Ligand clusters for UniProt code Q07820

Ligand clusters for Q07820: Induced myeloid leukemia cell differentiation protein Mcl-1 from Homo sapiens

		Top 6 (of 8) ligand clusters Cluster 1. 16 ligand types 17 ligands Cluster 2. 1 ligand type 18 ligands Cluster 3. 1 ligand type 1 ligand Cluster 4. 1 ligand type 2 ligands Cluster 5. 1 ligand type 1 ligand Cluster 6. 1 ligand type 1 ligand
Representative protein: 4wmuA

Structures

PDB		Schematic diagram
4wmuA
6ybkA
6qynA
4wmxA
5lofA
		more ...

Cluster 1 contains 16 ligand types

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Ligand		Description
		1. Ligand: JLE × 2 (2~{r})-2-[[6-Ethyl-5-(1~{h}-Indol-4-Yl)thieno[2,3- D]pyrimidin-4-Yl]amino]-3-Phenyl-Propanoic acid PDB codes: 6qyl(A), 6qz7(A).
		2. Ligand: 19H × 1 6-Chloro-3-[3-(4-Chloro-3,5-Dimethylphenoxy)propyl]-1h- Indole-2-Carboxylic acid PDB code: 4wmu(A).
		3. Ligand: 3M6 × 1 (2s)-2-[(2s,3r)-10-{[(4-Fluorophenyl)sulfonyl]amino}-3- Methyl-2-[(Methyl{[4- (Trifluoromethyl) phenyl]carbamoyl}amino)methyl]-6-Oxo-3,4-Dihydro-2h-1, 5-Benzoxazocin-5(6h)- Yl]propanoic acid PDB code: 4wgi(A).
		4. Ligand: 3R4 × 1 3-Chloro-6-Fluoro-1-Benzothiophene-2-Carboxylic acid PDB code: 4wmv(A).
		5. Ligand: 3R6 × 1 2-Hydroxy-5-(Methylsulfanyl)benzoic acid PDB code: 4wmw(A).
		6. Ligand: 3R7 × 1 4-Ethenyl-2-[(Phenylsulfonyl)amino]benzoic acid PDB code: 4wmx(A).
		7. Ligand: 70R × 1 (2~{r})-2-[5-[3-Chloranyl-2-Methyl-4-[2-(4- Methylpiperazin-1-Yl)ethoxy]phenyl]-6-(5- Fluoranylfuran-2-Yl)thieno[2,3-D]pyrimidin-4-Yl]oxy-3- [2-[[2-[2,2,2- Tris(fluoranyl)ethyl]pyrazol-3- Yl]methoxy]phenyl]propanoic acid PDB code: 5lof(A).
		8. Ligand: 865 × 1 7-[2-(1h-Imidazol-1-Yl)-4-Methylpyridin-3-Yl]-3-[3- (Naphthalen-1-Yloxy)propyl]-1-[2-Oxo-2- (Piperazin-1- Yl)ethyl]-1h-Indole-2-Carboxylic acid PDB code: 4wmt(A).
		9. Ligand: J1N × 1 2-[(6-Ethyl-5-Phenyl-Thieno[2,3-D]pyrimidin-4-Yl) amino]-3-Oxidanyl-Propanoic acid PDB code: 6qgd(A).
		10. Ligand: JKQ × 1 (2~{r})-2-[[6-Ethyl-5-(1~{h}-Indol-5-Yl)thieno[2,3- D]pyrimidin-4-Yl]amino]propanoic acid PDB code: 6qxj(A).
		11. Ligand: JL8 × 1 (2~{r})-2-[5-(3-Chloranyl-2-Methyl-4-Oxidanyl-Phenyl)- 6-Ethyl-Thieno[2,3-D]pyrimidin-4-Yl]oxy-3- Phenyl- Propanoic acid PDB code: 6qyn(A).
		12. Ligand: JLB × 1 (2~{r})-2-[6-Ethyl-5-(1~{h}-Indol-5-Yl)thieno[2,3- D]pyrimidin-4-Yl]oxypropanoic acid PDB code: 6qyk(A).
		13. Ligand: JLH × 1 (2~{r})-2-[5-[3-Chloranyl-2-Methyl-4-[2-(4- Methylpiperazin-1-Yl)ethoxy]phenyl]-6-Ethyl- Thieno[2, 3-D]pyrimidin-4-Yl]oxy-3-Phenyl-Propanoic acid PDB code: 6qyo(A).
		14. Ligand: OJW × 1 (2~{r})-2-[5-[3-Chloranyl-2-Methyl-4-[2-(4- Methylpiperazin-1-Yl)ethoxy]phenyl]-6-(5- Fluoranylfuran-2-Yl)thieno[2,3-D]pyrimidin-4-Yl]oxy-3- [2-[(2-Methylpyrazol-3- Yl)methoxy]phenyl]propanoic acid PDB code: 6ybj(A).
		15. Ligand: OK2 × 1 (2~{r})-2-[5-[3-Chloranyl-2-Methyl-4-[2-(4- Methylpiperazin-1-Yl)ethoxy]phenyl]-6-(4- Fluorophenyl)thieno[2,3-D]pyrimidin-4-Yl]oxy-3-[2- (Pyrazin-2-Ylmethoxy)phenyl]propanoic acid PDB code: 6ybk(A).
		16. Ligand: OK5 × 1 (2~{r})-2-[5-[3-Chloranyl-2-Methyl-4-[2-(4- Methylpiperazin-1-Yl)ethoxy]phenyl]-6-(4- Fluorophenyl)thieno[2,3-D]pyrimidin-4-Yl]oxy-3-[2-[[2- (2-Methoxyphenyl)pyrimidin-4- Yl]methoxy]phenyl]propanoic acid PDB code: 6ybl(A).

Cluster 2 contains 1 ligand type

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Ligand		Description
		1. Ligand: GLC-GLC × 18 GLC=Alpha-D-Glucopyranose. PDB codes: 4wgi(A), 4wms(A), 4wmt(A), 4wmu(A), 4wmv(A), 4wmw(A), 4wmx(A), 5lof(A), 6qgd(A), 6qxj(A), 6qyk(A), 6qyl(A), 6qyn(A), 6qyo(A), 6qz7(A), 6ybj(A), 6ybk(A), 6ybl(A).

Cluster 3 contains 1 ligand type

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Ligand		Description
		1. Ligand: EDO × 1 1,2-Ethanediol PDB code: 4wms(A).

Cluster 4 contains 1 ligand type

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Ligand		Description
		1. Ligand: EDO × 2 1,2-Ethanediol PDB codes: 4wmt(A), 4wmu(A).

Cluster 5 contains 1 ligand type

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Ligand		Description
		1. Ligand: EDO × 1 1,2-Ethanediol PDB code: 4wmu(A).

Cluster 6 contains 1 ligand type

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Ligand		Description
		1. Ligand: EDO × 1 1,2-Ethanediol PDB code: 4wmu(A).