Ligand clusters for UniProt code P09958

Ligand clusters for P09958: Furin from Homo sapiens

		Top 6 (of 16) ligand clusters Cluster 1. 23 ligand types 50 ligands Cluster 2. 1 ligand type 1 ligand Cluster 3. 1 ligand type 1 ligand Cluster 4. 1 ligand type 11 ligands Cluster 5. 1 ligand type 9 ligands Cluster 6. 1 ligand type 2 ligands
Representative protein: 5jxgA

Structures

PDB		Schematic diagram
5jxgA
6hleA
6hlbA
6hldA
4omdA
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Cluster 1 contains 23 ligand types (of which only 20 are listed. Click for all)

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Ligand		Description
_Ca		1. Metal: _CA × 16 PDB codes: 4omc(A), 4omd(A), 4ryd(A), 4z2a(A), 5jxg(A), 5jxh(A), 6eqv(A), 6eqw(A), 6eqx(A), 6hlb(A), 6hld(A), 6hle(A), 6hza(A), 6hzb(A), 6hzc(A), 6hzd(A).
_Na		2. Metal: _NA × 7 PDB codes: 5jxg(A), 5jxh(A), 5jxi(A), 5jxj(A).
		3. Ligand: 2UC-ARG-VAL-ARG-00S × 3 2UC=1-[3-(2-Oxoethyl)benzyl]guanidine, 00S=4-(Aminomethyl)benzenecarboximidamide. PDB codes: 4omc(A), 5jxh(A), 5jxj(A).
		4. Ligand: PTD × 3 Pentanedial PDB codes: 6hza(A), 6hzb(A), 6hzd(A).
		5. Ligand: LYS-ARG-ARG-TBG-LYS-00S × 2 TBG=3-Methyl-L-Valine, 00S=4-(Aminomethyl)benzenecarboximidamide. PDB codes: 6hle(A), 6hzc(A).
		6. Ligand: PO4 × 2 Phosphate ion PDB codes: 4z2a(A),
		7. Ligand: 2UE-ARG-TBG-ARG-00S × 1 2UE=1-[4-(2-Oxoethyl)benzyl]guanidine, TBG=3-Methyl-L-Valine, 00S=4-(Aminomethyl)benzenecarboximidamide. PDB code: 4ryd(A).
		8. Ligand: 2UE-ARG-TBG-ON8-00S × 1 2UE=1-[4-(2-Oxoethyl)benzyl]guanidine, TBG=3-Methyl-L-Valine, ON8=1-[(3~{s})-3-Azanyl-4-Oxidanylidene-Butoxy]guanidine, 00S=4-(Aminomethyl)benzenecarboximidamide. PDB code: 6yd7(A).
		9. Ligand: 2UE-ON8-TBG-LYS-00S × 1 2UE=1-[4-(2-Oxoethyl)benzyl]guanidine, ON8=1-[(3~{s})-3-Azanyl-4-Oxidanylidene-Butoxy]guanidine, TBG=3-Methyl-L-Valine, 00S=4-(Aminomethyl)benzenecarboximidamide. PDB code: 6yd3(A).
		10. Ligand: 2UE-ON8-TBG-ON8-00S × 1 2UE=1-[4-(2-Oxoethyl)benzyl]guanidine, ON8=1-[(3~{s})-3-Azanyl-4-Oxidanylidene-Butoxy]guanidine, TBG=3-Methyl-L-Valine, 00S=4-(Aminomethyl)benzenecarboximidamide. PDB code: 6yd4(A).
		11. Ligand: ALN-ARG-ARG-ARG-SLL-LYS-00S × 1 ALN=Naphthalen-2-Yl-3-Alanine, SLL=(2s)-2-Azanyl-6-[(4-Hydroxy-4-Oxo-Butanoyl) amino]hexanoic acid, 00S=4-(Aminomethyl)benzenecarboximidamide. PDB code: 6hld(A).
		12. Ligand: ARG-ARG-ARG-ARG-SLL-ARG-00S × 1 SLL=(2s)-2-Azanyl-6-[(4-Hydroxy-4-Oxo-Butanoyl) amino]hexanoic acid, 00S=4-(Aminomethyl)benzenecarboximidamide. PDB code: 6hlb(A).
		13. Ligand: ARG-ARG-ARG-LYS-ARG-00S × 1 00S=4-(Aminomethyl)benzenecarboximidamide. PDB code: 6hzd(A).
		14. Ligand: ARG-ARG-ARG-VAL-ARG-00S × 1 00S=4-(Aminomethyl)benzenecarboximidamide. PDB code: 6eqx(A).
		15. Ligand: ARG-ARG-LYS-ARG-00S × 1 00S=4-(Aminomethyl)benzenecarboximidamide. PDB code: 6hza(A).
		16. Ligand: ARG-ARG-LYS-LYS-00S × 1 00S=4-(Aminomethyl)benzenecarboximidamide. PDB code: 6hzb(A).
		17. Ligand: BVK-ARG-TBG-ARG-00S × 1 BVK=2-[4-(Aminomethyl)phenyl]ethanoic acid, TBG=3-Methyl-L-Valine, 00S=4-(Aminomethyl)benzenecarboximidamide. PDB code: 6eqw(A).
		18. Ligand: BVK-ON8-TBG-LYS-00S × 1 BVK=2-[4-(Aminomethyl)phenyl]ethanoic acid, ON8=1-[(3~{s})-3-Azanyl-4-Oxidanylidene-Butoxy]guanidine, TBG=3-Methyl-L-Valine, 00S=4-(Aminomethyl)benzenecarboximidamide. PDB code: 6yd2(A).
		19. Ligand: DKA-ARG-VAL-LYS-AR7-0QE × 1 DKA=Decanoic acid, AR7=Amino{[(4s)-4-Amino-5,5- Dihydroxypentyl]amino}methaniminium, 0QE=Chloromethane. PDB code: 5jmo(A).
		20. Ligand: GEB × 1 3-[4-(3-Oxidanylidenepropyl)piperazin-1-Yl]propanal PDB code: 6hle(A).
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Cluster 2 contains 1 ligand type

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Ligand		Description
		1. Ligand: NAG × 1 n-acetylglucosamine 2-Acetamido-2-Deoxy-Beta-D-Glucopyranose PDB code: 5jmo(A).

Cluster 3 contains 1 ligand type

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Ligand		Description
		1. Ligand: NAG × 1 n-acetylglucosamine 2-Acetamido-2-Deoxy-Beta-D-Glucopyranose PDB code: 5jmo(A).

Cluster 4 contains 1 ligand type

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Ligand		Description
		1. Ligand: PO4 × 11 Phosphate ion PDB codes: 6hlb(A), 6hld(A), 6hle(A), 6hza(A), 6hzb(A), 6hzc(A), 6hzd(A), 6yd2(A), 6yd3(A), 6yd4(A), 6yd7(A).

Cluster 5 contains 1 ligand type

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Ligand		Description
		1. Ligand: PO4 × 9 Phosphate ion PDB codes: 6hlb(A), 6hld(A), 6hle(A), 6hza(A), 6hzb(A), 6hzc(A), 6hzd(A), 6yd2(A), 6yd3(A).

Cluster 6 contains 1 ligand type

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Ligand		Description
		1. Ligand: PO4 × 2 Phosphate ion PDB codes: 6yd4(A), 6yd7(A).