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Ligand clusters for UniProt code P09211

Ligand clusters for P09211: Glutathione S-transferase P OS=Homo sapiens GN=GSTP1 PE=1 SV=2

Top 6 (of 14) ligand clusters
Cluster 1.
23 ligand types
60 ligands
Cluster 2.
15 ligand types
44 ligands
Cluster 3.
3 ligand types
47 ligands
Cluster 4.
2 ligand types
6 ligands
Cluster 5.
2 ligand types
4 ligands
Cluster 6.
2 ligand types
3 ligands
Representative protein: 13gsA  
 

Structures

PDB   Schematic diagram
13gsA    
2a2rA    
5gssA    
16gsA    
3csiA    
 more ...

 

 Cluster 1 contains 23 ligand types (of which only 20 are listed. Click for all)

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Ligand Description


 
1. Ligand: GSH × 21
glutathione
Glutathione
PDB codes: 13gs(A), 19gs(A), 1aqw(A), 1kbn(A), 1lbk(A), 1md3(A), 1md4(A), 1px6(A), 1px7(A), 3csh(A), 3csi(A), 3dd3(A), 3gus(A), 3hjo(A), 3ie3(A), 3km6(A), 3kmo(A), 5gss(A), 6gss(A), 7gss(A), 8gss(A).


 
2. Ligand: EAA × 6
ethacrynic acid
Ethacrynic acid
PDB codes: 2gss(A), 3dgq(A), 3hjo(A), 3km6(A), 3kmo(A), 3n9j(A).


 
3. Ligand: SAS × 1
sulfasalazine
2-Hydroxy-(5-([4-(2-Pyridinylamino)sulfonyl]phenyl) azo)benzoic acid
PDB code: 13gs(A).


 
4. Ligand: GSN × 2
2-Amino-5-[1-(Carboxylatomethylcarbamoyl)-2- Nitrososulfanyl-Ethyl]amino-5-Oxo-Pentanoate
PDB codes: 2a2r(A), 2a2s(A).


 
5. Ligand: GPR × 1
(9r,10r)-9-(S-Glutathionyl)-10-Hydroxy-9,10- Dihydrophenanthrene
PDB code: 2pgt(A).


 
6. Ligand: GTX × 5
S-Hexylglutathione
PDB codes: 17gs(A), 1pgt(A), 2j9h(A), 4gss(A), 9gss(A).


 
7. Ligand: GBX × 2
2-Amino-4-[1-(Carboxymethyl-Carbamoyl)-2-(9-Hydroxy-7, 8-Dioxo-7,8,9,10-Tetrahydro-
Benzo[def]chrysen-10- Ylsulfanyl)-Ethylcarbamoyl]-Butyric acid
PDB codes: 3pgt(A), 4pgt(A).


 
8. Ligand: GDN × 1
Glutathione s-(2,4 dinitrobenzene)
PDB code: 18gs(A).


 
9. Ligand: BSP × 1
3,3'-(4,5,6,7-Tetrabromo-3-Oxo-1(3h)- Isobenzofuranylidene)bis [6-
Hydroxybenzenesulfonic acid]anion
PDB code: 19gs(A).


 
10. Ligand: MES × 1
2-(N-Morpholino)-Ethanesulfonic acid
PDB code: 3pgt(A).


 
11. Ligand: SO4 × 1
Sulfate ion
PDB code: 3pgt(A).


 
12. Ligand: CBD × 1
Cibacron blue
PDB code: 20gs(A).


 
13. Ligand: CO3 × 3
Carbonate ion
PDB codes: 3hjm(A), 3hkr(A), 3kmn(A).


 
14. Ligand: GSH-EAA × 2
GSH=Glutathione, EAA=Ethacrynic acid.
PDB codes: 11gs(A), 3gss(A).


 
15. Ligand: LZ6 × 2
L-Gamma-Glutamyl-S-(2-{[4-(3-Carboxypropyl)phenyl](2- Chloroethyl)amino}ethyl)-L-Cysteinylglycine
PDB codes: 3csh(A), 3csi(A).


 
16. Ligand: N11 × 2
6-[(7-Nitro-2,1,3-Benzoxadiazol-4-Yl)sulfanyl]hexan-1- Ol
PDB codes: 3gus(A), 3ie3(A).

_Ca
 
17. Metal: _CA × 2
PDB codes: 3hkr(A), 3n9j(A).


 
18. Ligand: 0HG × 1
N-[(4s)-4-Ammonio-4-Carboxybutanoyl]-S-(4-Bromobenzyl)- L-Cysteinylglycine
PDB code: 1aqv(A).


 
19. Ligand: 0HH × 1
L-Gamma-Glutamyl-S-Nonyl-L-Cysteinylglycine
PDB code: 12gs(A).


 
20. Ligand: GTD × 1
1-(S-Glutathionyl)-2,4,6-Trinitrocyclohexa-2,5-Diene
PDB code: 1aqx(A).

 + more. Press for full list
 

 

 Cluster 2 contains 15 ligand types

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Ligand Description


 
1. Ligand: GSH × 21
glutathione
Glutathione
PDB codes: 13gs(A), 19gs(A), 1aqw(A), 1kbn(A), 1lbk(A), 1md3(A), 1md4(A), 1px6(A), 1px7(A), 3csh(A), 3csi(A), 3dd3(A), 3gus(A), 3hjo(A), 3ie3(A), 3km6(A), 3kmo(A), 5gss(A), 6gss(A), 7gss(A), 8gss(A).


 
2. Ligand: GSN × 2
2-Amino-5-[1-(Carboxylatomethylcarbamoyl)-2- Nitrososulfanyl-Ethyl]amino-5-Oxo-Pentanoate
PDB codes: 2a2r(A), 2a2s(A).


 
3. Ligand: GPR × 1
(9r,10r)-9-(S-Glutathionyl)-10-Hydroxy-9,10- Dihydrophenanthrene
PDB code: 2pgt(A).


 
4. Ligand: GTX × 5
S-Hexylglutathione
PDB codes: 17gs(A), 1pgt(A), 2j9h(A), 4gss(A), 9gss(A).


 
5. Ligand: GBX × 2
2-Amino-4-[1-(Carboxymethyl-Carbamoyl)-2-(9-Hydroxy-7, 8-Dioxo-7,8,9,10-Tetrahydro-
Benzo[def]chrysen-10- Ylsulfanyl)-Ethylcarbamoyl]-Butyric acid
PDB codes: 3pgt(A), 4pgt(A).


 
6. Ligand: GDN × 1
Glutathione s-(2,4 dinitrobenzene)
PDB code: 18gs(A).


 
7. Ligand: GSH-EAA × 2
GSH=Glutathione, EAA=Ethacrynic acid.
PDB codes: 11gs(A), 3gss(A).


 
8. Ligand: LZ6 × 2
L-Gamma-Glutamyl-S-(2-{[4-(3-Carboxypropyl)phenyl](2- Chloroethyl)amino}ethyl)-L-Cysteinylglycine
PDB codes: 3csh(A), 3csi(A).

_Ca
 
9. Metal: _CA × 2
PDB codes: 3hkr(A), 3n9j(A).


 
10. Ligand: 0HG × 1
N-[(4s)-4-Ammonio-4-Carboxybutanoyl]-S-(4-Bromobenzyl)- L-Cysteinylglycine
PDB code: 1aqv(A).


 
11. Ligand: 0HH × 1
L-Gamma-Glutamyl-S-Nonyl-L-Cysteinylglycine
PDB code: 12gs(A).


 
12. Ligand: GTD × 1
1-(S-Glutathionyl)-2,4,6-Trinitrocyclohexa-2,5-Diene
PDB code: 1aqx(A).


 
13. Ligand: LEE × 1
L-Gamma-Glutamyl-S-Hexyl-L-Cysteinylglycine
PDB code: 1gss(A).


 
14. Ligand: VWW × 1
L-Gamma-Glutamyl-S-Benzyl-N-[(S)-Carboxy(phenyl) methyl]-L-Cysteinamide
PDB code: 10gs(A).

_Cl
 
15. Metal: _CL × 1
PDB code: 3hjm(A).

 

 Cluster 3 contains 3 ligand types

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Ligand Description


 
1. Ligand: EPE × 2
4-(2-Hydroxyethyl)-1-Piperazine ethanesulfonic acid
PDB codes: 1pgt(A), 2pgt(A).


 
2. Ligand: MES × 41
2-(N-Morpholino)-Ethanesulfonic acid
PDB codes: 10gs(A), 11gs(A), 12gs(A), 13gs(A), 14gs(A), 16gs(A), 17gs(A), 18gs(A), 19gs(A), 1aqv(A), 1aqw(A), 1aqx(A), 1kbn(A), 1lbk(A), 1md3(A), 1md4(A), 1px6(A), 1px7(A), 20gs(A), 22gs(A), 2a2r(A), 2a2s(A), 2gss(A), 3gss(A), 3pgt(A), 4gss(A), 4pgt(A), 5gss(A), 6gss(A), 7gss(A), 9gss(A), 3csh(A), 3csi(A), 3csj(A), 3dd3(A), 3dgq(A), 3gus(A), 3hjm(A), 3hkr(A), 3ie3(A), 3n9j(A).

_Ca
 
3. Metal: _CA × 4
PDB codes: 3hjo(A), 3km6(A), 3kmo(A),

 

 Cluster 4 contains 2 ligand types

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Ligand Description


 
1. Ligand: MES × 5
2-(N-Morpholino)-Ethanesulfonic acid
PDB codes: 13gs(A), 17gs(A), 22gs(A), 2gss(A), 5gss(A).


 
2. Ligand: SO4 × 1
Sulfate ion
PDB code: 3pgt(A).

 

 Cluster 5 contains 2 ligand types

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Ligand Description


 
1. Ligand: MES × 2
2-(N-Morpholino)-Ethanesulfonic acid
PDB codes: 1aqw(A), 1aqx(A).

_Ca
 
2. Metal: _CA × 2
PDB codes: 3hjo(A), 3kmn(A).

 

 Cluster 6 contains 2 ligand types

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Ligand Description


 
1. Ligand: SO4 × 2
Sulfate ion
PDB codes: 2pgt(A), 4pgt(A).


 
2. Ligand: CO3 × 1
Carbonate ion
PDB code: 3hjo(A).

 

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