Code8D0
Name(6~{a}~{R},9~{R},10~{a}~{R})-9-(hydroxymethyl)-3-(8-isothiocyanato-2-methyl-octan-2-yl)-6,6-dimethyl-6~{a},7,8,9,10,10~{a}-hexahydrobenzo[c]chromen-1-ol
Synonyms
Identifier(6~{a}~{R},9~{R},10~{a}~{R})-9-(hydroxymethyl)-3-(8-isothiocyanato-2-methyl-octan-2-yl)-6,6-dimethyl-6~{a},7,8,9,10,10~{a}-hexahydrobenzo[c]chromen-1-ol
FormulaC26 H39 N O3 S
Molecular Weight445.658
SMILESCC1([C@@H]2CC[C@H](C[C@H]2c3c(cc(cc3O1)C(C)(C)CCCCCCN=C=S)O)CO)C
PubChem102336704
Formal Charge0
Total Atoms70
Total Chiral Atoms3
Total Bonds72
Total Aromatic Bonds6
Networks5
 missing image

This ligand is also present in the following 5 networks:
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
5XR8 A Lipid Cannabinoid CB1 Homo sapiens AM841 - - 2.95 2017-07-12 10.1038/nature23272

A 2D representation of the interactions of 8D0 in 5XR8
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:F177 R:R:M109 12.44 0 No Yes 4 3 1 2
R:R:F174 R:R:I119 3.77 1 Yes No 5 5 1 2
R:R:F200 R:R:G166 3.01 1 Yes No 7 8 1 2
R:R:I169 R:R:V196 3.07 0 No No 5 7 2 1
R:R:F170 R:R:F174 12.86 1 Yes Yes 7 5 1 1
R:R:F170 R:R:F200 3.22 1 Yes Yes 7 7 1 1
R:R:F170 R:R:L387 6.09 1 Yes No 7 7 1 2
L:L:?1 R:R:F170 10.3 1 Yes Yes 0 7 0 1
R:R:F174 R:R:H178 18.1 1 Yes Yes 5 4 1 2
R:R:F174 R:R:S383 5.28 1 Yes No 5 6 1 1
R:R:F174 R:R:M384 3.73 1 Yes No 5 5 1 2
L:L:?1 R:R:F174 7.92 1 Yes Yes 0 5 0 1
R:R:F177 R:R:H178 9.05 0 No Yes 4 4 1 2
L:L:?1 R:R:F177 14.26 1 Yes No 0 4 0 1
R:R:F189 R:R:L193 6.09 1 Yes Yes 9 4 1 1
R:R:F189 R:R:P269 7.22 1 Yes No 9 3 1 2
R:R:F189 R:R:H270 3.39 1 Yes Yes 9 3 1 2
L:L:?1 R:R:F189 5.55 1 Yes Yes 0 9 0 1
R:R:L193 R:R:T197 5.9 1 Yes Yes 4 6 1 1
R:R:F268 R:R:L193 3.65 1 Yes Yes 5 4 1 1
L:L:?1 R:R:L193 8.1 1 Yes Yes 0 4 0 1
L:L:?1 R:R:V196 3.88 1 Yes No 0 7 0 1
R:R:A248 R:R:T197 3.36 0 No Yes 7 6 2 1
R:R:T197 R:R:W279 4.85 1 Yes Yes 6 6 1 1
L:L:?1 R:R:T197 12.46 1 Yes Yes 0 6 0 1
R:R:C386 R:R:F200 5.59 0 No Yes 7 7 2 1
L:L:?1 R:R:F200 3.17 1 Yes Yes 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:P251 R:R:Y275 16.69 0 No Yes 6 7 2 1
R:R:W255 R:R:Y275 13.5 9 Yes Yes 5 7 2 1
R:R:I267 R:R:S265 4.64 1 Yes No 4 4 2 2
R:R:F268 R:R:S265 3.96 1 Yes No 5 4 1 2
R:R:F268 R:R:I267 8.79 1 Yes Yes 5 4 1 2
R:R:F379 R:R:I267 12.56 1 Yes Yes 4 4 1 2
R:R:F268 R:R:I271 5.02 1 Yes No 5 3 1 2
R:R:F268 R:R:M363 4.98 1 Yes No 5 6 1 2
R:R:F268 R:R:F379 7.5 1 Yes Yes 5 4 1 1
L:L:?1 R:R:F268 19.01 1 Yes Yes 0 5 0 1
R:R:H270 R:R:P269 7.63 1 Yes No 3 3 2 2
L:L:?1 R:R:Y275 3.05 1 Yes Yes 0 7 0 1
R:R:I280 R:R:W279 3.52 0 No Yes 5 6 2 1
R:R:V283 R:R:W279 12.26 0 No Yes 8 6 2 1
L:L:?1 R:R:W279 14.08 1 Yes Yes 0 6 0 1
R:R:L359 R:R:M363 4.24 1 No No 7 6 2 2
R:R:F379 R:R:L359 4.87 1 Yes No 4 7 1 2
R:R:F379 R:R:I362 8.79 1 Yes No 4 4 1 2
R:R:F379 R:R:M363 3.73 1 Yes No 4 6 1 2
R:R:F379 R:R:S383 7.93 1 Yes No 4 6 1 1
L:L:?1 R:R:F379 5.55 1 Yes Yes 0 4 0 1
L:L:?1 R:R:S383 5.86 1 Yes No 0 6 0 1
R:R:L360 R:R:W279 2.28 0 No Yes 7 6 2 1
StatisticsValue
Average Number Of Links13.00
Average Number Of Links With An Hub10.00
Average Interaction Strength8.71
Average Nodes In Shell38.00
Average Hubs In Shell16.00
Average Links In Shell52.00
Average Links Mediated by Hubs In Shell50.00
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
6KPC A Lipid Cannabinoid CB2 Homo sapiens PubChem 145915889 - - 3.2 2020-02-12 10.1016/j.cell.2020.01.008

A 2D representation of the interactions of 8D0 in 6KPC
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:F94 R:R:M22 3.73 1 Yes No 3 7 1 2
R:R:F94 R:R:M26 11.2 1 Yes No 3 6 1 2
R:R:V113 R:R:V86 3.21 1 No No 5 4 1 2
R:R:F87 R:R:F91 16.08 1 Yes Yes 6 6 1 1
R:R:F87 R:R:V113 5.24 1 Yes No 6 5 1 1
R:R:F117 R:R:F87 4.29 1 Yes Yes 6 6 2 1
R:R:F87 R:R:L289 4.87 1 Yes No 6 6 1 2
L:L:?1 R:R:F87 14.26 1 Yes Yes 0 6 0 1
L:L:?1 R:R:S90 4.88 1 Yes No 0 4 0 1
R:R:F91 R:R:H95 6.79 1 Yes No 6 4 1 1
R:R:F91 R:R:S285 3.96 1 Yes No 6 5 1 1
R:R:F91 R:R:M286 3.73 1 Yes Yes 6 5 1 2
L:L:?1 R:R:F91 11.88 1 Yes Yes 0 6 0 1
R:R:F94 R:R:H95 9.05 1 Yes No 3 4 1 1
L:L:?1 R:R:F94 12.68 1 Yes Yes 0 3 0 1
L:L:?1 R:R:H95 5.02 1 Yes No 0 4 0 1
R:R:F183 R:R:I110 6.28 1 Yes No 6 4 1 2
R:R:I110 R:R:I186 4.42 0 No Yes 4 5 2 2
R:R:G111 R:R:T114 3.64 0 No Yes 6 4 2 1
L:L:?1 R:R:V113 8.72 1 Yes No 0 5 0 1
R:R:S165 R:R:T114 6.4 0 No Yes 7 4 2 1
R:R:T114 R:R:W194 6.06 1 Yes Yes 4 5 1 1
L:L:?1 R:R:T114 11.51 1 Yes Yes 0 4 0 1
R:R:T118 R:R:W194 6.06 1 No Yes 6 5 2 1
R:R:I198 R:R:T118 6.08 1 No No 7 6 2 2
R:R:V164 R:R:W194 3.68 0 No Yes 5 5 2 1
R:R:L167 R:R:Y190 5.86 0 No Yes 5 7 2 1
R:R:I186 R:R:P168 6.77 1 Yes No 5 5 2 2
R:R:P168 R:R:Y190 11.13 1 No Yes 5 7 2 1
R:R:W172 R:R:Y190 11.58 0 Yes Yes 5 7 2 1
R:R:F183 R:R:L182 3.65 1 Yes No 6 4 1 2
R:R:F281 R:R:L182 19.49 1 Yes No 4 4 1 2
R:R:F183 R:R:L191 4.87 1 Yes No 6 5 1 2
R:R:F183 R:R:M265 4.98 1 Yes No 6 6 1 2
R:R:F183 R:R:F281 6.43 1 Yes Yes 6 4 1 1
L:L:?1 R:R:F183 20.6 1 Yes Yes 0 6 0 1
R:R:I186 R:R:Y190 6.04 1 Yes Yes 5 7 2 1
R:R:I186 R:R:L191 4.28 1 Yes No 5 5 2 2
L:L:?1 R:R:Y190 3.81 1 Yes Yes 0 7 0 1
R:R:L195 R:R:W194 3.42 0 No Yes 4 5 2 1
R:R:I198 R:R:W194 10.57 1 No Yes 7 5 2 1
L:L:?1 R:R:W194 15.56 1 Yes Yes 0 5 0 1
R:R:L195 R:R:M265 5.65 0 No No 4 6 2 2
R:R:F281 R:R:L264 7.31 1 Yes No 4 4 1 2
R:R:F281 R:R:M265 4.98 1 Yes No 4 6 1 2
R:R:F281 R:R:S285 7.93 1 Yes No 4 5 1 1
L:L:?1 R:R:F281 5.55 1 Yes Yes 0 4 0 1
L:L:?1 R:R:S285 5.86 1 Yes No 0 5 0 1
R:R:K109 R:R:S90 1.53 0 No No 5 4 2 1
R:R:A282 R:R:F91 1.39 0 No Yes 4 6 2 1
StatisticsValue
Average Number Of Links12.00
Average Number Of Links With An Hub8.00
Average Interaction Strength10.03
Average Nodes In Shell36.00
Average Hubs In Shell13.00
Average Links In Shell50.00
Average Links Mediated by Hubs In Shell46.00
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
6KPF A Lipid Cannabinoid CB2 Homo sapiens PubChem 145915889 - Gi1/Beta1/Gamma2 2.9 2020-02-12 10.1016/j.cell.2020.01.008

A 2D representation of the interactions of 8D0 in 6KPF
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:F94 R:R:M22 4.98 3 Yes No 3 7 1 2
R:R:P184 R:R:Y25 20.86 3 Yes No 5 4 1 2
R:R:F94 R:R:M26 3.73 3 Yes No 3 6 1 2
R:R:H95 R:R:L28 7.71 3 Yes No 4 6 1 2
R:R:F87 R:R:F91 8.57 3 Yes Yes 6 6 1 1
R:R:F87 R:R:V113 5.24 3 Yes No 6 5 1 1
R:R:F117 R:R:F87 4.29 3 Yes Yes 6 6 2 1
R:R:F87 R:R:S285 5.28 3 Yes No 6 5 1 1
R:R:F87 R:R:L289 6.09 3 Yes No 6 6 1 2
L:L:?1 R:R:F87 11.09 3 Yes Yes 0 6 0 1
R:R:K109 R:R:S90 6.12 0 No No 5 4 2 1
L:L:?1 R:R:S90 3.91 3 Yes No 0 4 0 1
R:R:F91 R:R:H95 13.58 3 Yes Yes 6 4 1 1
R:R:F91 R:R:S285 5.28 3 Yes No 6 5 1 1
R:R:F91 R:R:M286 6.22 3 Yes No 6 5 1 2
L:L:?1 R:R:F91 9.51 3 Yes Yes 0 6 0 1
R:R:F94 R:R:H95 9.05 3 Yes Yes 3 4 1 1
R:R:F106 R:R:F94 5.36 3 No Yes 9 3 2 1
R:R:F94 R:R:P184 5.78 3 Yes Yes 3 5 1 1
L:L:?1 R:R:F94 11.88 3 Yes Yes 0 3 0 1
L:L:?1 R:R:H95 5.02 3 Yes Yes 0 4 0 1
R:R:F106 R:R:I110 5.02 3 No No 9 4 2 2
R:R:F106 R:R:P184 4.33 3 No Yes 9 5 2 1
R:R:F183 R:R:I110 6.28 3 Yes No 6 4 1 2
R:R:I110 R:R:I186 4.42 0 No Yes 4 5 2 1
R:R:G111 R:R:T114 3.64 0 No No 6 4 2 1
L:L:?1 R:R:V113 7.75 3 Yes No 0 5 0 1
R:R:T114 R:R:W194 6.06 3 No Yes 4 5 1 1
L:L:?1 R:R:T114 10.55 3 Yes No 0 4 0 1
R:R:T118 R:R:W194 6.06 3 No Yes 6 5 2 1
R:R:I198 R:R:T118 6.08 3 No No 7 6 2 2
R:R:I186 R:R:S180 4.64 0 Yes No 5 4 1 2
R:R:F183 R:R:P184 4.33 3 Yes Yes 6 5 1 1
R:R:F183 R:R:M265 4.98 3 Yes Yes 6 6 1 2
R:R:F183 R:R:F281 6.43 3 Yes Yes 6 4 1 2
L:L:?1 R:R:F183 26.94 3 Yes Yes 0 6 0 1
L:L:?1 R:R:P184 8.55 3 Yes Yes 0 5 0 1
R:R:I186 R:R:P187 5.08 0 Yes Yes 5 4 1 2
R:R:I186 R:R:Y190 3.63 0 Yes No 5 7 1 2
L:L:?1 R:R:I186 4.64 3 Yes Yes 0 5 0 1
R:R:W194 R:R:Y190 7.72 3 Yes No 5 7 1 2
R:R:L191 R:R:M265 4.24 0 No Yes 5 6 1 2
L:L:?1 R:R:L191 4.5 3 Yes No 0 5 0 1
R:R:I198 R:R:W194 15.27 3 No Yes 7 5 2 1
R:R:M265 R:R:W194 3.49 3 Yes Yes 6 5 2 1
L:L:?1 R:R:W194 8.89 3 Yes Yes 0 5 0 1
R:R:F281 R:R:M265 3.73 3 Yes Yes 4 6 2 2
L:L:?1 R:R:S285 7.81 3 Yes No 0 5 0 1
R:R:A282 R:R:H95 2.93 0 No Yes 4 4 2 1
StatisticsValue
Average Number Of Links13.00
Average Number Of Links With An Hub8.00
Average Interaction Strength9.31
Average Nodes In Shell33.00
Average Hubs In Shell13.00
Average Links In Shell49.00
Average Links Mediated by Hubs In Shell45.00
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
6KPG A Lipid Cannabinoid CB1 Homo sapiens AM841 - Gi1/Beta1/Gamma2 3 2020-02-12 10.1016/j.cell.2020.01.008

A 2D representation of the interactions of 8D0 in 6KPG
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:F177 6.43 2 Yes Yes 5 4 1 1
R:R:F108 R:R:P269 8.67 2 Yes No 5 3 1 2
R:R:F108 R:R:K376 3.72 2 Yes No 5 2 1 2
L:L:?1 R:R:F108 3.96 2 Yes Yes 0 5 0 1
R:R:H178 R:R:L111 5.14 2 Yes No 4 4 1 2
R:R:F170 R:R:F174 8.57 2 Yes Yes 7 5 1 2
R:R:F170 R:R:V196 3.93 2 Yes No 7 7 1 2
R:R:F170 R:R:S383 5.28 2 Yes No 7 6 1 1
L:L:?1 R:R:F170 11.88 2 Yes Yes 0 7 0 1
R:R:K192 R:R:S173 7.65 0 No No 6 4 2 1
L:L:?1 R:R:S173 4.88 2 Yes No 0 4 0 1
R:R:F174 R:R:H178 5.66 2 Yes Yes 5 4 2 1
R:R:F174 R:R:S383 6.61 2 Yes No 5 6 2 1
R:R:F177 R:R:H178 12.44 2 Yes Yes 4 4 1 1
R:R:F177 R:R:H181 10.18 2 Yes No 4 3 1 2
L:L:?1 R:R:F177 13.47 2 Yes Yes 0 4 0 1
L:L:?1 R:R:H178 4.18 2 Yes Yes 0 4 0 1
R:R:F189 R:R:L193 4.87 2 Yes No 9 4 1 1
R:R:F189 R:R:P269 7.22 2 Yes No 9 3 1 2
R:R:F189 R:R:H270 4.53 2 Yes No 9 3 1 2
L:L:?1 R:R:F189 3.17 2 Yes Yes 0 9 0 1
R:R:I271 R:R:L190 2.85 2 Yes No 3 5 1 2
R:R:I271 R:R:L193 5.71 2 Yes No 3 4 1 1
L:L:?1 R:R:L193 5.4 2 Yes No 0 4 0 1
R:R:T197 R:R:W279 7.28 2 No Yes 6 6 1 1
L:L:?1 R:R:T197 10.55 2 Yes No 0 6 0 1
R:R:C386 R:R:F200 12.57 2 Yes Yes 7 7 1 2
R:R:T201 R:R:W279 6.06 0 No Yes 6 6 2 1
R:R:L250 R:R:P251 3.28 2 No No 5 6 2 2
R:R:L250 R:R:W255 4.56 2 No Yes 5 5 2 2
R:R:L250 R:R:Y275 3.52 2 No Yes 5 7 2 1
R:R:P251 R:R:Y275 5.56 2 No Yes 6 7 2 1
R:R:W255 R:R:Y275 10.61 2 Yes Yes 5 7 2 1
R:R:F268 R:R:I267 6.28 2 No Yes 5 4 1 2
R:R:F379 R:R:I267 5.02 0 Yes Yes 4 4 1 2
R:R:F268 R:R:I271 5.02 2 No Yes 5 3 1 1
L:L:?1 R:R:F268 13.47 2 Yes No 0 5 0 1
R:R:H270 R:R:P269 9.15 2 No No 3 3 2 2
R:R:I271 R:R:Y275 4.84 2 Yes Yes 3 7 1 1
L:L:?1 R:R:I271 4.64 2 Yes Yes 0 3 0 1
R:R:L276 R:R:Y275 4.69 0 No Yes 5 7 2 1
R:R:F278 R:R:Y275 7.22 2 No Yes 6 7 2 1
R:R:W279 R:R:Y275 6.75 2 Yes Yes 6 7 1 1
L:L:?1 R:R:Y275 9.15 2 Yes Yes 0 7 0 1
R:R:V283 R:R:W279 8.58 0 No Yes 8 6 2 1
R:R:W279 R:R:W356 3.75 2 Yes Yes 6 8 1 2
R:R:M363 R:R:W279 3.49 2 Yes Yes 6 6 2 1
L:L:?1 R:R:W279 12.59 2 Yes Yes 0 6 0 1
R:R:L359 R:R:W356 6.83 2 No Yes 7 8 2 2
R:R:C386 R:R:W356 3.92 2 Yes Yes 7 8 1 2
R:R:L359 R:R:M363 2.83 2 No Yes 7 6 2 2
R:R:C386 R:R:L359 3.17 2 Yes No 7 7 1 2
R:R:F379 R:R:I362 8.79 0 Yes No 4 4 1 2
R:R:C382 R:R:F379 5.59 0 No Yes 5 4 2 1
L:L:?1 R:R:F379 6.34 2 Yes Yes 0 4 0 1
L:L:?1 R:R:S383 4.88 2 Yes No 0 6 0 1
L:L:?1 R:R:C386 3.1 2 Yes Yes 0 7 0 1
StatisticsValue
Average Number Of Links15.00
Average Number Of Links With An Hub10.00
Average Interaction Strength7.44
Average Nodes In Shell39.00
Average Hubs In Shell17.00
Average Links In Shell57.00
Average Links Mediated by Hubs In Shell54.00
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
8WRZ A Lipid Cannabinoid CB1 Homo sapiens 8D0 - Arrestin1 3.6 2024-02-28 10.1093/procel/pwad055

A 2D representation of the interactions of 8D0 in 8WRZ
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:F177 5.36 0 No Yes 5 4 2 1
R:R:F177 R:R:V110 2.62 1 Yes No 4 3 1 2
R:R:H178 R:R:Q116 2.47 1 Yes No 4 4 1 2
R:R:I169 R:R:V196 6.14 0 No Yes 5 7 2 1
R:R:F170 R:R:S173 3.96 1 Yes No 7 4 1 1
R:R:F170 R:R:F174 10.72 1 Yes Yes 7 5 1 2
R:R:F170 R:R:V196 3.93 1 Yes Yes 7 7 1 1
R:R:F170 R:R:F200 15 1 Yes Yes 7 7 1 2
R:R:C386 R:R:F170 2.79 1 No Yes 7 7 2 1
R:R:F170 R:R:L387 7.31 1 Yes Yes 7 7 1 2
L:L:?1 R:R:F170 3.17 1 Yes Yes 0 7 0 1
L:L:?1 R:R:S173 1.95 1 Yes No 0 4 0 1
R:R:F174 R:R:H178 12.44 1 Yes Yes 5 4 2 1
R:R:F174 R:R:S383 6.61 1 Yes No 5 6 2 1
R:R:F174 R:R:L387 3.65 1 Yes Yes 5 7 2 2
R:R:F177 R:R:H178 14.71 1 Yes Yes 4 4 1 1
R:R:F177 R:R:H181 10.18 1 Yes No 4 3 1 2
L:L:?1 R:R:F177 2.38 1 Yes Yes 0 4 0 1
L:L:?1 R:R:H178 10.04 1 Yes Yes 0 4 0 1
R:R:F189 R:R:H181 2.26 1 No No 9 3 2 2
R:R:F189 R:R:L193 4.87 1 No Yes 9 4 2 1
R:R:F189 R:R:P269 7.22 1 No No 9 3 2 2
R:R:L193 R:R:P269 3.28 1 Yes No 4 3 1 2
R:R:I271 R:R:L193 2.85 1 Yes Yes 3 4 1 1
L:L:?1 R:R:L193 1.8 1 Yes Yes 0 4 0 1
R:R:S199 R:R:V196 3.23 1 No Yes 7 7 2 1
R:R:F200 R:R:V196 3.93 1 Yes Yes 7 7 2 1
L:L:?1 R:R:V196 4.85 1 Yes Yes 0 7 0 1
L:L:?1 R:R:T197 12.46 1 Yes No 0 6 0 1
R:R:F200 R:R:S199 3.96 1 Yes No 7 7 2 2
R:R:C386 R:R:F200 6.98 1 No Yes 7 7 2 2
R:R:T201 R:R:W279 2.43 0 No Yes 6 6 2 1
R:R:I247 R:R:Y275 9.67 1 No Yes 5 7 2 1
R:R:F278 R:R:I247 3.77 1 No No 6 5 2 2
R:R:P251 R:R:W255 14.86 1 No Yes 6 5 2 2
R:R:P251 R:R:Y275 11.13 1 No Yes 6 7 2 1
R:R:W255 R:R:Y275 10.61 1 Yes Yes 5 7 2 1
R:R:L276 R:R:S265 6.01 1 Yes No 5 4 1 2
R:R:F268 R:R:I267 11.3 1 Yes Yes 5 4 1 2
R:R:D366 R:R:I267 11.2 0 No Yes 4 4 2 2
R:R:F379 R:R:I267 3.77 1 Yes Yes 4 4 1 2
R:R:F268 R:R:M363 3.73 1 Yes Yes 5 6 1 1
R:R:F268 R:R:F379 2.14 1 Yes Yes 5 4 1 1
L:L:?1 R:R:F268 27.73 1 Yes Yes 0 5 0 1
R:R:I271 R:R:Y275 2.42 1 Yes Yes 3 7 1 1
R:R:I271 R:R:L276 2.85 1 Yes Yes 3 5 1 1
L:L:?1 R:R:I271 5.57 1 Yes Yes 0 3 0 1
R:R:F278 R:R:Y275 8.25 1 No Yes 6 7 2 1
R:R:W279 R:R:Y275 4.82 1 Yes Yes 6 7 1 1
L:L:?1 R:R:Y275 6.86 1 Yes Yes 0 7 0 1
R:R:L276 R:R:M363 4.24 1 Yes Yes 5 6 1 1
L:L:?1 R:R:L276 5.4 1 Yes Yes 0 5 0 1
R:R:I280 R:R:W279 7.05 0 No Yes 5 6 2 1
R:R:V283 R:R:W279 7.36 1 No Yes 8 6 2 1
R:R:L359 R:R:W279 2.28 1 No Yes 7 6 2 1
R:R:L360 R:R:W279 3.42 1 No Yes 7 6 2 1
R:R:M363 R:R:W279 2.33 1 Yes Yes 6 6 1 1
L:L:?1 R:R:W279 20 1 Yes Yes 0 6 0 1
R:R:L360 R:R:V283 2.98 1 No No 7 8 2 2
R:R:L359 R:R:L360 4.15 1 No No 7 7 2 2
R:R:F379 R:R:I362 3.77 1 Yes No 4 4 1 2
R:R:C382 R:R:I362 3.27 1 No No 5 4 2 2
R:R:D366 R:R:M363 5.54 0 No Yes 4 6 2 1
L:L:?1 R:R:M363 1.84 1 Yes Yes 0 6 0 1
R:R:C382 R:R:F379 5.59 1 No Yes 5 4 2 1
L:L:?1 R:R:F379 4.75 1 Yes Yes 0 4 0 1
L:L:?1 R:R:S383 2.93 1 Yes No 0 6 0 1
R:R:G194 R:R:L193 1.71 0 No Yes 6 4 2 1
L:L:?1 R:R:A380 1.02 1 Yes No 0 4 0 1
StatisticsValue
Average Number Of Links16.00
Average Number Of Links With An Hub12.00
Average Interaction Strength7.05
Average Nodes In Shell44.00
Average Hubs In Shell18.00
Average Links In Shell69.00
Average Links Mediated by Hubs In Shell63.00
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 Links13.80
Average Number Of Links With An Hub9.60
Average Interaction Strength8.51
Average Nodes In Shell38.00
Average Hubs In Shell15.40
Average Links In Shell55.40
Average Links Mediated by Hubs In Shell51.60

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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 🔍)