Ligand clusters for UniProt code P14061

Ligand clusters for P14061: Estradiol 17-beta-dehydrogenase 1 from Homo sapiens

		Top 6 (of 10) ligand clusters Cluster 1. 21 ligand types 39 ligands Cluster 2. 4 ligand types 11 ligands Cluster 3. 1 ligand type 1 ligand Cluster 4. 1 ligand type 1 ligand Cluster 5. 1 ligand type 2 ligands Cluster 6. 1 ligand type 1 ligand
Representative protein: 1a27A

Structures

PDB		Schematic diagram
1a27A
1i5rA
1fduA
1fdvA
3dheA
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Cluster 1 contains 21 ligand types (of which only 20 are listed. Click for all)

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Ligand		Description
		1. Ligand: NAP × 7 Nadp nicotinamide-Adenine-Dinucleotide phosphate PDB codes: 1a27(A), 1equ(A), 1fdt(A), 1fdu(A), 1qyv(A), 1qyw(A), 1qyx(A).
		2. Ligand: EQI × 1 Equilin PDB code: 1equ(A).
		3. Ligand: NAD × 1 Nicotinamide-Adenine-Dinucleotide PDB code: 1fdv(A).
		4. Ligand: EST × 6 estradiol Estradiol PDB codes: 1a27(A), 1fds(A), 1fdt(A), 1fdu(A), 1fdw(A), 1iol(A).
		5. Ligand: GOL × 2 glycerin Glycerol PDB codes: 1i5r(A), 6dtp(A).
		6. Ligand: AND × 1 prasterone 3-Beta-Hydroxy-5-Androsten-17-One PDB code: 3dhe(A).
		7. Ligand: J3Z × 1 estrone (9beta,13alpha)-3-Hydroxyestra-1,3,5(10)-Trien-17-One PDB code: 6mne(A).
		8. Ligand: TES × 1 testosterone Testosterone PDB code: 1jtv(A).
		9. Ligand: DHT × 1 5-Alpha-Dihydrotestosterone PDB code: 1dht(A).
		10. Ligand: 5SD × 1 5alpha-Androstan-3,17-Dione PDB code: 1qyw(A).
		11. Ligand: ASD × 1 4-Androstene-3-17-Dione PDB code: 1qyx(A).
		12. Ligand: HYC × 1 O5'-[9-(3,17b-Dihydroxy-1,3,5(10)-Estratrien-16b-Yl)- Nonanoyl]adenosine PDB code: 1i5r(A).
		13. Ligand: NAP × 5 Nadp nicotinamide-Adenine-Dinucleotide phosphate PDB codes: 3hb5(X), 3km0(A), 6cgc(A), 6cge(A), 6mne(A).
		14. Ligand: DHT × 2 5-Alpha-Dihydrotestosterone PDB codes: 3dey(X), 3klm(X).
		15. Ligand: E2B × 2 3-{[(9beta,14beta,16alpha,17alpha)-3,17-Dihydroxyestra- 1,3,5(10)-Trien-16-Yl]methyl}benzamide PDB codes: 3hb4(X), 3hb5(X).
		16. Ligand: AOM × 1 5-Alpha-Androstane-3-Beta,17beta-Diol PDB code: 3km0(A).
		17. Ligand: B81 × 1 (3alpha,8alpha,17beta)-Androst-5-Ene-3,17-Diol PDB code: 3klp(X).
		18. Ligand: EM9 × 1 N-Butyl-11-[(7alpha,9beta,13alpha,14beta,16alpha, 17alpha)-16-Chloro-3,17-Dihydroxyestra-1,3,5(10)- Trien-7-Yl]-N-Methylundecanamide PDB code: 6dtp(A).
		19. Ligand: F0A × 1 3-{[(9beta,14beta,16alpha,17alpha)-3,17-Dihydroxy-2- Methoxyestra-1,3,5(10)-Trien-16- Yl]methyl}benzamide PDB code: 6cgc(A).
		20. Ligand: F0D × 1 3-{[(14beta,16alpha,17alpha)-3-(2-Bromoethyl)-17- Hydroxyestra-1,3,5(10)-Trien-16- Yl]methyl}benzamide PDB code: 6cge(A).
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Cluster 2 contains 4 ligand types

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Ligand		Description
		1. Ligand: GOL × 8 glycerin Glycerol PDB codes: 1i5r(A), 1jtv(A), 1qyv(A), 1qyw(A), 1qyx(A), 6dtp(A),
		2. Ligand: EDO × 1 1,2-Ethanediol PDB code: 6dtp(A).
		3. Ligand: PEG × 1 Di(hydroxyethyl)ether PDB code: 6mnc(A).
		4. Ligand: SO4 × 1 Sulfate ion PDB code: 1fdt(A).

Cluster 3 contains 1 ligand type

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Ligand		Description
		1. Ligand: PGE × 1 Triethylene glycol PDB code: 6dtp(A).

Cluster 4 contains 1 ligand type

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

Cluster 5 contains 1 ligand type

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Ligand		Description
		1. Ligand: GOL × 2 glycerin Glycerol PDB codes: 3dey(X), 3klm(X).

Cluster 6 contains 1 ligand type

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Ligand		Description
		1. Ligand: GOL × 1 glycerin Glycerol PDB code: 6dtp(A).