Ligand clusters for UniProt code A4GRE3

Ligand clusters for A4GRE3: Macrophage migration inhibitory factor OS=Ancylostoma ceylanicum PE=1 SV=1

		Top 6 (of 8) ligand clusters Cluster 1. 2 ligand types 2 ligands Cluster 2. 2 ligand types 2 ligands Cluster 3. 3 ligand types 5 ligands Cluster 4. 3 ligand types 3 ligands Cluster 5. 2 ligand types 2 ligands Cluster 6. 2 ligand types 4 ligands
Representative protein: 2os5A

Structures

PDB		Schematic diagram
2os5A
3rf4A
3rf5A

Cluster 1 contains 2 ligand types

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Ligand		Description
		1. Ligand: FUN × 1 furosemide 5-(Aminosulfonyl)-4-Chloro-2-[(2-Furylmethyl) amino]benzoic acid PDB code: 3rf4(A).
		2. Ligand: FUZ × 1 2-[(Furan-2-Ylmethyl)amino]benzoic acid PDB code: 3rf5(A).

Cluster 2 contains 2 ligand types

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Ligand		Description
		1. Ligand: FUN × 1 furosemide 5-(Aminosulfonyl)-4-Chloro-2-[(2-Furylmethyl) amino]benzoic acid PDB code: 3rf4(A).
		2. Ligand: FUZ × 1 2-[(Furan-2-Ylmethyl)amino]benzoic acid PDB code: 3rf5(A).

Cluster 3 contains 3 ligand types

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Ligand		Description
_Zn		1. Metal: _ZN × 2 PDB codes: 3rf4(A), 3rf5(A).
		2. Ligand: ACT × 1 acetic acid Acetate ion PDB code: 3rf5(A).
		3. Ligand: IMD × 2 Imidazole PDB codes: 3rf4(A), 3rf5(A).

Cluster 4 contains 3 ligand types

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Ligand		Description
		1. Ligand: ACT × 1 acetic acid Acetate ion PDB code: 3rf5(A).
_Zn		2. Metal: _ZN × 1 PDB code: 3rf5(A).
		3. Ligand: IMD × 1 Imidazole PDB code: 3rf5(A).

Cluster 5 contains 2 ligand types

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Ligand		Description
		1. Ligand: ACT × 1 acetic acid Acetate ion PDB code: 3rf4(A).
		2. Ligand: SO4 × 1 Sulfate ion PDB code: 2os5(A).

Cluster 6 contains 2 ligand types

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Ligand		Description
		1. Ligand: ACT × 2 acetic acid Acetate ion PDB codes: 3rf4(A), 3rf5(A).
		2. Ligand: IMD × 2 Imidazole PDB codes: 3rf4(A), 3rf5(A).