Ligand clusters for UniProt code Q9ZEU2

Ligand clusters for Q9ZEU2: Amylosucrase from Neisseria polysaccharea

		Top 6 (of 20) ligand clusters Cluster 1. 8 ligand types 27 ligands Cluster 2. 5 ligand types 8 ligands Cluster 3. 6 ligand types 6 ligands Cluster 4. 4 ligand types 6 ligands Cluster 5. 3 ligand types 4 ligands Cluster 6. 4 ligand types 7 ligands
Representative protein: 3ueqA

Structures

PDB		Schematic diagram
3ueqA
1mw2A
4flrA
4floA
1mvyA
		more ...

Cluster 1 contains 8 ligand types

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Ligand		Description
		1. Ligand: BGC × 1 Beta-D-Glucopyranose PDB code: 1s46(A).
		2. Ligand: TRS × 10 tromethamine 2-Amino-2-Hydroxymethyl-Propane-1,3-Diol PDB codes: 1g5a(A), 1mvy(A), 1mw1(A), 1mw2(A), 1mw3(A), 4flo(A), 4flq(A), 4flr(A), 5n6v(A), 5n7j(A).
		3. Ligand: GOL × 9 glycerin Glycerol PDB codes: 4flo(A), 4flq(A), 4flr(A),
		4. Ligand: GLC × 1 d-glucose Alpha-D-Glucopyranose PDB code: 1jg9(A).
		5. Ligand: GLC-FRU × 3 GLC=Alpha-D-Glucopyranose, FRU=Beta-D-Fructofuranose. PDB codes: 1jgi(A), 1zs2(A), 4fls(A).
		6. Ligand: EPE × 1 4-(2-Hydroxyethyl)-1-Piperazine ethanesulfonic acid PDB code: 1g5a(A).
		7. Ligand: GLC-GLC-GLC-GLC-GLC-GLC-GLC × 1 GLC=Alpha-D-Glucopyranose. PDB code: 1mw0(A).
		8. Ligand: OTU × 1 3-O-Alpha-D-Glucopyranosyl-D-Fructose PDB code: 3ueq(A).

Cluster 2 contains 5 ligand types

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Ligand		Description
		1. Ligand: GLC × 2 d-glucose Alpha-D-Glucopyranose PDB codes: 1jg9(A), 5n6v(A).
		2. Ligand: GOL × 1 glycerin Glycerol PDB code: 4flr(A).
		3. Ligand: GLC-GLC-GLC-GLC × 3 GLC=Alpha-D-Glucopyranose. PDB codes: 1mvy(A), 1mw2(A), 1zs2(A).
		4. Ligand: GLC-GLC-GLC × 1 GLC=Alpha-D-Glucopyranose. PDB code: 5n7j(A).
		5. Ligand: GLC-GLC-GLC-GLC-GLC-GLC-GLC × 1 GLC=Alpha-D-Glucopyranose. PDB code: 1mw0(A).

Cluster 3 contains 6 ligand types

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Ligand		Description
		1. Ligand: GLC × 1 d-glucose Alpha-D-Glucopyranose PDB code: 1jg9(A).
		2. Ligand: FRU-GLC × 1 FRU=Beta-D-Fructofuranose, GLC=Alpha-D-Glucopyranose. PDB code: 3ueq(A).
		3. Ligand: GLC-FRU × 1 GLC=Alpha-D-Glucopyranose, FRU=Beta-D-Fructofuranose. PDB code: 5n7j(A).
		4. Ligand: GLC-GLC × 1 GLC=Alpha-D-Glucopyranose. PDB code: 1mvy(A).
		5. Ligand: GLC-GLC-GLC × 1 GLC=Alpha-D-Glucopyranose. PDB code: 1zs2(A).
		6. Ligand: GLC-GLC-GLC-BGC × 1 GLC=Alpha-D-Glucopyranose, BGC=Beta-D-Glucopyranose. PDB code: 1mw0(A).

Cluster 4 contains 4 ligand types

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Ligand		Description
		1. Ligand: GOL × 1 glycerin Glycerol PDB code: 4flr(A).
		2. Ligand: 1PE × 3 Pentaethylene glycol PDB codes: 4flr(A), 5n6v(A), 5n7j(A).
		3. Ligand: P6G × 1 Hexaethylene glycol PDB code: 4flo(A).
		4. Ligand: PG4 × 1 Tetraethylene glycol PDB code: 4flq(A).

Cluster 5 contains 3 ligand types

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Ligand		Description
		1. Ligand: GOL × 2 glycerin Glycerol PDB codes: 4flq(A), 4flr(A).
		2. Ligand: GLC-FRU × 1 GLC=Alpha-D-Glucopyranose, FRU=Beta-D-Fructofuranose. PDB code: 1mw3(A).
		3. Ligand: PGE × 1 Triethylene glycol PDB code: 4flq(A).

Cluster 6 contains 4 ligand types

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Ligand		Description
		1. Ligand: GOL × 4 glycerin Glycerol PDB codes: 4flo(A), 4flq(A), 4flr(A), 4fls(A).
		2. Ligand: 1PE × 1 Pentaethylene glycol PDB code: 5n7j(A).
		3. Ligand: PEG × 1 Di(hydroxyethyl)ether PDB code: 3ueq(A).
		4. Ligand: PGE × 1 Triethylene glycol PDB code: 5n6v(A).