Ligand clusters for UniProt code P49761

Ligand clusters for P49761: Dual specificity protein kinase CLK3 from Homo sapiens

		Top 6 (of 46) ligand clusters Cluster 1. 15 ligand types 19 ligands Cluster 2. 5 ligand types 7 ligands Cluster 3. 2 ligand types 2 ligands Cluster 4. 4 ligand types 7 ligands Cluster 5. 3 ligand types 3 ligands Cluster 6. 2 ligand types 3 ligands
Representative protein: 6z55A

Structures

PDB		Schematic diagram
6z55A
6fyrA
6ytwA
6ytyA
6yu1a
		more ...

Cluster 1 contains 15 ligand types

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Ligand		Description
		1. Ligand: 3NG × 2 5-[(3-Chlorophenyl)amino]benzo[c][2,6]naphthyridine-8- Carboxylic acid PDB codes: 6fyp(A), 6khf(A).
		2. Ligand: EAE × 2 (1~{z})-1-(3-Ethyl-5-Methoxy-1,3-Benzothiazol-2- Ylidene)propan-2-One PDB codes: 6ytw(A), 6yty(A).
		3. Ligand: EDO × 2 1,2-Ethanediol PDB codes: 6ft7(A), 6z52(A).
		4. Ligand: KHC × 2 (4~{s})-7,8-Bis(chloranyl)-9-Methyl-1-Oxidanylidene- Spiro[2,4-Dihydropyrido[3,4-B]indole-3,4'- Piperidine]- 4-Carbonitrile PDB codes: 6yu1(a), 6z2v(A).
		5. Ligand: 3RA × 1 5-(1,3-Benzodioxol-5-Ylmethyl)-2-(Phenylamino)-4h- Imidazol-4-One PDB code: 3raw(A).
		6. Ligand: DKI × 1 5-Amino-3-{[4-(Aminosulfonyl)phenyl]amino}-N- (2,6-Difluorophenyl)-1h-1,2,4-Triazole-1- Carbothioamide PDB code: 2wu6(A).
		7. Ligand: E6Q × 1 3-Phenyl-1~{h}-Pyrrolo[3,4-G]indol-8-One PDB code: 6ft7(A).
		8. Ligand: EAQ × 1 6-~{Tert}-Butyl-~{N}-[6-(1~{h}-Pyrazol-4-Yl)-1~{h}- Imidazo[1,2-A]pyridin-2-Yl]pyridine-3- Carboxamide PDB code: 6fyr(A).
		9. Ligand: JWN × 1 4-[2-Methyl-1-(4-Methylpiperazin-1-Yl)-1-Oxidanylidene- Propan-2-Yl]-~{N}-(6-Pyridin-4- Ylimidazo[1,2- A]pyridin-2-Yl)benzamide PDB code: 6rct(A).
		10. Ligand: PQ5 × 1 7,10-Dioxa-13,17,18,21-Tetrazatetracyclo[12.5.2.12, 6.017,20]docosa-1(20),2(22),3,5,14(21),15,18- Heptaene- 5-Carboxylic acid PDB code: 6z55(A).
		11. Ligand: Q7H × 1 11,15-Dimethyl-6-(Oxan-4-Yloxy)-8-Oxa-2,11,15,19,21,23- Hexazatetracyclo[15.6.1.13,7.020,24]pentacosa-1(23), 3(25),4,6,17,20(24),21-Heptaen-10-One PDB code: 6z54(A).
		12. Ligand: Q7Z × 1 6-(2-Methoxyethoxy)-11,15-Dimethyl-8-Oxa-2,11,15,19,21, 23- Hexazatetracyclo[15.6.1.13,7.020,24]pentacosa- 1(23),3(25),4,6,17,20(24),21-Heptaen-10-One PDB code: 6z53(A).
		13. Ligand: Q8B × 1 N-Cyclopentyl-2-[(11,15-Dimethyl-10-Oxo-8-Oxa-2,11,15, 19,21,23- Hexazatetracyclo[15.6.1.13,7.020, 24]pentacosa-1(23),3(25),4,6,17,20(24),21-Heptaen-6- Yl)oxy]acetamide PDB code: 6z51(A).
		14. Ligand: Q8T × 1 11,15-Dimethyl-6-(4-Methylpiperazin-1-Yl)-8-Oxa-2,11, 15,19,21,23- Hexazatetracyclo[15.6.1.13,7.020, 24]pentacosa-1(23),3(25),4,6,17,20(24),21-Heptaen-10- One PDB code: 6z52(A).
		15. Ligand: V25 × 1 Ethyl 3-[(E)-2-Amino-1-Cyanoethenyl]-6,7- Dichloro-1-Methyl-1h-Indole-2-Carboxylate PDB code: 2wu7(A).

Cluster 2 contains 5 ligand types

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Ligand		Description
		1. Ligand: DMS × 1 dimethyl sulfoxide Dimethyl sulfoxide PDB code: 2wu6(A).
		2. Ligand: GOL × 1 glycerin Glycerol PDB code: 6ytw(A).
		3. Ligand: EDO × 2 1,2-Ethanediol PDB codes: 6z51(A), 6z53(A).
		4. Ligand: PO4 × 2 Phosphate ion PDB codes: 6yu1(a), 6z55(A).
		5. Ligand: SO4 × 1 Sulfate ion PDB code: 2wu7(A).

Cluster 3 contains 2 ligand types

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Ligand		Description
		1. Ligand: PG4 × 1 Tetraethylene glycol PDB code: 6yu1(a).
		2. Ligand: PO4 × 1 Phosphate ion PDB code: 6z55(A).

Cluster 4 contains 4 ligand types

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Ligand		Description
		1. Ligand: PO4 × 3 Phosphate ion PDB codes: 6ytw(A), 6yu1(a), 6z55(A).
		2. Ligand: EDO × 2 1,2-Ethanediol PDB codes: 6z53(A), 6z54(A).
		3. Ligand: SO4 × 1 Sulfate ion PDB code: 2wu6(A).
_Cl		4. Metal: _CL × 1 PDB code: 2wu6(A).

Cluster 5 contains 3 ligand types

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Ligand		Description
		1. Ligand: DMS × 1 dimethyl sulfoxide Dimethyl sulfoxide PDB code: 2wu6(A).
		2. Ligand: EDO × 1 1,2-Ethanediol PDB code: 2eu9(A).
		3. Ligand: SO4 × 1 Sulfate ion PDB code: 2wu7(A).

Cluster 6 contains 2 ligand types

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Ligand		Description
		1. Ligand: SO4 × 2 Sulfate ion PDB codes: 2wu6(A), 2wu7(A).
		2. Ligand: EDO × 1 1,2-Ethanediol PDB code: 6z55(A).