Ligand clusters for UniProt code P78417

Ligand clusters for P78417: Glutathione S-transferase omega-1 from Homo sapiens

		Top 6 (of 10) ligand clusters Cluster 1. 22 ligand types 34 ligands Cluster 2. 3 ligand types 3 ligands Cluster 3. 1 ligand type 4 ligands Cluster 4. 2 ligand types 16 ligands Cluster 5. 1 ligand type 2 ligands Cluster 6. 1 ligand type 1 ligand
Representative protein: 6mhcA

Structures

PDB		Schematic diagram
6mhcA
6pnoA
5yvoA
3vlnA
5v3qA
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Cluster 1 contains 22 ligand types (of which only 20 are listed. Click for all)

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Ligand		Description
		1. Ligand: GSH × 4 glutathione Glutathione PDB codes: 1eem(A), 3lfl(A), 5yvn(A).
		2. Ligand: ASC × 1 ascorbic acid Ascorbic acid PDB code: 3vln(A).
		3. Ligand: DMS × 1 dimethyl sulfoxide Dimethyl sulfoxide PDB code: 6mhc(A).
		4. Ligand: GDS × 1 glutathione disulfide Oxidized glutathione disulfide PDB code: 4is0(A).
		5. Ligand: MES × 5 2-(N-Morpholino)-Ethanesulfonic acid PDB codes: 4yqm(A), 4yqu(A), 6mhb(A), 6mhc(A), 6mhd(A).
		6. Ligand: ACT × 3 Acetate ion PDB codes: 3vln(A), 5yvn(A), 5yvo(A).
		7. Ligand: TLA × 3 L(+)-Tartaric acid PDB codes: 6pnm(A), 6pnn(A), 6pno(A).
		8. Ligand: MLX × 2 N-{3-[(2-Chloro-Acetyl)-(4-Nitro-Phenyl)-Amino]- Propyl}-2,2,2-Trifluoro-Acetamide PDB codes: 5v3q(A), 5yvo(A).
		9. Ligand: 1R4 × 1 L-Gamma-Glutamyl-S-[2-(4-Nitrophenyl)-2-Oxoethyl]-L- Cysteinylglycine PDB code: 4is0(A).
		10. Ligand: 4G9 × 1 2-Chloro-N-[4-Chloro-3-(Dimethylsulfamoyl) phenyl]acetamide PDB code: 4yqm(A).
		11. Ligand: 4GB × 1 N-{5-(Azepan-1-Ylsulfonyl)-2-[(Ethylsulfanyl) methoxy]phenyl}acetamide PDB code: 4yqu(A).
		12. Ligand: 4GG × 1 2-(Ethylsulfanyl)-N-Methyl-N-[(1-Phenyl-1h-Pyrazol-4- Yl)methyl]acetamide PDB code: 4yqv(A).
		13. Ligand: 85P × 1 2-(4-Chlorophenyl)-6-[(Fluorosulfonyl)oxy]quinoline-4- Carboxylic acid PDB code: 5ueh(A).
		14. Ligand: ACN × 1 Acetone PDB code: 6mhd(A).
		15. Ligand: EDO × 1 1,2-Ethanediol PDB code: 3vln(A).
		16. Ligand: JR7 × 1 N-[4-(4-Chlorophenyl)-1,3-Thiazol-2-Yl]propanamide PDB code: 6mhb(A).
		17. Ligand: JRD × 1 N-[(3-Methyl-1,2-Oxazol-5-Yl)methyl]-N-(4-Phenyl-1,3- Thiazol-2-Yl)propanamide PDB code: 6mhd(A).
		18. Ligand: JRM × 1 Methyl n-(4-Phenyl-1,3-Thiazol-2-Yl)-N- Propanoylglycinate PDB code: 6mhc(A).
		19. Ligand: OR7 × 1 2-Chloro-N-{4-Chloro-3-[(2-Methoxyethyl)(methyl) sulfamoyl]phenyl}acetamide PDB code: 6pnn(A).
		20. Ligand: ORM × 1 2-Chloro-N-{4-Chloro-3-[(Propan-2-Yl) sulfamoyl]phenyl}acetamide PDB code: 6pno(A).
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Cluster 2 contains 3 ligand types

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Ligand		Description
		1. Ligand: GOL × 1 glycerin Glycerol PDB code: 3vln(A).
		2. Ligand: DTT × 1 2,3-Dihydroxy-1,4-Dithiobutane PDB code: 4is0(A).
		3. Ligand: MLX × 1 N-{3-[(2-Chloro-Acetyl)-(4-Nitro-Phenyl)-Amino]- Propyl}-2,2,2-Trifluoro-Acetamide PDB code: 5yvo(A).

Cluster 3 contains 1 ligand type

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Ligand		Description
		1. Ligand: MES × 4 2-(N-Morpholino)-Ethanesulfonic acid PDB codes: 4yqu(A), 6mhb(A), 6mhc(A), 6mhd(A).

Cluster 4 contains 2 ligand types

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Ligand		Description
		1. Ligand: GOL × 1 glycerin Glycerol PDB code: 3vln(A).
		2. Ligand: SO4 × 15 Sulfate ion PDB codes: 1eem(A), 3vln(A), 4is0(A), 5ueh(A), 5v3q(A), 5yvn(A), 5yvo(A), 6pnm(A), 6pnn(A), 6pno(A),

Cluster 5 contains 1 ligand type

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Ligand		Description
		1. Ligand: DTT × 2 2,3-Dihydroxy-1,4-Dithiobutane PDB codes: 3lfl(A),

Cluster 6 contains 1 ligand type

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Ligand		Description
		1. Ligand: PEG × 1 Di(hydroxyethyl)ether PDB code: 6mhc(A).