Ligand clusters for UniProt code P35747

Ligand clusters for P35747: Albumin from Equus caballus

		Top 6 (of 44) ligand clusters Cluster 1. 24 ligand types 59 ligands Cluster 2. 16 ligand types 44 ligands Cluster 3. 9 ligand types 9 ligands Cluster 4. 8 ligand types 11 ligands Cluster 5. 7 ligand types 14 ligands Cluster 6. 3 ligand types 6 ligands
Representative protein: 4f5tA

Structures

PDB		Schematic diagram
4f5tA
4f5uA
4j2vA
4zbrA
5iihA
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Cluster 1 contains 24 ligand types (of which only 20 are listed. Click for all)

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Ligand		Description
		1. Ligand: SIN × 8 succinic acid Succinic acid PDB codes: 4f5u(A), 4ot2(A), 4zbq(A), 4zbr(A), 5dby(A), 6oci(A), 6ocj(A).
_Zn		2. Metal: _ZN × 6 PDB codes: 5iix(A), 5ij5(A), 5ije(A),
		3. Ligand: 8QP × 2 etodolac [(1s)-1,8-Diethyl-1,3,4,9-Tetrahydropyrano[3,4-B]indol- 1-Yl]acetic acid PDB codes: 5v0v(A),
		4. Ligand: NPS × 2 naproxen (2s)-2-(6-Methoxynaphthalen-2-Yl)propanoic acid PDB codes: 4ot2(A), 4zbr(A).
		5. Ligand: CZE × 1 cetirizine (2-{4-[(S)-(4-Chlorophenyl)(phenyl)methyl]piperazin-1- Yl}ethoxy)acetic acid PDB code: 5dqf(A).
		6. Ligand: DEX × 1 dexamethasone Dexamethasone PDB code: 6xk0(A).
		7. Ligand: IBP × 1 dexibuprofen Ibuprofen PDB code: 6oci(A).
		8. Ligand: TES × 1 testosterone Testosterone PDB code: 6mdq(A).
		9. Ligand: TRS × 1 tromethamine 2-Amino-2-Hydroxymethyl-Propane-1,3-Diol PDB code: 5v0v(A).
		10. Ligand: ACT × 7 Acetate ion PDB codes: 4f5t(A), 4ot2(A), 4zbq(A), 5dby(A), 6ocj(A).
		11. Ligand: MLI × 7 Malonate ion PDB codes: 4f5u(A), 4j2v(A), 4ot2(A), 4zbr(A), 5id9(A).
		12. Ligand: SO4 × 6 Sulfate ion PDB codes: 4f5t(A), 5iih(A), 5iiu(A), 5iix(A), 7mbl(A).
		13. Ligand: LMR × 3 (2s)-2-Hydroxybutanedioic acid PDB codes: 4f5u(A), 4zbr(A), 5dby(A).
		14. Ligand: FLC × 2 Citrate anion PDB codes: 6mdq(A), 6xk0(A).
		15. Ligand: UNL × 2 Unknown ligand PDB codes: 6u4r(A), 6u4x(A).
		16. Ligand: 6A4 × 1 (4s)-2-Sulfanylidene-4-[(Tetradecanoyloxy)methyl]-1,3, 2lambda~5~-Dioxaphospholane-2-Thiolate PDB code: 5id9(A).
		17. Ligand: 8QS × 1 [(1r)-1,8-Diethyl-1,3,4,9-Tetrahydropyrano[3,4-B]indol- 1-Yl]acetic acid PDB code: 5v0v(A).
		18. Ligand: DIU × 1 2-Hydroxy-3,5-Diiodo-Benzoic acid PDB code: 4j2v(A).
		19. Ligand: EDO × 1 1,2-Ethanediol PDB code: 3v08(A).
		20. Ligand: KNA × 1 Nonanoic acid PDB code: 6ci6(A).
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Cluster 2 contains 16 ligand types

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Ligand		Description
		1. Ligand: DIF × 4 diclofenac 2-[2,6-Dichlorophenyl)amino]benzeneacetic acid PDB codes: 4zbq(A), 4zbr(A), 5dby(A).
		2. Ligand: NPS × 3 naproxen (2s)-2-(6-Methoxynaphthalen-2-Yl)propanoic acid PDB codes: 4ot2(A), 4zbr(A), 5dby(A).
		3. Ligand: GOL × 2 glycerin Glycerol PDB codes: 4f5t(A),
		4. Ligand: IBP × 2 dexibuprofen Ibuprofen PDB codes: 6oci(A), 6u4x(A).
		5. Ligand: NBO × 2 nabumetone Nabumetone PDB codes: 6ci6(A),
		6. Ligand: TRS × 2 tromethamine 2-Amino-2-Hydroxymethyl-Propane-1,3-Diol PDB codes: 5v0v(A),
		7. Ligand: 9KL × 1 dexketoprofen (2s)-2-[3-(Benzenecarbonyl)phenyl]propanoic acid PDB code: 6u4r(A).
		8. Ligand: SO4 × 12 Sulfate ion PDB codes: 3v08(A), 4f5t(A), 5dqf(A), 5iix(A), 6ci6(A), 6u4x(A), 6u5a(A), 7mbl(A),
		9. Ligand: ACT × 4 Acetate ion PDB codes: 4f5t(A), 4j2v(A), 4ot2(A), 5dby(A).
		10. Ligand: MLI × 4 Malonate ion PDB codes: 4f5u(A), 4j2v(A), 5dby(A), 6ocj(A).
		11. Ligand: DIU × 2 2-Hydroxy-3,5-Diiodo-Benzoic acid PDB codes: 4j2v(A),
		12. Ligand: PWY × 2 (6-Methoxynaphthalen-2-Yl)acetic acid PDB codes: 6u5a(A),
		13. Ligand: KNA × 1 Nonanoic acid PDB code: 6u4r(A).
		14. Ligand: M5A × 1 (2s)-2-[4-(Thiophene-2-Carbonyl)phenyl]propanoic acid PDB code: 6ocj(A).
		15. Ligand: PG4 × 1 Tetraethylene glycol PDB code: 5dqf(A).
		16. Ligand: UNL × 1 Unknown ligand PDB code: 5iix(A).

Cluster 3 contains 9 ligand types

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Ligand		Description
		1. Ligand: 9KL × 1 dexketoprofen (2s)-2-[3-(Benzenecarbonyl)phenyl]propanoic acid PDB code: 6u4r(A).
		2. Ligand: IBP × 1 dexibuprofen Ibuprofen PDB code: 6u4x(A).
		3. Ligand: LCR × 1 levocetirizine (2-{4-[(R)-(4-Chlorophenyl)(phenyl)methyl]piperazin-1- Yl}ethoxy)acetic acid PDB code: 5dqf(A).
		4. Ligand: SIN × 1 succinic acid Succinic acid PDB code: 6oci(A).
		5. Ligand: TES × 1 testosterone Testosterone PDB code: 6mdq(A).
		6. Ligand: TRS × 1 tromethamine 2-Amino-2-Hydroxymethyl-Propane-1,3-Diol PDB code: 5v0v(A).
		7. Ligand: ACT × 1 Acetate ion PDB code: 4f5t(A).
		8. Ligand: LMR × 1 (2s)-2-Hydroxybutanedioic acid PDB code: 4zbq(A).
		9. Ligand: MLI × 1 Malonate ion PDB code: 4ot2(A).

Cluster 4 contains 8 ligand types

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Ligand		Description
_Zn		1. Metal: _ZN × 4 PDB codes: 5iiu(A), 5iix(A), 5ij5(A), 5ije(A).
		2. Ligand: GOL × 1 glycerin Glycerol PDB code: 4f5t(A).
		3. Ligand: 8QS × 1 [(1r)-1,8-Diethyl-1,3,4,9-Tetrahydropyrano[3,4-B]indol- 1-Yl]acetic acid PDB code: 5v0v(A).
		4. Ligand: DIU × 1 2-Hydroxy-3,5-Diiodo-Benzoic acid PDB code: 4j2v(A).
		5. Ligand: FLC × 1 Citrate anion PDB code: 6mdq(A).
_Br		6. Metal: _BR × 1 PDB code: 3v08(A).
_Cl		7. Metal: _CL × 1 PDB code: 5dqf(A).
_Co		8. Metal: _CO × 1 PDB code: 7mbl(A).

Cluster 5 contains 7 ligand types

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Ligand		Description
		1. Ligand: GOL × 1 glycerin Glycerol PDB code: 4f5t(A).
		2. Ligand: TRS × 1 tromethamine 2-Amino-2-Hydroxymethyl-Propane-1,3-Diol PDB code: 6ci6(A).
		3. Ligand: SO4 × 7 Sulfate ion PDB codes: 5iix(A), 5ije(A), 5v0v(A), 6ci6(A), 6u4r(A), 6u4x(A), 6u5a(A).
		4. Ligand: MLI × 2 Malonate ion PDB codes: 5dby(A),
		5. Ligand: FLC × 1 Citrate anion PDB code: 6mdq(A).
		6. Ligand: UNL × 1 Unknown ligand PDB code: 5iix(A).
_Co		7. Metal: _CO × 1 PDB code: 7mbl(A).

Cluster 6 contains 3 ligand types

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Ligand		Description
		1. Ligand: 9KL × 1 dexketoprofen (2s)-2-[3-(Benzenecarbonyl)phenyl]propanoic acid PDB code: 6u4r(A).
		2. Ligand: MLI × 4 Malonate ion PDB codes: 4f5u(A), 4j2v(A), 4ot2(A), 5id9(A).
		3. Ligand: PG4 × 1 Tetraethylene glycol PDB code: 5dqf(A).