Ligand clusters for UniProt code P14735

Ligand clusters for P14735: Insulin-degrading enzyme from Homo sapiens

		Top 6 (of 14) ligand clusters Cluster 1. 42 ligand types 99 ligands Cluster 2. 2 ligand types 13 ligands Cluster 3. 2 ligand types 3 ligands Cluster 4. 2 ligand types 3 ligands Cluster 5. 1 ligand type 1 ligand Cluster 6. 1 ligand type 1 ligand
Representative protein: 2g49A

Structures

PDB		Schematic diagram
2g49A
4lteA
6byzA
3e4aA
3cwwA
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Cluster 1 contains 42 ligand types (of which only 20 are listed. Click for all)

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Ligand		Description
_Zn		1. Metal: _ZN × 34 PDB codes: 2g54(A), 2jg4(A), 2wby(A), 2wc0(A), 2wk3(A), 2ypu(A), 3cww(A), 3e4a(A), 3e4z(A), 3e50(A), 3h44(A), 3hgz(A), 3n56(A), 3n57(A), 3ofi(A), 3qz2(A), 4dtt(A), 4dwk(A), 4gs8(A), 4gsc(A), 4gsf(A), 4ifh(A), 4iof(A), 4lte(A), 4m1c(A), 4nxo(A), 4pes(A), 4pf7(A), 4pf9(A), 4pfc(A), 4qia(A), 4ral(A), 4re9(A), 5cjo(A).
		2. Ligand: ACY × 2 acetic acid Acetic acid PDB codes: 3e4a(A),
		3. Ligand: DIO × 11 1,4-Diethylene dioxide PDB codes: 2g47(A), 2g48(A), 2g49(A), 2g54(A), 2g56(A), 2jbu(A), 2wc0(A), 3cww(A), 3h44(A), 3n56(A).
		4. Ligand: PEG × 7 Di(hydroxyethyl)ether PDB codes: 4nxo(A), 4re9(A),
		5. Ligand: ALA-ALA-ALA × 4 PDB codes: 2jbu(A), 3e4a(A), 4pes(A), 6byz(A).
		6. Ligand: I41 × 3 2-[[2-[[(2s)-3-(3h-Imidazol-4-Yl)-1-Methoxy- 1-Oxo-Propan-2-Yl]amino]-2-Oxo-Ethyl]- (Phenylmethyl)amino]ethanoic acid PDB codes: 2ypu(A), 4dtt(A),
		7. Ligand: 1PE × 2 Pentaethylene glycol PDB codes: 4nxo(A), 4re9(A).
		8. Ligand: J22 × 2 {(8r,9s,10s)-9-(2',3'-Dimethyl[1,1'-Biphenyl]-4-Yl)-6- [(1-Methyl-1h-Imidazol-2-Yl)sulfonyl]-1,6- Diazabicyclo[6.2.0]decan-10-Yl}methanol PDB codes: 6eds(A), 6mq3(A).
		9. Ligand: 2H7 × 1 4-Fluoro-N-({1-[(2r)-4-(Hydroxyamino)-1-(Naphthalen-2- Yl)-4-Oxobutan-2-Yl]-1h-1,2,3-Triazol-4- Yl}methyl) benzamide PDB code: 4nxo(A).
		10. Ligand: 2PJ × 1 Tert-Butyl [(2s)-2-(2,5-Difluorophenyl)-3-(Quinolin-3- Yl)propyl]carbamate PDB code: 4pes(A).
		11. Ligand: 2Q6 × 1 Methyl [(2s)-2-[4-({5-[4-({(2s)-2-[(3s)-3-Amino-2- Oxopiperidin-1-Yl]-2- Cyclohexylacetyl}amino) phenyl]pentyl}oxy)phenyl]-3-(Quinolin-3-Yl) propyl]carbamate PDB code: 4pf9(A).
		12. Ligand: 2QW × 1 (2s)-2-Amino-N-{(1s)-1-Cyclohexyl-2-[(4-Methylphenyl) amino]-2-Oxoethyl}-4- (Methylselanyl)butanamide PDB code: 4pf7(A).
		13. Ligand: 2QX × 1 Methyl [(2s)-2-(5-{5-[4-({(2s)-2-[(3s)-3-Amino-2- Oxopiperidin-1-Yl]-2- Cyclohexylacetyl}amino) phenyl]pentyl}-2-Fluorophenyl)-3-(Quinolin-3-Yl) propyl]carbamate PDB code: 4pfc(A).
		14. Ligand: 33K × 1 N-Benzyl-N-(Carboxymethyl)glycyl-L-Histidine PDB code: 4qia(A).
		15. Ligand: 3M9 × 1 4-Fluoro-N-({1-[(2r)-4-(Hydroxyamino)-1-(Naphthalen-2- Yl)-4-Oxobutan-2-Yl]-1h-1,2,3-Triazol-5- Yl}methyl) benzamide PDB code: 4re9(A).
		16. Ligand: ACT × 1 Acetate ion PDB code: 3cww(A).
		17. Ligand: ALA-ALA-ALA-ALA-ALA-ALA-ALA × 1 PDB code: 2jbu(A).
		18. Ligand: ALA-PRO-PRO × 1 PDB code: 3cww(A).
		19. Ligand: ALA-SER-LEU-ALA × 1 PDB code: 3h44(A).
		20. Ligand: ALA-TYR-ARG × 1 PDB code: 3e4z(A).
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Cluster 2 contains 2 ligand types

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Ligand		Description
		1. Ligand: EPE × 7 4-(2-Hydroxyethyl)-1-Piperazine ethanesulfonic acid PDB codes: 4lte(A), 4nxo(A), 4re9(A), 5cjo(A), 6byz(A), 6eds(A), 6mq3(A).
		2. Ligand: DIO × 6 1,4-Diethylene dioxide PDB codes: 2jg4(A), 3cww(A), 3e4a(A), 3ofi(A).

Cluster 3 contains 2 ligand types

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Ligand		Description
		1. Ligand: PEG × 2 Di(hydroxyethyl)ether PDB codes: 4nxo(A), 4re9(A).
		2. Ligand: EDO × 1 1,2-Ethanediol PDB code: 4nxo(A).

Cluster 4 contains 2 ligand types

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Ligand		Description
		1. Ligand: ACY × 1 acetic acid Acetic acid PDB code: 3e4a(A).
		2. Ligand: DIO × 2 1,4-Diethylene dioxide PDB codes: 2wc0(A), 6eds(A).

Cluster 5 contains 1 ligand type

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Ligand		Description
		1. Ligand: PEG × 1 Di(hydroxyethyl)ether PDB code: 6eds(A).

Cluster 6 contains 1 ligand type

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Ligand		Description
		1. Ligand: DIO × 1 1,4-Diethylene dioxide PDB code: 2wc0(A).