CodeR5F
NameRotigotine
Synonyms(6~{S})-6-[propyl(2-thiophen-2-ylethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
Identifier(6~{S})-6-[propyl(2-thiophen-2-ylethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
FormulaC19 H25 N O S
Molecular Weight315.473
SMILESCCCN(CCc1cccs1)[C@H]2CCc3c(cccc3O)C2
PubChem59227
Formal Charge0
Total Atoms47
Total Chiral Atoms1
Total Bonds49
Total Aromatic Bonds11
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
8IRR A Amine Dopamine D1 Homo sapiens Rotigotine - Gs/Beta1/Gamma2 3.2 2023-06-07  10.1038/s41422-023-00808-0

A 2D representation of the interactions of R5F in 8IRR
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:V73 R:R:W321 3.68 0 No Yes 8 7 2 1
R:R:V77 R:R:W99 4.9 2 No Yes 8 5 2 2
R:R:D103 R:R:V77 5.84 2 Yes No 7 8 1 2
R:R:V77 R:R:W321 7.36 2 No Yes 8 7 2 1
R:R:K81 R:R:W99 6.96 2 No Yes 6 5 2 2
R:R:K81 R:R:W321 4.64 2 No Yes 6 7 2 1
R:R:D103 R:R:W99 6.7 2 Yes Yes 7 5 1 2
R:R:W321 R:R:W99 3.75 2 Yes Yes 7 5 1 2
R:R:D103 R:R:S107 4.42 2 Yes No 7 7 1 1
R:R:D103 R:R:W321 8.93 2 Yes Yes 7 7 1 1
L:L:?1 R:R:D103 17.87 2 Yes Yes 0 7 0 1
R:R:I104 R:R:S155 6.19 0 No No 6 7 1 2
R:R:I104 R:R:Y194 4.84 0 No Yes 6 7 1 2
L:L:?1 R:R:I104 15.04 2 Yes No 0 6 0 1
R:R:S107 R:R:W285 7.41 2 No Yes 7 8 1 1
L:L:?1 R:R:S107 5.93 2 Yes No 0 7 0 1
R:R:I154 R:R:T108 4.56 0 No No 5 6 2 2
R:R:S202 R:R:T108 6.4 0 No No 6 6 1 2
R:R:I111 R:R:W285 17.62 0 No Yes 8 8 2 1
R:R:I154 R:R:S198 6.19 0 No No 5 7 2 1
L:L:?1 R:R:S188 6.92 2 Yes No 0 5 0 1
R:R:S198 R:R:Y194 13.99 0 No Yes 7 7 1 2
L:L:?1 R:R:S198 6.92 2 Yes No 0 7 0 1
R:R:F289 R:R:S199 5.28 2 Yes No 7 7 1 2
R:R:N292 R:R:S199 5.96 2 No No 6 7 1 2
L:L:?1 R:R:S202 5.93 2 Yes No 0 6 0 1
R:R:F203 R:R:W285 4.01 2 Yes Yes 8 8 2 1
R:R:F203 R:R:F289 24.65 2 Yes Yes 8 7 2 1
R:R:F281 R:R:W285 5.01 0 No Yes 9 8 2 1
R:R:F289 R:R:W285 5.01 2 Yes Yes 7 8 1 1
R:R:G320 R:R:W285 8.44 0 No Yes 7 8 2 1
R:R:N323 R:R:W285 9.04 0 No Yes 9 8 2 1
L:L:?1 R:R:W285 3.75 2 Yes Yes 0 8 0 1
R:R:F288 R:R:F289 11.79 2 Yes Yes 7 7 1 1
R:R:F288 R:R:N292 12.08 2 Yes No 7 6 1 1
R:R:F288 R:R:F313 6.43 2 Yes No 7 4 1 2
L:L:?1 R:R:F288 18.44 2 Yes Yes 0 7 0 1
L:L:?1 R:R:F289 10.42 2 Yes Yes 0 7 0 1
L:L:?1 R:R:N292 7.23 2 Yes No 0 6 0 1
R:R:V317 R:R:W321 7.36 2 No Yes 6 7 1 1
L:L:?1 R:R:V317 14.71 2 Yes No 0 6 0 1
R:R:W318 R:R:W321 12.18 0 No Yes 5 7 2 1
L:L:?1 R:R:W321 8.25 2 Yes Yes 0 7 0 1
L:L:?1 R:R:D314 1.79 2 Yes No 0 4 0 1
StatisticsValue
Average Number Of Links13.00
Average Number Of Links With An Hub5.00
Average Interaction Strength9.48
Average Nodes In Shell30.00
Average Hubs In Shell9.00
Average Links In Shell44.00
Average Links Mediated by Hubs In Shell39.00
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
8IRS A Amine Dopamine D2 Homo sapiens Rotigotine - Gi1/Beta1/Gamma2 3 2023-06-07  10.1038/s41422-023-00808-0

A 2D representation of the interactions of R5F in 8IRS
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:V83 R:R:Y416 2.52 0 No Yes 8 8 2 1
R:R:D114 R:R:V87 5.84 1 No No 8 8 1 2
R:R:V87 R:R:Y416 3.79 1 No Yes 8 8 2 1
R:R:M88 R:R:W413 2.33 1 Yes Yes 9 8 2 2
R:R:M88 R:R:Y416 10.78 1 Yes Yes 9 8 2 1
R:R:V91 R:R:W413 4.9 1 No Yes 8 8 2 2
R:R:V91 R:R:Y416 8.83 1 No Yes 8 8 2 1
R:R:D114 R:R:Y416 6.9 1 No Yes 8 8 1 1
L:L:?1 R:R:D114 16.98 1 Yes No 0 8 0 1
R:R:S167 R:R:V115 6.46 0 No No 9 8 2 1
R:R:L170 R:R:V115 2.98 7 Yes No 8 8 2 1
L:L:?1 R:R:V115 12.75 1 Yes No 0 8 0 1
R:R:C118 R:R:W386 5.22 1 No Yes 8 9 1 1
R:R:C118 R:R:Y416 2.69 1 No Yes 8 8 1 1
L:L:?1 R:R:C118 4.18 1 Yes No 0 8 0 1
R:R:L123 R:R:T119 2.95 0 Yes Yes 8 8 2 1
R:R:S163 R:R:T119 3.2 0 No Yes 8 8 2 1
R:R:S197 R:R:T119 9.59 1 No Yes 8 8 1 1
L:L:?1 R:R:T119 2.91 1 Yes Yes 0 8 0 1
R:R:F198 R:R:I122 2.51 1 Yes Yes 9 9 2 2
R:R:F382 R:R:I122 2.51 1 Yes Yes 9 9 2 2
R:R:I122 R:R:W386 12.92 1 Yes Yes 9 9 2 1
R:R:F390 R:R:I122 2.51 1 Yes Yes 8 9 1 2
R:R:I166 R:R:S193 3.1 0 Yes No 8 9 2 1
R:R:I166 R:R:S197 6.19 0 Yes No 8 8 2 1
R:R:F189 R:R:L170 6.09 7 Yes Yes 8 8 2 2
R:R:E181 R:R:I183 5.47 0 No No 4 5 2 1
L:L:?1 R:R:I183 9.4 1 Yes No 0 5 0 1
R:R:F189 R:R:S193 6.61 7 Yes No 8 9 2 1
R:R:H393 R:R:V190 4.15 1 Yes No 8 7 1 2
L:L:?1 R:R:S193 7.91 1 Yes No 0 9 0 1
R:R:S194 R:R:Y199 2.54 1 No Yes 8 7 2 2
R:R:F390 R:R:S194 6.61 1 Yes No 8 8 1 2
L:L:?1 R:R:S197 3.95 1 Yes No 0 8 0 1
R:R:F198 R:R:Y199 5.16 1 Yes Yes 9 7 2 2
R:R:F198 R:R:F382 5.36 1 Yes Yes 9 9 2 2
R:R:F198 R:R:W386 5.01 1 Yes Yes 9 9 2 1
R:R:F198 R:R:F390 25.72 1 Yes Yes 9 8 2 1
R:R:F390 R:R:Y199 3.09 1 Yes Yes 8 7 1 2
R:R:F382 R:R:W386 4.01 1 Yes Yes 9 9 2 1
R:R:F389 R:R:W386 5.01 1 Yes Yes 8 9 1 1
R:R:F390 R:R:W386 12.03 1 Yes Yes 8 9 1 1
R:R:G415 R:R:W386 8.44 0 No Yes 8 9 2 1
R:R:N418 R:R:W386 10.17 0 Yes Yes 9 9 2 1
L:L:?1 R:R:W386 3 1 Yes Yes 0 9 0 1
R:R:F389 R:R:F390 9.65 1 Yes Yes 8 8 1 1
R:R:F389 R:R:H393 15.84 1 Yes Yes 8 8 1 1
R:R:F389 R:R:T412 6.49 1 Yes Yes 8 8 1 1
L:L:?1 R:R:F389 16.84 1 Yes Yes 0 8 0 1
L:L:?1 R:R:F390 8.02 1 Yes Yes 0 8 0 1
R:R:H393 R:R:Y408 6.53 1 Yes Yes 8 5 1 1
L:L:?1 R:R:H393 5.08 1 Yes Yes 0 8 0 1
R:R:I403 R:R:N396 9.91 1 No No 6 5 2 2
R:R:N396 R:R:Y408 8.14 1 No Yes 5 5 2 1
R:R:I403 R:R:Y408 4.84 1 No Yes 6 5 2 1
R:R:T412 R:R:Y408 2.5 1 Yes Yes 8 5 1 1
L:L:?1 R:R:Y408 3.86 1 Yes Yes 0 5 0 1
R:R:T412 R:R:Y416 2.5 1 Yes Yes 8 8 1 1
L:L:?1 R:R:T412 9.7 1 Yes Yes 0 8 0 1
R:R:W413 R:R:Y416 3.86 1 Yes Yes 8 8 2 1
L:L:?1 R:R:Y416 13.12 1 Yes Yes 0 8 0 1
StatisticsValue
Average Number Of Links14.00
Average Number Of Links With An Hub8.00
Average Interaction Strength8.41
Average Nodes In Shell37.00
Average Hubs In Shell20.00
Average Links In Shell61.00
Average Links Mediated by Hubs In Shell57.00
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
8IRT A Amine Dopamine D3 Homo sapiens Rotigotine - Gi1/Beta1/Gamma2 2.7 2023-06-07  10.1038/s41422-023-00808-0

A 2D representation of the interactions of R5F in 8IRT
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:D110 R:R:V82 5.84 3 Yes No 8 8 1 2
R:R:V82 R:R:Y373 3.79 3 No Yes 8 8 2 1
R:R:M83 R:R:Y373 10.78 0 No Yes 8 8 2 1
R:R:V86 R:R:Y373 7.57 0 No Yes 8 8 2 1
R:R:G94 R:R:L89 3.42 0 No No 5 5 2 1
R:R:C114 R:R:D110 4.67 3 No Yes 7 8 1 1
R:R:D110 R:R:Y373 9.2 3 Yes Yes 8 8 1 1
L:L:?1 R:R:D110 17.87 3 Yes Yes 0 8 0 1
R:R:S165 R:R:V111 3.23 0 No No 8 8 2 1
R:R:L168 R:R:V111 4.47 13 Yes No 7 8 2 1
L:L:?1 R:R:V111 12.75 3 Yes No 0 8 0 1
R:R:C114 R:R:W342 5.22 3 No Yes 7 8 1 2
L:L:?1 R:R:C114 5.22 3 Yes No 0 7 0 1
R:R:S196 R:R:T115 9.59 0 No No 8 8 1 2
R:R:S192 R:R:V164 3.23 0 No No 8 7 1 2
R:R:S196 R:R:V164 4.85 0 No No 8 7 1 2
R:R:F188 R:R:L168 13.4 13 Yes Yes 7 7 2 2
R:R:F188 R:R:S192 13.21 13 Yes No 7 8 2 1
R:R:H349 R:R:V189 12.45 3 Yes No 8 7 1 2
L:L:?1 R:R:S192 6.92 3 Yes No 0 8 0 1
R:R:F346 R:R:S193 5.28 3 Yes No 7 8 1 2
R:R:H349 R:R:S193 4.18 3 Yes No 8 8 1 2
L:L:?1 R:R:S196 3.95 3 Yes No 0 8 0 1
R:R:F197 R:R:Y198 11.35 3 Yes No 9 6 2 2
R:R:F197 R:R:W342 4.01 3 Yes Yes 9 8 2 2
R:R:F197 R:R:F346 25.72 3 Yes Yes 9 7 2 1
R:R:F346 R:R:Y198 4.13 3 Yes No 7 6 1 2
R:R:F346 R:R:W342 6.01 3 Yes Yes 7 8 1 2
R:R:F345 R:R:F346 10.72 3 Yes Yes 8 7 1 1
R:R:F345 R:R:H349 11.31 3 Yes Yes 8 8 1 1
R:R:F345 R:R:Y365 8.25 3 Yes No 8 4 1 2
R:R:F345 R:R:T369 5.19 3 Yes No 8 6 1 1
L:L:?1 R:R:F345 18.44 3 Yes Yes 0 8 0 1
L:L:?1 R:R:F346 10.42 3 Yes Yes 0 7 0 1
R:R:H349 R:R:Y365 8.71 3 Yes No 8 4 1 2
L:L:?1 R:R:H349 11.85 3 Yes Yes 0 8 0 1
R:R:T369 R:R:Y373 4.99 3 No Yes 6 8 1 1
L:L:?1 R:R:T369 7.76 3 Yes No 0 6 0 1
L:L:?1 R:R:Y373 16.98 3 Yes Yes 0 8 0 1
R:R:F345 R:R:T368 2.59 3 Yes No 8 6 1 2
L:L:?1 R:R:L89 1.82 3 Yes No 0 5 0 1
StatisticsValue
Average Number Of Links11.00
Average Number Of Links With An Hub5.00
Average Interaction Strength10.36
Average Nodes In Shell28.00
Average Hubs In Shell10.00
Average Links In Shell41.00
Average Links Mediated by Hubs In Shell36.00
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
8IRU A Amine Dopamine D4 Homo sapiens Rotigotine - chim(NtGi1-Gs-CtGi1)/Beta1/Gamma2 3.2 2023-06-07  10.1038/s41422-023-00808-0

A 2D representation of the interactions of R5F in 8IRU
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:L83 R:R:V87 4.47 0 No Yes 8 8 2 2
R:R:L83 R:R:Y390 5.86 0 No Yes 8 8 2 1
R:R:D115 R:R:V87 5.84 2 No Yes 9 8 1 2
R:R:L88 R:R:Y390 8.21 2 Yes Yes 8 8 2 1
R:R:E95 R:R:F91 9.33 2 No Yes 6 8 2 1
R:R:F91 R:R:T386 6.49 2 Yes No 8 6 1 1
R:R:F91 R:R:W387 15.03 2 Yes No 8 8 1 2
R:R:F91 R:R:Y390 12.38 2 Yes Yes 8 8 1 1
L:L:?1 R:R:F91 4.81 2 Yes Yes 0 8 0 1
R:R:E95 R:R:W387 14.17 2 No No 6 8 2 2
R:R:L187 R:R:M112 5.65 0 No No 7 7 2 1
L:L:?1 R:R:M112 6.52 2 Yes No 0 7 0 1
R:R:D115 R:R:Y390 8.05 2 No Yes 9 8 1 1
L:L:?1 R:R:D115 19.66 2 Yes No 0 9 0 1
R:R:A167 R:R:V116 3.39 0 No No 9 9 2 1
R:R:V116 R:R:Y192 3.79 0 No Yes 9 8 1 2
L:L:?1 R:R:V116 9.81 2 Yes No 0 9 0 1
R:R:C119 R:R:W359 3.92 0 No Yes 8 9 1 2
L:L:?1 R:R:C119 5.22 2 Yes No 0 8 0 1
R:R:T120 R:R:V166 6.35 2 Yes No 8 8 2 2
R:R:S200 R:R:T120 9.59 2 No Yes 8 8 1 2
R:R:S200 R:R:V166 4.85 2 No No 8 8 1 2
R:R:L187 R:R:Y192 5.86 0 No Yes 7 8 2 2
R:R:L187 R:R:V193 2.98 0 No No 7 7 2 2
R:R:S196 R:R:Y192 13.99 0 No Yes 9 8 1 2
R:R:H366 R:R:V193 12.45 2 Yes No 7 7 1 2
L:L:?1 R:R:S196 5.93 2 Yes No 0 9 0 1
R:R:F363 R:R:S197 5.28 2 Yes No 8 8 1 1
R:R:H366 R:R:S197 4.18 2 Yes No 7 8 1 1
L:L:?1 R:R:S197 2.97 2 Yes No 0 8 0 1
L:L:?1 R:R:S200 3.95 2 Yes No 0 8 0 1
R:R:F201 R:R:W359 3.01 2 Yes Yes 9 9 2 2
R:R:F201 R:R:F363 21.43 2 Yes Yes 9 8 2 1
R:R:F363 R:R:W359 5.01 2 Yes Yes 8 9 1 2
R:R:F362 R:R:F363 12.86 2 Yes Yes 8 8 1 1
R:R:F362 R:R:H366 14.71 2 Yes Yes 8 7 1 1
R:R:F362 R:R:T386 6.49 2 Yes No 8 6 1 1
L:L:?1 R:R:F362 14.43 2 Yes Yes 0 8 0 1
L:L:?1 R:R:F363 10.42 2 Yes Yes 0 8 0 1
L:L:?1 R:R:H366 11.85 2 Yes Yes 0 7 0 1
L:L:?1 R:R:T386 3.88 2 Yes No 0 6 0 1
L:L:?1 R:R:Y390 12.35 2 Yes Yes 0 8 0 1
StatisticsValue
Average Number Of Links13.00
Average Number Of Links With An Hub5.00
Average Interaction Strength8.60
Average Nodes In Shell27.00
Average Hubs In Shell12.00
Average Links In Shell42.00
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 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8IRV A Amine Dopamine D5 Homo sapiens Rotigotine - chim(NtGi1-Gs)/Beta1/Gamma2 3.1 2023-06-07  10.1038/s41422-023-00808-0

A 2D representation of the interactions of R5F in 8IRV
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:M95 R:R:V90 3.04 1 Yes Yes 8 8 2 2
R:R:V90 R:R:W349 4.9 1 Yes Yes 8 8 2 1
R:R:V94 R:R:W116 4.9 1 Yes Yes 7 7 2 2
R:R:D120 R:R:V94 7.3 1 Yes Yes 8 7 1 2
R:R:V94 R:R:W349 4.9 1 Yes Yes 7 8 2 1
R:R:M95 R:R:W346 5.82 1 Yes Yes 8 6 2 2
R:R:M95 R:R:W349 6.98 1 Yes Yes 8 8 2 1
R:R:E102 R:R:K98 10.8 1 No Yes 6 7 2 1
R:R:K98 R:R:W116 4.64 1 Yes Yes 7 7 1 2
R:R:D342 R:R:K98 6.91 1 No Yes 5 7 2 1
R:R:K98 R:R:W346 4.64 1 Yes Yes 7 6 1 2
R:R:K98 R:R:W349 4.64 1 Yes Yes 7 8 1 1
L:L:?1 R:R:K98 3.71 1 Yes Yes 0 7 0 1
R:R:D342 R:R:E102 7.8 1 No No 5 6 2 2
R:R:D120 R:R:W116 3.35 1 Yes Yes 8 7 1 2
R:R:D120 R:R:S124 4.42 1 Yes No 8 7 1 1
R:R:D120 R:R:W349 10.05 1 Yes Yes 8 8 1 1
L:L:?1 R:R:D120 11.62 1 Yes Yes 0 8 0 1
R:R:I121 R:R:S172 6.19 0 No No 7 8 1 2
R:R:I121 R:R:Y225 4.84 0 No Yes 7 8 1 2
L:L:?1 R:R:I121 9.4 1 Yes No 0 7 0 1
L:L:?1 R:R:S124 4.94 1 Yes No 0 7 0 1
R:R:L129 R:R:T125 2.95 0 No Yes 7 7 2 1
R:R:S168 R:R:T125 3.2 0 No Yes 8 7 2 1
R:R:I171 R:R:T125 4.56 1 No Yes 6 7 2 1
R:R:S233 R:R:T125 9.59 1 No Yes 7 7 1 1
L:L:?1 R:R:T125 2.91 1 Yes Yes 0 7 0 1
R:R:I171 R:R:S229 4.64 1 No No 6 6 2 1
R:R:I171 R:R:S233 3.1 1 No No 6 7 2 1
L:L:?1 R:R:S219 8.9 1 Yes No 0 4 0 1
R:R:S229 R:R:Y225 12.72 0 No Yes 6 8 1 2
L:L:?1 R:R:S229 6.92 1 Yes No 0 6 0 1
R:R:F313 R:R:S230 5.28 1 Yes No 7 7 1 2
R:R:N316 R:R:S230 5.96 1 No No 7 7 1 2
L:L:?1 R:R:S233 3.95 1 Yes No 0 7 0 1
R:R:F234 R:R:Y235 9.28 1 Yes No 8 5 2 2
R:R:F234 R:R:W309 4.01 1 Yes Yes 8 8 2 2
R:R:F234 R:R:F313 20.36 1 Yes Yes 8 7 2 1
R:R:F313 R:R:Y235 3.09 1 Yes No 7 5 1 2
R:R:F313 R:R:W309 5.01 1 Yes Yes 7 8 1 2
R:R:F312 R:R:F313 10.72 1 Yes Yes 7 7 1 1
R:R:F312 R:R:N316 12.08 1 Yes No 7 7 1 1
R:R:F312 R:R:F341 5.36 1 Yes Yes 7 4 1 1
L:L:?1 R:R:F312 12.03 1 Yes Yes 0 7 0 1
L:L:?1 R:R:F313 7.22 1 Yes Yes 0 7 0 1
R:R:F341 R:R:L315 3.65 1 Yes No 4 5 1 2
L:L:?1 R:R:N316 3.62 1 Yes No 0 7 0 1
R:R:F341 R:R:V319 3.93 1 Yes No 4 4 1 2
L:L:?1 R:R:F341 4.81 1 Yes Yes 0 4 0 1
R:R:V345 R:R:W349 7.36 1 No Yes 6 8 1 1
L:L:?1 R:R:V345 11.77 1 Yes No 0 6 0 1
R:R:W346 R:R:W349 11.25 1 Yes Yes 6 8 2 1
L:L:?1 R:R:W349 7.5 1 Yes Yes 0 8 0 1
StatisticsValue
Average Number Of Links14.00
Average Number Of Links With An Hub7.00
Average Interaction Strength7.09
Average Nodes In Shell33.00
Average Hubs In Shell16.00
Average Links In Shell53.00
Average Links Mediated by Hubs In Shell48.00
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 Links13.00
Average Number Of Links With An Hub6.00
Average Interaction Strength8.79
Average Nodes In Shell31.00
Average Hubs In Shell13.40
Average Links In Shell48.20
Average Links Mediated by Hubs In Shell43.40

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Physico-chemical properties of the nodes interacting with this ligand

(Click to enlarge 🔍)

missing image


Location of the nodes interacting with this ligand

(Click to enlarge 🔍)