CodeA1H
NameMolidustat
Synonyms
  • Molidustat
  • Molidustat sodium
Identifier
FormulaC13 H14 N8 O2
Molecular Weight314.303
SMILES
PubChem59603622
Formal Charge0
Total Atoms37
Total Chiral Atoms0
Total Bonds40
Total Aromatic Bonds11
Networks20
 missing image

This ligand is also present in the following 20 networks:
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8RLN A Nucleotide Adenosine A2A Homo Sapiens LUF5834 - - 2.43 2024-06-19 doi.org/10.1021/acsptsci.4c00051

A 2D representation of the interactions of A1H in 8RLN
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
R:R:E13 R:R:Y9 19.08 1 Yes Yes 6 5 2 1
R:R:S67 R:R:Y9 3.82 1 No Yes 3 5 1 1
R:R:Y271 R:R:Y9 14.89 1 Yes Yes 3 5 1 1
L:L:?1 R:R:Y9 6.05 1 Yes Yes 0 5 0 1
R:R:E13 R:R:H278 12.31 1 Yes Yes 6 6 2 2
R:R:A59 R:R:V84 3.39 0 No No 6 6 2 1
L:L:?1 R:R:S67 7.75 1 Yes No 0 3 0 1
R:R:C82 R:R:L85 3.17 0 No Yes 5 4 2 1
L:L:?1 R:R:V84 8.78 1 Yes No 0 6 0 1
R:R:L85 R:R:M177 4.24 1 Yes Yes 4 6 1 1
R:R:L85 R:R:N181 6.87 1 Yes Yes 4 5 1 2
L:L:?1 R:R:L85 4.08 1 Yes Yes 0 4 0 1
R:R:T88 R:R:W246 8.49 0 No Yes 6 8 2 1
R:R:F168 R:R:V172 14.42 1 Yes No 4 3 1 2
R:R:F168 R:R:M177 6.22 1 Yes Yes 4 6 1 1
L:L:?1 R:R:F168 42.19 1 Yes Yes 0 4 0 1
R:R:M177 R:R:V172 3.04 1 Yes No 6 3 1 2
R:R:M174 R:R:N253 9.82 4 Yes No 4 5 2 1
R:R:M177 R:R:Y176 3.59 1 Yes Yes 6 6 1 2
R:R:N181 R:R:Y176 4.65 1 Yes Yes 5 6 2 2
R:R:M177 R:R:N181 7.01 1 Yes Yes 6 5 1 2
L:L:?1 R:R:M177 3.13 1 Yes Yes 0 6 0 1
R:R:H250 R:R:N181 3.83 0 Yes Yes 6 5 2 2
R:R:F242 R:R:W246 13.03 10 Yes Yes 9 8 2 1
R:R:H250 R:R:W246 3.17 0 Yes Yes 6 8 2 1
R:R:S277 R:R:W246 14.83 0 No Yes 7 8 2 1
L:L:?1 R:R:W246 10.07 1 Yes Yes 0 8 0 1
R:R:A273 R:R:L249 3.15 0 No No 6 5 2 1
R:R:L249 R:R:S277 3 0 No No 5 7 1 2
L:L:?1 R:R:L249 12.24 1 Yes No 0 5 0 1
L:L:?1 R:R:N253 4.05 1 Yes No 0 5 0 1
R:R:L267 R:R:Y271 19.93 0 No Yes 3 3 2 1
L:L:?1 R:R:Y271 3.46 1 Yes Yes 0 3 0 1
R:R:H278 R:R:I274 3.98 1 Yes No 6 4 2 1
L:L:?1 R:R:I274 14.73 1 Yes No 0 4 0 1
R:R:H278 R:R:S277 4.18 1 Yes No 6 7 2 2
R:R:A81 R:R:F168 2.77 0 No Yes 5 4 2 1
R:R:S6 R:R:Y271 2.54 0 No Yes 4 3 2 1
StatisticsValue
Average Number Of Links11.00
Average Number Of Links With An Hub6.00
Average Interaction Strength10.59
Average Nodes In Shell28.00
Average Hubs In Shell14.00
Average Links In Shell38.00
Average Links Mediated by Hubs In Shell35.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8RVW A Nucleotide Adenosine A2A Homo Sapiens StilSwitch3 Na - 2.65 2025-01-08 doi.org/10.1038/s41467-024-55109-w

A 2D representation of the interactions of A1H in 8RVW
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 R:R:F168 45.78 1 Yes Yes 0 4 0 1
L:L:?1 R:R:E169 12.7 1 Yes No 0 3 0 1
L:L:?1 R:R:M177 3.13 1 Yes Yes 0 6 0 1
L:L:?1 R:R:L249 10.2 1 Yes No 0 5 0 1
L:L:?1 R:R:N253 8.1 1 Yes No 0 5 0 1
L:L:?1 R:R:H264 3.79 1 Yes Yes 0 2 0 1
L:L:?1 R:R:L267 5.1 1 Yes No 0 3 0 1
L:L:?1 R:R:M270 7.29 1 Yes No 0 4 0 1
L:L:?1 R:R:I274 9.47 1 Yes No 0 4 0 1
R:R:L85 R:R:Y176 3.52 1 Yes Yes 4 6 2 2
R:R:L85 R:R:M177 4.24 1 Yes Yes 4 6 2 1
R:R:F168 R:R:V172 9.18 1 Yes No 4 3 1 2
R:R:F168 R:R:M177 6.22 1 Yes Yes 4 6 1 1
R:R:E169 R:R:T256 4.23 1 No No 3 4 1 2
R:R:E169 R:R:H264 11.08 1 No Yes 3 2 1 1
R:R:M177 R:R:V172 3.04 1 Yes No 6 3 1 2
R:R:M174 R:R:N253 9.82 0 No No 4 5 2 1
R:R:M174 R:R:T256 3.01 0 No No 4 4 2 2
R:R:M177 R:R:Y176 3.59 1 Yes Yes 6 6 1 2
R:R:A273 R:R:L249 3.15 0 No No 6 5 2 1
R:R:H264 R:R:T256 10.95 1 Yes No 2 4 1 2
R:R:H264 R:R:M270 5.25 1 Yes No 2 4 1 1
R:R:L267 R:R:Y271 14.07 0 No No 3 3 1 2
R:R:H278 R:R:I274 3.98 3 Yes No 6 4 2 1
R:R:A81 R:R:F168 2.77 0 No Yes 5 4 2 1
StatisticsValue
Average Number Of Links9.00
Average Number Of Links With An Hub3.00
Average Interaction Strength11.73
Average Nodes In Shell19.00
Average Hubs In Shell7.00
Average Links In Shell25.00
Average Links Mediated by Hubs In Shell20.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8RW4 A Nucleotide Adenosine A2A Homo Sapiens AzoSwitch2 Na - 2.2 2025-01-08 doi.org/10.1038/s41467-024-55109-w

A 2D representation of the interactions of A1H in 8RW4
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 R:R:F168 45.78 1 Yes Yes 0 4 0 1
L:L:?1 R:R:E169 11.72 1 Yes No 0 3 0 1
L:L:?1 R:R:M177 4.17 1 Yes Yes 0 6 0 1
L:L:?1 R:R:L249 16.32 1 Yes No 0 5 0 1
L:L:?1 R:R:N253 5.06 1 Yes No 0 5 0 1
L:L:?1 R:R:L267 6.12 1 Yes No 0 3 0 1
L:L:?1 R:R:M270 7.29 1 Yes No 0 4 0 1
L:L:?1 R:R:I274 11.57 1 Yes No 0 4 0 1
R:R:Y271 R:R:Y9 25.81 0 No Yes 3 5 2 2
R:R:I274 R:R:Y9 6.04 0 No Yes 4 5 1 2
R:R:G69 R:R:L167 3.42 0 No Yes 4 4 2 1
R:R:L85 R:R:Y176 3.52 1 Yes Yes 4 6 2 2
R:R:L85 R:R:M177 4.24 1 Yes Yes 4 6 2 1
R:R:L85 R:R:N181 8.24 1 Yes Yes 4 5 2 2
R:R:K153 R:R:L167 4.23 1 Yes Yes 4 4 2 1
R:R:D170 R:R:K153 6.91 1 No Yes 4 4 2 2
R:R:D170 R:R:L167 8.14 1 No Yes 4 4 2 1
R:R:F168 R:R:V172 14.42 1 Yes No 4 3 1 2
R:R:F168 R:R:M177 7.46 1 Yes Yes 4 6 1 1
R:R:E169 R:R:M174 5.41 0 No Yes 3 4 1 2
R:R:E169 R:R:H264 9.85 0 No No 3 2 1 2
R:R:M177 R:R:V172 3.04 1 Yes No 6 3 1 2
R:R:M174 R:R:N253 7.01 1 Yes No 4 5 2 1
R:R:M177 R:R:Y176 3.59 1 Yes Yes 6 6 1 2
R:R:N181 R:R:Y176 10.47 1 Yes Yes 5 6 2 2
R:R:M177 R:R:N181 4.21 1 Yes Yes 6 5 1 2
R:R:A273 R:R:L249 3.15 0 No No 6 5 2 1
R:R:L249 R:R:S277 3 0 No No 5 7 1 2
R:R:H264 R:R:M270 5.25 0 No No 2 4 2 1
R:R:L267 R:R:Y271 15.24 0 No No 3 3 1 2
R:R:H278 R:R:I274 3.98 3 Yes No 6 4 2 1
R:R:H278 R:R:S277 4.18 3 Yes No 6 7 2 2
R:R:I252 R:R:M270 2.92 0 No No 5 4 2 1
R:R:A81 R:R:F168 2.77 0 No Yes 5 4 2 1
L:L:?1 R:R:L167 2.04 1 Yes Yes 0 4 0 1
StatisticsValue
Average Number Of Links9.00
Average Number Of Links With An Hub3.00
Average Interaction Strength12.23
Average Nodes In Shell26.00
Average Hubs In Shell11.00
Average Links In Shell35.00
Average Links Mediated by Hubs In Shell29.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8RW7 A Nucleotide Adenosine A2A Homo Sapiens StilSwitch1 Na - 2.25 2025-01-08 doi.org/10.1038/s41467-024-55109-w

A 2D representation of the interactions of A1H in 8RW7
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 R:R:V84 4.39 1 Yes No 0 6 0 1
L:L:?1 R:R:F168 48.47 1 Yes Yes 0 4 0 1
L:L:?1 R:R:E169 5.86 1 Yes No 0 3 0 1
L:L:?1 R:R:M177 4.17 1 Yes Yes 0 6 0 1
L:L:?1 R:R:L249 14.28 1 Yes No 0 5 0 1
L:L:?1 R:R:N253 4.05 1 Yes No 0 5 0 1
L:L:?1 R:R:L267 7.14 1 Yes No 0 3 0 1
L:L:?1 R:R:M270 6.25 1 Yes Yes 0 4 0 1
L:L:?1 R:R:Y271 3.46 1 Yes No 0 3 0 1
L:L:?1 R:R:I274 11.57 1 Yes No 0 4 0 1
R:R:Y271 R:R:Y9 27.8 1 No Yes 3 5 1 2
R:R:I274 R:R:Y9 6.04 0 No Yes 4 5 1 2
R:R:A59 R:R:V84 3.39 0 No No 6 6 2 1
R:R:G69 R:R:L167 3.42 0 No Yes 4 4 2 1
R:R:L85 R:R:Y176 3.52 1 No Yes 4 6 2 2
R:R:L85 R:R:M177 4.24 1 No Yes 4 6 2 1
R:R:L85 R:R:N181 8.24 1 No Yes 4 5 2 2
R:R:K153 R:R:L167 4.23 1 Yes Yes 4 4 2 1
R:R:D170 R:R:K153 8.3 1 No Yes 4 4 2 2
R:R:D170 R:R:L167 9.5 1 No Yes 4 4 2 1
R:R:F168 R:R:V172 14.42 1 Yes No 4 3 1 2
R:R:F168 R:R:M177 4.98 1 Yes Yes 4 6 1 1
R:R:E169 R:R:M174 5.41 0 No No 3 4 1 2
R:R:E169 R:R:H264 9.85 0 No No 3 2 1 2
R:R:M174 R:R:N253 5.61 0 No No 4 5 2 1
R:R:M177 R:R:Y176 3.59 1 Yes Yes 6 6 1 2
R:R:N181 R:R:Y176 8.14 1 Yes Yes 5 6 2 2
R:R:M177 R:R:N181 7.01 1 Yes Yes 6 5 1 2
R:R:A273 R:R:L249 4.73 0 No No 6 5 2 1
R:R:H264 R:R:M270 5.25 0 No Yes 2 4 2 1
R:R:L267 R:R:Y271 15.24 1 No No 3 3 1 1
R:R:H278 R:R:I274 3.98 3 Yes No 6 4 2 1
R:R:A265 R:R:M270 3.22 0 No Yes 4 4 2 1
R:R:I252 R:R:M270 2.92 0 No Yes 5 4 2 1
R:R:A81 R:R:F168 2.77 0 No Yes 5 4 2 1
L:L:?1 R:R:L167 2.04 1 Yes Yes 0 4 0 1
StatisticsValue
Average Number Of Links11.00
Average Number Of Links With An Hub4.00
Average Interaction Strength10.15
Average Nodes In Shell28.00
Average Hubs In Shell10.00
Average Links In Shell36.00
Average Links Mediated by Hubs In Shell30.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8RWC A Nucleotide Adenosine A2A Homo Sapiens StilSwitch2 Na - 2.31 2025-01-08 doi.org/10.1038/s41467-024-55109-w

A 2D representation of the interactions of A1H in 8RWC
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 R:R:V84 3.29 1 Yes No 0 6 0 1
L:L:?1 R:R:F168 49.37 1 Yes Yes 0 4 0 1
L:L:?1 R:R:E169 13.67 1 Yes No 0 3 0 1
L:L:?1 R:R:M177 5.21 1 Yes Yes 0 6 0 1
L:L:?1 R:R:L249 16.32 1 Yes No 0 5 0 1
L:L:?1 R:R:N253 8.1 1 Yes No 0 5 0 1
L:L:?1 R:R:H264 3.79 1 Yes Yes 0 2 0 1
L:L:?1 R:R:L267 5.1 1 Yes No 0 3 0 1
L:L:?1 R:R:M270 6.25 1 Yes No 0 4 0 1
L:L:?1 R:R:I274 12.62 1 Yes No 0 4 0 1
R:R:Y271 R:R:Y9 27.8 3 No Yes 3 5 2 2
R:R:I274 R:R:Y9 4.84 0 No Yes 4 5 1 2
R:R:A59 R:R:V84 3.39 0 No No 6 6 2 1
R:R:L85 R:R:Y176 3.52 1 Yes Yes 4 6 2 2
R:R:L85 R:R:M177 4.24 1 Yes Yes 4 6 2 1
R:R:L85 R:R:N181 8.24 1 Yes Yes 4 5 2 2
R:R:F168 R:R:V172 14.42 1 Yes No 4 3 1 2
R:R:F168 R:R:M177 6.22 1 Yes Yes 4 6 1 1
R:R:E169 R:R:M174 5.41 1 No No 3 4 1 2
R:R:E169 R:R:H264 11.08 1 No Yes 3 2 1 1
R:R:M174 R:R:N253 8.41 0 No No 4 5 2 1
R:R:M177 R:R:Y176 3.59 1 Yes Yes 6 6 1 2
R:R:N181 R:R:Y176 8.14 1 Yes Yes 5 6 2 2
R:R:M177 R:R:N181 4.21 1 Yes Yes 6 5 1 2
R:R:H264 R:R:T256 10.95 1 Yes No 2 4 1 2
R:R:H264 R:R:M270 3.94 1 Yes No 2 4 1 1
R:R:L267 R:R:Y271 15.24 0 No No 3 3 1 2
R:R:H278 R:R:I274 3.98 3 Yes No 6 4 2 1
R:R:A273 R:R:L249 3.15 0 No No 6 5 2 1
R:R:I252 R:R:M270 2.92 0 No No 5 4 2 1
R:R:A81 R:R:F168 2.77 0 No Yes 5 4 2 1
R:R:F168 R:R:I66 2.51 1 Yes No 4 4 1 2
StatisticsValue
Average Number Of Links10.00
Average Number Of Links With An Hub3.00
Average Interaction Strength12.37
Average Nodes In Shell25.00
Average Hubs In Shell9.00
Average Links In Shell32.00
Average Links Mediated by Hubs In Shell26.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8RWD A Nucleotide Adenosine A2A Homo Sapiens StilSwitch3 Na - 2.05 2025-01-08 doi.org/10.1038/s41467-024-55109-w

A 2D representation of the interactions of A1H in 8RWD
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 R:R:V84 3.29 1 Yes No 0 6 0 1
L:L:?1 R:R:F168 50.27 1 Yes Yes 0 4 0 1
L:L:?1 R:R:E169 15.63 1 Yes No 0 3 0 1
L:L:?1 R:R:M177 5.21 1 Yes Yes 0 6 0 1
L:L:?1 R:R:L249 17.34 1 Yes No 0 5 0 1
L:L:?1 R:R:N253 8.1 1 Yes No 0 5 0 1
L:L:?1 R:R:H264 3.79 1 Yes Yes 0 2 0 1
L:L:?1 R:R:L267 6.12 1 Yes No 0 3 0 1
L:L:?1 R:R:M270 8.34 1 Yes No 0 4 0 1
L:L:?1 R:R:I274 11.57 1 Yes No 0 4 0 1
R:R:Y271 R:R:Y9 26.81 0 No Yes 3 5 2 2
R:R:I274 R:R:Y9 6.04 0 No Yes 4 5 1 2
R:R:A59 R:R:V84 3.39 0 No No 6 6 2 1
R:R:L85 R:R:Y176 3.52 1 No Yes 4 6 2 2
R:R:L85 R:R:M177 4.24 1 No Yes 4 6 2 1
R:R:L85 R:R:N181 8.24 1 No Yes 4 5 2 2
R:R:F168 R:R:V172 14.42 1 Yes No 4 3 1 2
R:R:F168 R:R:M177 7.46 1 Yes Yes 4 6 1 1
R:R:E169 R:R:M174 6.77 1 No No 3 4 1 2
R:R:E169 R:R:H264 11.08 1 No Yes 3 2 1 1
R:R:M174 R:R:N253 8.41 0 No No 4 5 2 1
R:R:M177 R:R:Y176 3.59 1 Yes Yes 6 6 1 2
R:R:N181 R:R:Y176 10.47 1 Yes Yes 5 6 2 2
R:R:M177 R:R:N181 4.21 1 Yes Yes 6 5 1 2
R:R:M177 R:R:N253 4.21 1 Yes No 6 5 1 1
R:R:H264 R:R:T256 12.32 1 Yes No 2 4 1 2
R:R:H264 R:R:M270 5.25 1 Yes No 2 4 1 1
R:R:L267 R:R:Y271 17.58 0 No No 3 3 1 2
R:R:H278 R:R:I274 3.98 3 Yes No 6 4 2 1
R:R:A273 R:R:L249 3.15 0 No No 6 5 2 1
R:R:I252 R:R:M270 2.92 0 No No 5 4 2 1
R:R:A81 R:R:F168 2.77 0 No Yes 5 4 2 1
StatisticsValue
Average Number Of Links10.00
Average Number Of Links With An Hub3.00
Average Interaction Strength12.97
Average Nodes In Shell24.00
Average Hubs In Shell8.00
Average Links In Shell32.00
Average Links Mediated by Hubs In Shell26.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8RWE A Nucleotide Adenosine A2A Homo Sapiens StilSwitch4 Na - 2.2 2025-01-08 doi.org/10.1038/s41467-024-55109-w

A 2D representation of the interactions of A1H in 8RWE
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 R:R:F168 50.27 1 Yes Yes 0 4 0 1
L:L:?1 R:R:E169 15.63 1 Yes No 0 3 0 1
L:L:?1 R:R:M177 5.21 1 Yes Yes 0 6 0 1
L:L:?1 R:R:L249 19.38 1 Yes No 0 5 0 1
L:L:?1 R:R:N253 8.1 1 Yes No 0 5 0 1
L:L:?1 R:R:L267 6.12 1 Yes No 0 3 0 1
L:L:?1 R:R:M270 7.29 1 Yes No 0 4 0 1
L:L:?1 R:R:I274 11.57 1 Yes No 0 4 0 1
R:R:Y271 R:R:Y9 27.8 3 No Yes 3 5 2 2
R:R:I274 R:R:Y9 6.04 0 No Yes 4 5 1 2
R:R:G69 R:R:L167 3.42 0 No Yes 4 4 2 1
R:R:L85 R:R:Y176 3.52 1 No Yes 4 6 2 2
R:R:L85 R:R:M177 4.24 1 No Yes 4 6 2 1
R:R:L85 R:R:N181 8.24 1 No Yes 4 5 2 2
R:R:K153 R:R:L167 4.23 1 Yes Yes 4 4 2 1
R:R:D170 R:R:K153 8.3 1 No Yes 4 4 2 2
R:R:D170 R:R:L167 8.14 1 No Yes 4 4 2 1
R:R:F168 R:R:V172 14.42 1 Yes No 4 3 1 2
R:R:F168 R:R:M177 6.22 1 Yes Yes 4 6 1 1
R:R:E169 R:R:M174 5.41 0 No Yes 3 4 1 2
R:R:E169 R:R:H264 11.08 0 No No 3 2 1 2
R:R:M174 R:R:N253 9.82 0 Yes No 4 5 2 1
R:R:M177 R:R:Y176 3.59 1 Yes Yes 6 6 1 2
R:R:N181 R:R:Y176 9.3 1 Yes Yes 5 6 2 2
R:R:M177 R:R:N181 5.61 1 Yes Yes 6 5 1 2
R:R:M177 R:R:N253 4.21 1 Yes No 6 5 1 1
R:R:H264 R:R:M270 5.25 0 No No 2 4 2 1
R:R:L267 R:R:Y271 15.24 0 No No 3 3 1 2
R:R:H278 R:R:I274 3.98 3 Yes No 6 4 2 1
R:R:A273 R:R:L249 3.15 0 No No 6 5 2 1
R:R:I252 R:R:M270 2.92 0 No No 5 4 2 1
R:R:A81 R:R:F168 2.77 0 No Yes 5 4 2 1
L:L:?1 R:R:L167 2.04 1 Yes Yes 0 4 0 1
StatisticsValue
Average Number Of Links9.00
Average Number Of Links With An Hub3.00
Average Interaction Strength13.96
Average Nodes In Shell25.00
Average Hubs In Shell10.00
Average Links In Shell33.00
Average Links Mediated by Hubs In Shell28.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8RWH A Nucleotide Adenosine A2A Homo Sapiens StilSwitch2 Na - 2.45 2025-01-08 doi.org/10.1038/s41467-024-55109-w

A 2D representation of the interactions of A1H in 8RWH
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 R:R:F168 48.47 2 Yes Yes 0 4 0 1
L:L:?1 R:R:E169 14.65 2 Yes No 0 3 0 1
L:L:?1 R:R:M177 4.17 2 Yes Yes 0 6 0 1
L:L:?1 R:R:L249 13.26 2 Yes No 0 5 0 1
L:L:?1 R:R:N253 8.1 2 Yes No 0 5 0 1
L:L:?1 R:R:L267 5.1 2 Yes No 0 3 0 1
L:L:?1 R:R:M270 8.34 2 Yes No 0 4 0 1
L:L:?1 R:R:I274 10.52 2 Yes No 0 4 0 1
R:R:L85 R:R:M177 4.24 2 No Yes 4 6 2 1
R:R:L85 R:R:N181 8.24 2 No No 4 5 2 2
R:R:F168 R:R:V172 14.42 2 Yes No 4 3 1 2
R:R:F168 R:R:M177 6.22 2 Yes Yes 4 6 1 1
R:R:E169 R:R:M174 6.77 0 No Yes 3 4 1 2
R:R:E169 R:R:H264 11.08 0 No No 3 2 1 2
R:R:M177 R:R:V172 3.04 2 Yes No 6 3 1 2
R:R:M174 R:R:N253 7.01 0 Yes No 4 5 2 1
R:R:M177 R:R:Y176 3.59 2 Yes Yes 6 6 1 2
R:R:N181 R:R:Y176 5.81 2 No Yes 5 6 2 2
R:R:M177 R:R:N181 4.21 2 Yes No 6 5 1 2
R:R:A273 R:R:L249 3.15 0 No No 6 5 2 1
R:R:L249 R:R:S277 3 0 No No 5 7 1 2
R:R:L267 R:R:Y271 12.89 0 No No 3 3 1 2
R:R:H278 R:R:I274 3.98 4 Yes No 6 4 2 1
R:R:H278 R:R:S277 4.18 4 Yes No 6 7 2 2
R:R:I252 R:R:M270 2.92 0 No No 5 4 2 1
R:R:A81 R:R:F168 2.77 0 No Yes 5 4 2 1
StatisticsValue
Average Number Of Links8.00
Average Number Of Links With An Hub2.00
Average Interaction Strength14.08
Average Nodes In Shell21.00
Average Hubs In Shell6.00
Average Links In Shell26.00
Average Links Mediated by Hubs In Shell20.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8RWI A Nucleotide Adenosine A2A Homo Sapiens StilSwitch2 Na - 2.8 2025-01-08 doi.org/10.1038/s41467-024-55109-w

A 2D representation of the interactions of A1H in 8RWI
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 R:R:S67 3.32 1 Yes No 0 3 0 1
L:L:?1 R:R:V84 3.29 1 Yes No 0 6 0 1
L:L:?1 R:R:F168 50.27 1 Yes Yes 0 4 0 1
L:L:?1 R:R:E169 6.84 1 Yes Yes 0 3 0 1
L:L:?1 R:R:L249 7.14 1 Yes Yes 0 5 0 1
L:L:?1 R:R:N253 6.07 1 Yes No 0 5 0 1
L:L:?1 R:R:L267 4.08 1 Yes No 0 3 0 1
L:L:?1 R:R:M270 5.21 1 Yes No 0 4 0 1
L:L:?1 R:R:Y271 11.23 1 Yes No 0 3 0 1
L:L:?1 R:R:I274 10.52 1 Yes No 0 4 0 1
R:R:Y271 R:R:Y9 8.94 1 No No 3 5 1 2
R:R:A59 R:R:V84 3.39 0 No No 6 6 2 1
R:R:A81 R:R:F168 4.16 0 No Yes 5 4 2 1
R:R:L85 R:R:V84 2.98 0 No No 4 6 2 1
R:R:F168 R:R:V172 15.73 1 Yes No 4 3 1 2
R:R:F168 R:R:M177 7.46 1 Yes Yes 4 6 1 2
R:R:E169 R:R:M174 5.41 1 Yes No 3 4 1 2
R:R:E169 R:R:T256 5.64 1 Yes No 3 4 1 2
R:R:E169 R:R:H264 11.08 1 Yes No 3 2 1 2
R:R:M177 R:R:V172 3.04 1 Yes No 6 3 2 2
R:R:M174 R:R:N253 5.61 0 No No 4 5 2 1
R:R:A273 R:R:L249 3.15 0 No Yes 6 5 2 1
R:R:I274 R:R:L249 4.28 1 No Yes 4 5 1 1
R:R:L249 R:R:S277 3 1 Yes No 5 7 1 2
R:R:H264 R:R:T256 10.95 1 No No 2 4 2 2
R:R:A265 R:R:M270 3.22 0 No No 4 4 2 1
R:R:L267 R:R:Y271 16.41 1 No No 3 3 1 1
R:R:H278 R:R:I274 3.98 1 Yes No 6 4 2 1
R:R:H278 R:R:S277 4.18 1 Yes No 6 7 2 2
R:R:I252 R:R:M270 2.92 0 No No 5 4 2 1
R:R:S67 R:R:T68 1.6 0 No No 3 5 1 2
StatisticsValue
Average Number Of Links10.00
Average Number Of Links With An Hub3.00
Average Interaction Strength10.80
Average Nodes In Shell26.00
Average Hubs In Shell6.00
Average Links In Shell31.00
Average Links Mediated by Hubs In Shell22.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8RWX A Nucleotide Adenosine A2A Homo Sapiens StilSwitch3 Na - 3.05 2025-01-08 doi.org/10.1038/s41467-024-55109-w

A 2D representation of the interactions of A1H in 8RWX
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 R:R:Y9 4.32 1 Yes Yes 0 5 0 1
L:L:?1 R:R:S67 5.53 1 Yes No 0 3 0 1
L:L:?1 R:R:V84 3.29 1 Yes No 0 6 0 1
L:L:?1 R:R:F168 47.58 1 Yes Yes 0 4 0 1
L:L:?1 R:R:L249 6.12 1 Yes No 0 5 0 1
L:L:?1 R:R:N253 4.05 1 Yes No 0 5 0 1
L:L:?1 R:R:L267 4.08 1 Yes No 0 3 0 1
L:L:?1 R:R:M270 6.25 1 Yes No 0 4 0 1
L:L:?1 R:R:Y271 15.55 1 Yes No 0 3 0 1
L:L:?1 R:R:I274 7.36 1 Yes No 0 4 0 1
R:R:I10 R:R:Y9 4.84 1 Yes Yes 6 5 2 1
R:R:E13 R:R:Y9 15.71 1 Yes Yes 6 5 2 1
R:R:S67 R:R:Y9 3.82 1 No Yes 3 5 1 1
R:R:Y271 R:R:Y9 8.94 1 No Yes 3 5 1 1
R:R:E13 R:R:H278 9.85 1 Yes Yes 6 6 2 2
R:R:A59 R:R:V84 3.39 0 No No 6 6 2 1
R:R:F168 R:R:V172 14.42 0 Yes No 4 3 1 2
R:R:F168 R:R:M177 7.46 0 Yes Yes 4 6 1 2
R:R:E169 R:R:T256 4.23 1 Yes No 3 4 1 2
R:R:E169 R:R:H264 11.08 1 Yes No 3 2 1 2
R:R:M174 R:R:M177 4.33 1 No Yes 4 6 2 2
R:R:M174 R:R:N253 9.82 1 No No 4 5 2 1
R:R:M177 R:R:N253 4.21 1 Yes No 6 5 2 1
R:R:A273 R:R:L249 3.15 0 No No 6 5 2 1
R:R:I252 R:R:M270 4.37 0 No No 5 4 2 1
R:R:H264 R:R:T256 13.69 1 No No 2 4 2 2
R:R:L267 R:R:Y271 9.38 1 No No 3 3 1 1
R:R:H278 R:R:I274 3.98 1 Yes No 6 4 2 1
L:L:?1 R:R:E169 2.93 1 Yes Yes 0 3 0 1
R:R:A81 R:R:F168 2.77 0 No Yes 5 4 2 1
R:R:V275 R:R:Y9 2.52 0 No Yes 5 5 2 1
R:R:D170 R:R:E169 1.3 0 Yes Yes 4 3 2 1
StatisticsValue
Average Number Of Links11.00
Average Number Of Links With An Hub3.00
Average Interaction Strength9.73
Average Nodes In Shell26.00
Average Hubs In Shell9.00
Average Links In Shell32.00
Average Links Mediated by Hubs In Shell26.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
9EPP A Sensory Opsins Rhodopsin Hasarius adansoni 11,20-Ethanoretinal - chim(Gi1-CtGq)/Beta1/Gamma2 4.06 2024-10-23 10.1038/s41467-024-53208-2

A 2D representation of the interactions of A1H in 9EPP
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 R:R:M103 4.17 4 Yes Yes 0 7 0 1
L:L:?1 R:R:Y126 1.73 4 Yes Yes 0 5 0 1
L:L:?1 R:R:G130 2.52 4 Yes No 0 6 0 1
L:L:?1 R:R:T201 2.17 4 Yes Yes 0 4 0 1
L:L:?1 R:R:I202 2.1 4 Yes Yes 0 5 0 1
L:L:?1 R:R:Y218 2.59 4 Yes Yes 0 5 0 1
L:L:?1 R:R:W290 10.91 4 Yes No 0 8 0 1
L:L:?1 R:R:Y293 2.59 4 Yes Yes 0 6 0 1
L:L:?1 R:R:A317 2.32 4 Yes No 0 5 0 1
L:L:?1 R:R:K321 9.35 4 Yes No 0 7 0 1
R:R:I57 R:R:M107 7.29 4 Yes Yes 7 7 2 2
R:R:I57 R:R:K321 5.82 4 Yes No 7 7 2 1
R:R:M103 R:R:M99 8.66 4 Yes No 7 7 1 2
R:R:F133 R:R:M99 9.95 4 Yes No 7 7 2 2
R:R:M103 R:R:Y126 9.58 4 Yes Yes 7 5 1 1
R:R:I129 R:R:M103 2.92 4 Yes Yes 4 7 2 1
R:R:G130 R:R:M103 1.75 4 No Yes 6 7 1 1
R:R:F133 R:R:M103 2.49 4 Yes Yes 7 7 2 1
R:R:T106 R:R:Y126 2.5 0 No Yes 6 5 2 1
R:R:M107 R:R:Y126 4.79 4 Yes Yes 7 5 2 1
R:R:K321 R:R:M107 2.88 4 No Yes 7 7 1 2
R:R:G127 R:R:Y126 2.9 0 No Yes 5 5 2 1
R:R:S199 R:R:Y126 8.9 0 No Yes 4 5 2 1
R:R:G127 R:R:Y191 2.9 0 No Yes 5 4 2 2
R:R:G130 R:R:I129 1.76 4 No Yes 6 4 1 2
R:R:F133 R:R:I129 5.02 4 Yes Yes 7 4 2 2
R:R:S131 R:R:Y218 10.17 0 No Yes 4 5 2 1
R:R:S135 R:R:Y218 6.36 4 No Yes 5 5 2 1
R:R:S135 R:R:V222 3.23 4 No Yes 5 5 2 2
R:R:W180 R:R:Y218 9.65 4 Yes Yes 5 5 2 1
R:R:V222 R:R:W180 2.45 4 Yes Yes 5 5 2 2
R:R:I202 R:R:Y191 4.84 4 Yes Yes 5 4 1 2
R:R:E194 R:R:T201 4.23 4 Yes Yes 4 4 2 1
R:R:E194 R:R:Y204 6.73 4 Yes Yes 4 5 2 2
R:R:E194 R:R:Y293 11.22 4 Yes Yes 4 6 2 1
R:R:I202 R:R:T201 4.56 4 Yes Yes 5 4 1 1
R:R:T201 R:R:Y204 3.75 4 Yes Yes 4 5 1 2
R:R:I202 R:R:Y214 6.04 4 Yes Yes 5 7 1 2
R:R:V222 R:R:Y218 12.62 4 Yes Yes 5 5 2 1
R:R:W286 R:R:W290 5.62 15 Yes No 9 8 2 1
R:R:A289 R:R:W290 2.59 0 No No 8 8 2 1
R:R:G316 R:R:Y293 4.35 0 No Yes 5 6 2 1
R:R:A317 R:R:Y293 4 4 No Yes 5 6 1 1
R:R:A320 R:R:Y293 2.67 0 No Yes 7 6 2 1
StatisticsValue
Average Number Of Links10.00
Average Number Of Links With An Hub6.00
Average Interaction Strength4.04
Average Nodes In Shell31.00
Average Hubs In Shell18.00
Average Links In Shell44.00
Average Links Mediated by Hubs In Shell43.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
9EPQ A Sensory Opsins Rhodopsin Hasarius adansoni 11,20-Ethanoretinal - chim(Gi1-CtGq)/Beta1/Gamma2 4.15 2024-10-23 10.1038/s41467-024-53208-2

A 2D representation of the interactions of A1H in 9EPQ
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 R:R:M103 3.13 1 Yes No 0 7 0 1
L:L:?1 R:R:G130 2.52 1 Yes No 0 6 0 1
L:L:?1 R:R:S199 3.32 1 Yes Yes 0 4 0 1
L:L:?1 R:R:T201 11.95 1 Yes No 0 4 0 1
L:L:?1 R:R:Y218 4.32 1 Yes Yes 0 5 0 1
L:L:?1 R:R:Y293 22.46 1 Yes Yes 0 6 0 1
L:L:?1 R:R:L294 3.06 1 Yes No 0 6 0 1
L:L:?1 R:R:K321 11.43 1 Yes No 0 7 0 1
R:R:I57 R:R:M107 2.92 1 Yes Yes 7 7 2 2
R:R:I57 R:R:K321 4.36 1 Yes No 7 7 2 1
R:R:M103 R:R:Y126 15.57 1 No Yes 7 5 1 2
R:R:G130 R:R:M103 3.49 1 No No 6 7 1 1
R:R:M107 R:R:Y126 2.39 1 Yes Yes 7 5 2 2
R:R:K321 R:R:M107 2.88 1 No Yes 7 7 1 2
R:R:S199 R:R:Y126 3.82 1 Yes Yes 4 5 1 2
R:R:S131 R:R:Y218 6.36 1 No Yes 4 5 2 1
R:R:S135 R:R:Y218 2.54 1 Yes Yes 5 5 2 1
R:R:S135 R:R:V222 3.23 1 Yes Yes 5 5 2 2
R:R:W180 R:R:Y214 2.89 1 Yes Yes 5 7 2 2
R:R:W180 R:R:Y218 15.43 1 Yes Yes 5 5 2 1
R:R:E194 R:R:S199 11.5 1 Yes Yes 4 4 2 1
R:R:E194 R:R:T201 4.23 1 Yes No 4 4 2 1
R:R:E194 R:R:Y293 4.49 1 Yes Yes 4 6 2 1
R:R:S199 R:R:T201 3.2 1 Yes No 4 4 1 1
R:R:I202 R:R:Y214 8.46 1 Yes Yes 5 7 2 2
R:R:I202 R:R:Y218 2.42 1 Yes Yes 5 5 2 1
R:R:Y214 R:R:Y218 3.97 1 Yes Yes 7 5 2 1
R:R:V222 R:R:Y218 3.79 1 Yes Yes 5 5 2 1
R:R:L294 R:R:Y223 9.38 0 No No 6 7 1 2
R:R:A317 R:R:Y293 4 0 No Yes 5 6 2 1
R:R:A320 R:R:Y293 2.67 0 No Yes 7 6 2 1
StatisticsValue
Average Number Of Links8.00
Average Number Of Links With An Hub3.00
Average Interaction Strength7.77
Average Nodes In Shell22.00
Average Hubs In Shell13.00
Average Links In Shell31.00
Average Links Mediated by Hubs In Shell29.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
9ERX A Lipid Cannabinoid CB1 Homo Sapiens D9-THC analog - Gi1/Beta1/Gamma2 2.9 2024-06-26 10.21203/rs.3.rs-4277209/v1

A 2D representation of the interactions of A1H in 9ERX
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
R:R:F108 R:R:P269 4.33 0 No No 5 3 1 2
L:L:?1 R:R:F108 4.49 4 Yes No 0 5 0 1
R:R:F177 R:R:M109 7.46 4 No No 4 3 1 2
R:R:H178 R:R:L111 9 4 Yes No 4 4 1 2
R:R:F170 R:R:F174 16.08 4 Yes Yes 7 5 1 1
R:R:F170 R:R:V196 5.24 4 Yes No 7 7 1 1
R:R:F170 R:R:S383 5.28 4 Yes No 7 6 1 1
R:R:F170 R:R:L387 4.87 4 Yes No 7 7 1 2
L:L:?1 R:R:F170 16.16 4 Yes Yes 0 7 0 1
R:R:F174 R:R:H178 9.05 4 Yes Yes 5 4 1 1
L:L:?1 R:R:F174 9.87 4 Yes Yes 0 5 0 1
R:R:F177 R:R:H178 3.39 4 No Yes 4 4 1 1
L:L:?1 R:R:F177 15.26 4 Yes No 0 4 0 1
L:L:?1 R:R:H178 4.74 4 Yes Yes 0 4 0 1
R:R:F189 R:R:K192 6.2 4 Yes Yes 9 6 1 2
R:R:F189 R:R:L193 3.65 4 Yes No 9 4 1 1
R:R:F189 R:R:P269 4.33 4 Yes No 9 3 1 2
R:R:F189 R:R:H270 9.05 4 Yes No 9 3 1 2
L:L:?1 R:R:F189 3.59 4 Yes Yes 0 9 0 1
R:R:F268 R:R:L193 7.31 4 Yes No 5 4 1 1
L:L:?1 R:R:L193 7.14 4 Yes No 0 4 0 1
L:L:?1 R:R:V196 8.78 4 Yes No 0 7 0 1
R:R:T197 R:R:W279 8.49 4 No Yes 6 6 1 1
L:L:?1 R:R:T197 4.35 4 Yes No 0 6 0 1
R:R:C386 R:R:F200 9.78 0 No No 7 7 2 1
L:L:?1 R:R:F200 3.59 4 Yes No 0 7 0 1
R:R:T201 R:R:W279 6.06 0 No Yes 6 6 2 1
R:R:I247 R:R:Y275 3.63 0 No Yes 5 7 2 1
R:R:I271 R:R:P251 3.39 4 No No 3 6 2 2
R:R:P251 R:R:Y275 13.91 4 No Yes 6 7 2 1
R:R:W255 R:R:Y275 5.79 0 Yes Yes 5 7 2 1
R:R:F268 R:R:I267 7.54 4 Yes Yes 5 4 1 2
R:R:F379 R:R:I267 13.82 4 Yes Yes 4 4 1 2
R:R:F268 R:R:F379 4.29 4 Yes Yes 5 4 1 1
L:L:?1 R:R:F268 24.24 4 Yes Yes 0 5 0 1
R:R:I271 R:R:Y275 4.84 4 No Yes 3 7 2 1
L:L:?1 R:R:Y275 3.46 4 Yes Yes 0 7 0 1
R:R:T283 R:R:W279 8.49 0 No Yes 8 6 2 1
R:R:M363 R:R:W279 4.65 0 No Yes 6 6 2 1
L:L:?1 R:R:W279 15.95 4 Yes Yes 0 6 0 1
R:R:F379 R:R:I362 6.28 4 Yes No 4 4 1 2
L:L:?1 R:R:F379 7.18 4 Yes Yes 0 4 0 1
L:L:?1 R:R:S383 11.07 4 Yes No 0 6 0 1
R:R:I169 R:R:V196 3.07 0 No No 5 7 2 1
L:L:?1 R:R:L359 3.06 4 Yes No 0 7 0 1
R:R:F200 R:R:G166 3.01 0 No No 7 8 1 2
R:R:A380 R:R:F174 2.77 0 No Yes 4 5 2 1
R:R:G194 R:R:T197 1.82 0 No No 6 6 2 1
R:R:F108 R:R:I105 1.26 0 No No 5 3 1 2
StatisticsValue
Average Number Of Links16.00
Average Number Of Links With An Hub8.00
Average Interaction Strength8.93
Average Nodes In Shell38.00
Average Hubs In Shell12.00
Average Links In Shell49.00
Average Links Mediated by Hubs In Shell41.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
9F33 A Amine Dopamine D3 Homo Sapiens FOB02-04A - Go1/Beta1/Gamma2 3.05 2024-09-18  10.1038/s41467-024-51993-4

A 2D representation of the interactions of A1H in 9F33
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 R:R:H29 3.79 1 Yes No 0 4 0 1
L:L:?1 R:R:E90 3.91 1 Yes No 0 6 0 1
L:L:?1 R:R:G94 10.08 1 Yes No 0 5 0 1
L:L:?1 R:R:F106 3.59 1 Yes No 0 7 0 1
L:L:?1 R:R:D110 23.01 1 Yes No 0 8 0 1
L:L:?1 R:R:V111 14.27 1 Yes No 0 8 0 1
L:L:?1 R:R:C114 8.19 1 Yes No 0 7 0 1
L:L:?1 R:R:S192 4.43 1 Yes No 0 8 0 1
L:L:?1 R:R:F345 23.34 1 Yes Yes 0 8 0 1
L:L:?1 R:R:F346 8.98 1 Yes Yes 0 7 0 1
L:L:?1 R:R:T369 5.43 1 Yes No 0 6 0 1
L:L:?1 R:R:Y373 4.32 1 Yes Yes 0 8 0 1
R:R:E90 R:R:H29 9.85 1 No No 6 4 1 1
R:R:E90 R:R:Y32 6.73 1 No No 6 5 1 2
R:R:M83 R:R:Y36 4.79 1 Yes Yes 8 7 2 2
R:R:V86 R:R:Y36 3.79 1 No Yes 8 7 2 2
R:R:T369 R:R:Y36 3.75 0 No Yes 6 7 1 2
R:R:Y36 R:R:Y373 4.96 1 Yes Yes 7 8 2 1
R:R:D110 R:R:V82 5.84 1 No No 8 8 1 2
R:R:M83 R:R:Y373 10.78 1 Yes Yes 8 8 2 1
R:R:F106 R:R:W85 14.03 0 No No 7 7 1 2
R:R:V86 R:R:Y373 3.79 1 No Yes 8 8 2 1
R:R:D110 R:R:Y373 5.75 1 No Yes 8 8 1 1
R:R:S165 R:R:V111 6.46 0 No No 8 8 2 1
R:R:C114 R:R:W342 5.22 0 No Yes 7 8 1 2
R:R:S196 R:R:T115 9.59 1 Yes No 8 8 1 2
R:R:F188 R:R:S192 10.57 32 Yes No 7 8 2 1
R:R:F346 R:R:S193 5.28 1 Yes No 7 8 1 2
R:R:F197 R:R:W342 4.01 1 Yes Yes 9 8 2 2
R:R:F197 R:R:F346 20.36 1 Yes Yes 9 7 2 1
R:R:F346 R:R:W342 4.01 1 Yes Yes 7 8 1 2
R:R:F345 R:R:F346 12.86 1 Yes Yes 8 7 1 1
R:R:F345 R:R:H349 6.79 1 Yes No 8 8 1 2
R:R:F345 R:R:T368 5.19 1 Yes No 8 6 1 2
L:L:?1 R:R:S196 3.32 1 Yes Yes 0 8 0 1
R:R:V164 R:R:V195 3.21 1 No No 7 4 2 2
R:R:G93 R:R:G94 2.11 0 No No 4 5 2 1
R:R:S196 R:R:V164 1.62 1 Yes No 8 7 1 2
R:R:S196 R:R:V195 1.62 1 Yes No 8 4 1 2
StatisticsValue
Average Number Of Links13.00
Average Number Of Links With An Hub4.00
Average Interaction Strength8.97
Average Nodes In Shell31.00
Average Hubs In Shell10.00
Average Links In Shell39.00
Average Links Mediated by Hubs In Shell32.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
9F34 A Amine Dopamine D3 Homo Sapiens FOB02-04A - Go1/Beta1/Gamma2 3.05 2024-09-18  10.1038/s41467-024-51993-4

A 2D representation of the interactions of A1H in 9F34
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 R:R:L89 8.16 2 Yes No 0 5 0 1
L:L:?1 R:R:D110 17 2 Yes Yes 0 8 0 1
L:L:?1 R:R:V111 12.08 2 Yes No 0 8 0 1
L:L:?1 R:R:C114 12.87 2 Yes No 0 7 0 1
L:L:?1 R:R:S196 4.43 2 Yes No 0 8 0 1
L:L:?1 R:R:W342 3.36 2 Yes Yes 0 8 0 1
L:L:?1 R:R:F345 15.26 2 Yes Yes 0 8 0 1
L:L:?1 R:R:F346 8.08 2 Yes Yes 0 7 0 1
L:L:?1 R:R:P362 4.84 2 Yes No 0 2 0 1
L:L:?1 R:R:Y365 18.14 2 Yes No 0 4 0 1
L:L:?1 R:R:T369 14.12 2 Yes No 0 6 0 1
L:L:?1 R:R:Y373 12.1 2 Yes Yes 0 8 0 1
R:R:V86 R:R:Y36 6.31 0 No Yes 8 7 2 2
R:R:T369 R:R:Y36 4.99 2 No Yes 6 7 1 2
R:R:D110 R:R:V82 7.3 2 Yes No 8 8 1 2
R:R:V82 R:R:Y373 3.79 2 No Yes 8 8 2 1
R:R:M83 R:R:Y373 11.97 0 Yes Yes 8 8 2 1
R:R:V86 R:R:Y373 3.79 0 No Yes 8 8 2 1
R:R:L89 R:R:W96 6.83 0 No Yes 5 9 1 2
R:R:C114 R:R:D110 3.11 2 No Yes 7 8 1 1
R:R:D110 R:R:Y373 8.05 2 Yes Yes 8 8 1 1
R:R:S165 R:R:V111 6.46 0 No No 8 8 2 1
R:R:L168 R:R:V111 4.47 0 No No 7 8 2 1
R:R:C114 R:R:W342 5.22 2 No Yes 7 8 1 1
R:R:T115 R:R:V164 6.35 2 No No 8 7 2 2
R:R:S196 R:R:T115 7.99 2 No No 8 8 1 2
R:R:F338 R:R:I118 7.54 2 Yes No 9 9 2 2
R:R:I118 R:R:W342 15.27 2 No Yes 9 8 2 1
R:R:S196 R:R:V164 3.23 2 No No 8 7 1 2
R:R:F346 R:R:S193 5.28 2 Yes No 7 8 1 2
R:R:F197 R:R:F338 3.22 2 Yes Yes 9 9 2 2
R:R:F197 R:R:W342 4.01 2 Yes Yes 9 8 2 1
R:R:F197 R:R:F346 21.43 2 Yes Yes 9 7 2 1
R:R:F338 R:R:W342 6.01 2 Yes Yes 9 8 2 1
R:R:F345 R:R:W342 3.01 2 Yes Yes 8 8 1 1
R:R:F346 R:R:W342 6.01 2 Yes Yes 7 8 1 1
R:R:G372 R:R:W342 4.22 0 No Yes 7 8 2 1
R:R:N375 R:R:W342 12.43 0 No Yes 9 8 2 1
R:R:F345 R:R:F346 11.79 2 Yes Yes 8 7 1 1
R:R:F345 R:R:H349 5.66 2 Yes No 8 8 1 2
R:R:F345 R:R:T368 5.19 2 Yes No 8 6 1 2
R:R:H349 R:R:Y365 3.27 0 No No 8 4 2 1
R:R:E363 R:R:P362 6.29 0 No No 1 2 2 1
R:R:T369 R:R:Y373 3.75 2 No Yes 6 8 1 1
StatisticsValue
Average Number Of Links12.00
Average Number Of Links With An Hub5.00
Average Interaction Strength10.87
Average Nodes In Shell31.00
Average Hubs In Shell11.00
Average Links In Shell44.00
Average Links Mediated by Hubs In Shell37.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
StatisticsValue
Average Number Of Links10.47
Average Number Of Links With An Hub3.93
Average Interaction Strength10.61
Average Nodes In Shell26.73
Average Hubs In Shell10.27
Average Links In Shell35.13
Average Links Mediated by Hubs In Shell29.60

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Physico-chemical properties of the nodes interacting with this ligand

(Click to enlarge 🔍)

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Location of the nodes interacting with this ligand

(Click to enlarge 🔍)