidin-1(2h)-
Yl)piperidin-1- Yl]methyl}benzoic acid

PDB code: 4qg7(A).

8. Ligand: T05 × 1

4-{[(3s)-3-(5-Methyl-2,4-Dioxo-3,4-Dihydropyrimidin- 1(2h)-Yl)piperidin-1-Yl]sulfonyl}-2-(3-
Methylphenoxy) benzoic acid

PDB code: 4hlc(A).