Ligand clusters for UniProt code Q13464

Ligand clusters for Q13464: Rho-associated protein kinase 1 from Homo sapiens

		5 ligand clusters Cluster 1. 25 ligand types 30 ligands Cluster 2. 2 ligand types 2 ligands Cluster 3. 1 ligand type 1 ligand Cluster 4. 1 ligand type 1 ligand Cluster 5. 1 ligand type 1 ligand
Representative protein: 2esmA

Structures

PDB		Schematic diagram
2esmA
5uzjA
3d9vA
2etkA
2etrA
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Cluster 1 contains 25 ligand types (of which only 20 are listed. Click for all)

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Ligand		Description
_Mg		1. Metal: _MG × 1 PDB code: 2v55(A).
		2. Ligand: M77 × 1 5-(1,4-Diazepan-1-Sulfonyl)isoquinoline PDB code: 2esm(A).
		3. Ligand: HFS × 1 1-(1-Hydroxy-5-Isoquinolinesulfonyl)homopiperazine PDB code: 2etk(A).
		4. Ligand: Y27 × 1 (R)-Trans-4-(1-Aminoethyl)-N-(4-Pyridyl) cyclohexanecarboxamide PDB code: 2etr(A).
		5. Ligand: 3NC × 2 Cis-4-Amino-N-(7-Chloro-1-Oxo-1,2-Dihydroisoquinolin-6- Yl)cyclohexanecarboxamide PDB codes: 3ncz(A),
		6. Ligand: B4J × 2 3,4-Dimethoxy-N-({3-[(5-Methyl-4,5,6,7-Tetrahydro[1, 3]thiazolo[5,4-C]pyridin-2- Yl) carbamoyl]phenyl}methyl)benzamide PDB codes: 5wne(A),
		7. Ligand: B4V × 2 1-(4-Amino-1,2,5-Oxadiazol-3-Yl)-5-Methyl-N-({3-[(5- Methyl-4,5,6,7-Tetrahydro[1,3]thiazolo[5,4- C]pyridin- 2-Yl)carbamoyl]phenyl}methyl)-1h-1,2,3-Triazole-4- Carboxamide PDB codes: 5wnf(A),
		8. Ligand: B4Y × 2 (2r)-N-(3-Cyanophenyl)-2-(3-{[(6s)-6-(Dimethylamino)-4, 5,6,7-Tetrahydro-1,3-Benzothiazol-2- Yl]carbamoyl}phenyl)pyrrolidine-1-Carboxamide PDB codes: 5wng(A),
		9. Ligand: B5G × 2 (2r)-N-(3-Cyanophenyl)-2-{3-[(5-Methyl-4,5,6,7- Tetrahydro[1,3]thiazolo[5,4-C]pyridin-2- Yl) carbamoyl]phenyl}pyrrolidine-1-Carboxamide PDB codes: 5wnh(A),
		10. Ligand: 07Q × 1 1-[(1r)-1-(3-Methoxyphenyl)ethyl]-3-(4-Pyridin-4-Yl-1, 3-Thiazol-2-Yl)urea PDB code: 3tv7(A).
		11. Ligand: 07R × 1 1-[(3-Hydroxyphenyl)methyl]-3-(4-Pyridin-4-Yl-1,3- Thiazol-2-Yl)urea PDB code: 3twj(A).
		12. Ligand: 0HD × 1 1-(1h-Indazol-5-Yl)-3-(2-Phenylethyl)urea PDB code: 3v8s(A).
		13. Ligand: 3J7 × 1 N~1~-[2-(1h-Indazol-5-Yl)pyrido[3,4-D]pyrimidin-4-Yl]- 2-Methylpropane-1,2-Diamine PDB code: 4w7p(A).
		14. Ligand: 4KH × 1 2-Fluoro-N-[4-(Pyridin-4-Yl)-1,3-Thiazol-2-Yl]benzamide PDB code: 4yvc(A).
		15. Ligand: 4KK × 1 2-(3-Methoxyphenyl)-N-[4-(Pyridin-4-Yl)-1,3-Thiazol-2- Yl]acetamide PDB code: 4yve(A).
		16. Ligand: 4TW × 1 N-[4-(2-Fluoropyridin-4-Yl)thiophen-2-Yl]-2-{3- [(Methylsulfonyl)amino]phenyl}acetamide PDB code: 5bml(A).
		17. Ligand: 65R × 1 2-{3-[3-(Piperidin-4-Yl)propoxy]phenyl}-N-[4-(Pyridin- 4-Yl)-1,3-Thiazol-2-Yl]acetamide PDB code: 5hvu(A).
		18. Ligand: 6U1 × 1 2-[3-(Methylsulfonylamino)phenyl]-~{N}-[4-(1~{h}- Pyrrolo[2,3-B]pyridin-3-Yl)-1,3-Thiazol-2- Yl]ethanamide PDB code: 5kks(A).
		19. Ligand: 6U2 × 1 2-[3-[3-(4-Methylpiperazin-1-Yl)propoxy]phenyl]-~{N}- [4-(1~{h}-Pyrrolo[2,3-B]pyridin-3-Yl)-1,3- Thiazol-2- Yl]ethanamide PDB code: 5kkt(A).
		20. Ligand: 8UV × 1 N-[4-(2-Aminopyridin-4-Yl)-1,3-Thiazol-2-Yl]-2-(3- Methoxyphenyl)acetamide PDB code: 5uzj(A).
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Cluster 2 contains 2 ligand types

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Ligand		Description
		1. Ligand: GOL × 1 glycerin Glycerol PDB code: 5wnf(A).
		2. Ligand: EDO × 1 1,2-Ethanediol PDB code: 3twj(A).

Cluster 3 contains 1 ligand type

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Ligand		Description
		1. Ligand: GOL × 1 glycerin Glycerol PDB code: 5wne(A).

Cluster 4 contains 1 ligand type

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Ligand		Description
		1. Ligand: GOL × 1 glycerin Glycerol PDB code: 5wnf(A).

Cluster 5 contains 1 ligand type

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Ligand		Description
		1. Ligand: SO4 × 1 Sulfate ion PDB code: 6e9w(A).