Ligand clusters for UniProt code G4VLE5

Ligand clusters for G4VLE5: Sulfotransferase oxamniquine resistance protein OS=Schistosoma mansoni GN=SULT-OR PE=1 SV=1

		2 ligand clusters Cluster 1. 10 ligand types 27 ligands Cluster 2. 2 ligand types 2 ligands
Representative protein: 6bdqA

Structures

PDB		Schematic diagram
6bdqA
6bdrA
6bdpA
6b4yA
6bdsA
		more ...

Cluster 1 contains 10 ligand types

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Ligand		Description
		1. Ligand: OAQ × 4 oxamniquine {(2s)-7-Nitro-2-[(Propan-2-Ylamino)methyl]-1,2,3,4- Tetrahydroquinolin-6-Yl}methanol PDB codes: 4mub(A), 5byk(A), 6b4y(A), 6b50(A).
		2. Ligand: TRS × 2 tromethamine 2-Amino-2-Hydroxymethyl-Propane-1,3-Diol PDB codes: 6b4x(A), 6b4z(A).
		3. Ligand: A3P × 14 Adenosine-3'-5'-Diphosphate PDB codes: 4mua(A), 4mub(A), 5byj(A), 5byk(A), 6b4x(A), 6b4y(A), 6b4z(A), 6b50(A), 6bdp(A), 6bdq(A), 6bdr(A), 6bds(A), 6mfe(A), 6uux(A).
		4. Ligand: DE4 × 1 [2-[Oxidanyl(oxidanylidene)-L^{4}-Azanyl]-4-[[(3~{r})- 1-(Phenylmethyl)pyrrolidin-3- Yl]amino]phenyl]methanol PDB code: 6bdp(A).
		5. Ligand: DE7 × 1 [2-[Oxidanyl(oxidanylidene)-L^{4}-Azanyl]-4-[[(3~{s})- Piperidin-3-Yl]amino]phenyl]methanol PDB code: 6bdq(A).
		6. Ligand: DF7 × 1 [4-[[(3~{r})-1-(1~{h}-Indol-3-Ylmethyl)pyrrolidin-3- Yl]amino]-2-[Oxidanyl(oxidanylidene)-L^{4}- Azanyl]phenyl]methanol PDB code: 6bdr(A).
		7. Ligand: DJ4 × 1 [2-[Oxidanyl(oxidanylidene)-L^{4}-Azanyl]-4-[[(3~{s})- 1-[[4- (Trifluoromethyl)phenyl]methyl]pyrrolidin-3- Yl]amino]phenyl]methanol PDB code: 6bds(A).
		8. Ligand: OQR × 1 {(2r)-7-Nitro-2-[(Propan-2-Ylamino)methyl]-1,2,3,4- Tetrahydroquinolin-6-Yl}methanol PDB code: 5byj(A).
		9. Ligand: QHM × 1 Hycanthone PDB code: 6uux(A).
		10. Ligand: S73 × 1 (2-Nitro-4-{[(3s)-1-{[4-(Trifluoromethoxy) phenyl]methyl}pyrrolidin-3-Yl]amino}phenyl)methanol PDB code: 6mfe(A).

Cluster 2 contains 2 ligand types

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Ligand		Description
		1. Ligand: DF7 × 1 [4-[[(3~{r})-1-(1~{h}-Indol-3-Ylmethyl)pyrrolidin-3- Yl]amino]-2-[Oxidanyl(oxidanylidene)-L^{4}- Azanyl]phenyl]methanol PDB code: 6bdr(A).
		2. Ligand: DJ4 × 1 [2-[Oxidanyl(oxidanylidene)-L^{4}-Azanyl]-4-[[(3~{s})- 1-[[4- (Trifluoromethyl)phenyl]methyl]pyrrolidin-3- Yl]amino]phenyl]methanol PDB code: 6bds(A).