CodeP32
Name4-{[(2S)-3-(tert-butylamino)-2-hydroxypropyl]oxy}-3H-indole-2-carbonitrile
Synonyms4-{[(2S)-3-(tert-butylamino)-2-hydroxypropyl]oxy}-3H-indole-2-carbonitrile
Identifier4-[(2S)-3-(tert-butylamino)-2-hydroxy-propoxy]-3H-indole-2-carbonitrile
FormulaC16 H21 N3 O2
Molecular Weight287.357
SMILESCC(C)(C)NC[C@@H](COc1cccc2c1CC(=N2)C#N)O
PubChem46937143
Formal Charge0
Total Atoms42
Total Chiral Atoms1
Total Bonds43
Total Aromatic Bonds6
Networks7
 missing image

This ligand is also present in the following 7 networks:
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
2VT4 A Amine Adrenergic Beta1 Meleagris gallopavo Cyanopindolol - - 2.7 2008-06-24 10.1038/nature07101

A 2D representation of the interactions of P32 in 2VT4
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:D121 R:R:V94 5.84 1 No No 7 7 1 2
R:R:V94 R:R:Y333 5.05 1 No Yes 7 7 2 1
R:R:V95 R:R:W330 4.9 1 Yes Yes 7 6 2 2
R:R:V95 R:R:Y333 3.79 1 Yes Yes 7 7 2 1
R:R:F201 R:R:T118 7.78 1 Yes No 4 6 1 2
R:R:D121 R:R:Y333 10.34 1 No Yes 7 7 1 1
L:L:?1 R:R:D121 19.19 1 Yes No 0 7 0 1
R:R:S173 R:R:V122 4.85 1 Yes No 7 6 2 1
R:R:I177 R:R:V122 4.61 1 Yes No 6 6 2 1
L:L:?1 R:R:V122 13.04 1 Yes No 0 6 0 1
R:R:S173 R:R:T126 7.99 1 Yes Yes 7 6 2 2
R:R:S215 R:R:T126 6.4 1 No Yes 6 6 1 2
R:R:S173 R:R:S215 3.26 1 Yes No 7 6 2 1
R:R:I177 R:R:W182 4.7 1 Yes Yes 6 5 2 2
R:R:F201 R:R:I177 6.28 1 Yes Yes 4 6 1 2
R:R:I177 R:R:Y207 3.63 1 Yes Yes 6 7 2 1
R:R:F201 R:R:W182 14.03 1 Yes Yes 4 5 1 2
R:R:T203 R:R:W182 3.64 1 No Yes 4 5 2 2
R:R:W182 R:R:Y207 5.79 1 Yes Yes 5 7 2 1
R:R:F201 R:R:T203 7.78 1 Yes No 4 4 1 2
R:R:F201 R:R:Y207 6.19 1 Yes Yes 4 7 1 1
L:L:?1 R:R:F201 9.84 1 Yes Yes 0 4 0 1
R:R:T203 R:R:Y207 6.24 1 No Yes 4 7 2 1
R:R:N204 R:R:Y207 3.49 0 No Yes 5 7 2 1
R:R:S211 R:R:Y207 15.26 1 No Yes 6 7 1 1
L:L:?1 R:R:Y207 3.95 1 Yes Yes 0 7 0 1
L:L:?1 R:R:S211 7.08 1 Yes No 0 6 0 1
L:L:?1 R:R:S215 4.04 1 Yes No 0 6 0 1
R:R:F216 R:R:F307 33.22 0 No Yes 7 7 2 1
R:R:F306 R:R:W303 6.01 1 Yes Yes 7 8 1 2
R:R:F307 R:R:W303 5.01 1 Yes Yes 7 8 1 2
R:R:F306 R:R:F307 9.65 1 Yes Yes 7 7 1 1
R:R:F306 R:R:F325 4.29 1 Yes No 7 4 1 2
R:R:F306 R:R:N329 9.67 1 Yes No 7 6 1 1
L:L:?1 R:R:F306 8.2 1 Yes Yes 0 7 0 1
L:L:?1 R:R:F307 11.48 1 Yes Yes 0 7 0 1
L:L:?1 R:R:N310 8.32 1 Yes No 0 6 0 1
R:R:N329 R:R:Y333 13.96 1 No Yes 6 7 1 1
L:L:?1 R:R:N329 13.87 1 Yes No 0 6 0 1
R:R:W330 R:R:Y333 13.5 1 Yes Yes 6 7 2 1
L:L:?1 R:R:Y333 3.95 1 Yes Yes 0 7 0 1
R:R:N310 R:R:S212 2.98 0 No No 6 6 1 2
R:R:P176 R:R:Y207 1.39 0 No Yes 7 7 2 1
StatisticsValue
Average Number Of Links11.00
Average Number Of Links With An Hub5.00
Average Interaction Strength9.36
Average Nodes In Shell27.00
Average Hubs In Shell13.00
Average Links In Shell43.00
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
2YCX A Amine Adrenergic Beta1 Meleagris gallopavo Cyanopindolol - - 3.25 2011-06-01 10.1073/pnas.1100185108

A 2D representation of the interactions of P32 in 2YCX
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:D121 R:R:V94 5.84 1 No No 7 7 1 2
R:R:V94 R:R:Y333 5.05 1 No Yes 7 7 2 1
R:R:V95 R:R:W330 6.13 1 No Yes 7 6 2 2
R:R:V95 R:R:Y333 5.05 1 No Yes 7 7 2 1
R:R:F97 R:R:W107 4.01 1 No Yes 4 7 2 2
R:R:F97 R:R:W117 6.01 1 No Yes 4 6 2 1
R:R:G98 R:R:W117 4.22 0 No Yes 6 6 2 1
R:R:W107 R:R:W117 10.31 1 Yes Yes 7 6 2 1
R:R:T118 R:R:W117 6.06 0 No Yes 6 6 2 1
L:L:?1 R:R:W117 5.37 1 Yes Yes 0 6 0 1
R:R:F201 R:R:T118 6.49 1 Yes No 4 6 1 2
R:R:D121 R:R:Y333 12.64 1 No Yes 7 7 1 1
L:L:?1 R:R:D121 20.11 1 Yes No 0 7 0 1
R:R:S173 R:R:V122 4.85 0 Yes No 7 6 2 1
L:L:?1 R:R:V122 6.02 1 Yes No 0 6 0 1
R:R:S173 R:R:T126 6.4 0 Yes No 7 6 2 2
R:R:S215 R:R:T126 6.4 0 No No 6 6 1 2
R:R:P176 R:R:Y207 5.56 0 No Yes 7 7 2 1
R:R:F201 R:R:W182 5.01 1 Yes Yes 4 5 1 2
R:R:T203 R:R:W182 3.64 1 Yes Yes 4 5 1 2
R:R:W182 R:R:Y207 5.79 1 Yes Yes 5 7 2 1
R:R:F201 R:R:T203 7.78 1 Yes Yes 4 4 1 1
R:R:F201 R:R:Y207 4.13 1 Yes Yes 4 7 1 1
L:L:?1 R:R:F201 7.38 1 Yes Yes 0 4 0 1
R:R:T203 R:R:Y207 6.24 1 Yes Yes 4 7 1 1
L:L:?1 R:R:T203 3.97 1 Yes Yes 0 4 0 1
R:R:N204 R:R:Y207 3.49 0 No Yes 5 7 2 1
R:R:S211 R:R:Y207 15.26 1 No Yes 6 7 1 1
L:L:?1 R:R:Y207 4.74 1 Yes Yes 0 7 0 1
L:L:?1 R:R:S211 9.1 1 Yes No 0 6 0 1
L:L:?1 R:R:S215 4.04 1 Yes No 0 6 0 1
R:R:F216 R:R:Y217 10.32 1 No Yes 7 5 2 2
R:R:F216 R:R:F307 34.29 1 No Yes 7 7 2 1
R:R:F307 R:R:Y217 4.13 1 Yes Yes 7 5 1 2
R:R:F306 R:R:W303 8.02 1 Yes Yes 7 8 1 2
R:R:F307 R:R:W303 7.02 1 Yes Yes 7 8 1 2
R:R:F306 R:R:F307 9.65 1 Yes Yes 7 7 1 1
R:R:F306 R:R:F325 3.22 1 Yes Yes 7 4 1 2
R:R:F306 R:R:N329 9.67 1 Yes No 7 6 1 1
L:L:?1 R:R:F306 9.02 1 Yes Yes 0 7 0 1
L:L:?1 R:R:F307 8.2 1 Yes Yes 0 7 0 1
R:R:F325 R:R:N310 6.04 0 Yes No 4 6 2 1
L:L:?1 R:R:N310 6.47 1 Yes No 0 6 0 1
R:R:N329 R:R:Y333 12.79 1 No Yes 6 7 1 1
L:L:?1 R:R:N329 12.02 1 Yes No 0 6 0 1
R:R:W330 R:R:Y333 15.43 1 Yes Yes 6 7 2 1
L:L:?1 R:R:Y333 5.53 1 Yes Yes 0 7 0 1
L:L:?1 R:R:A208 2.12 1 Yes No 0 6 0 1
R:R:A208 R:R:V314 1.7 0 No Yes 6 5 1 2
R:R:S173 R:R:V172 1.62 0 Yes No 7 5 2 2
R:R:S215 R:R:V172 1.62 0 No No 6 5 1 2
StatisticsValue
Average Number Of Links14.00
Average Number Of Links With An Hub7.00
Average Interaction Strength7.44
Average Nodes In Shell33.00
Average Hubs In Shell16.00
Average Links In Shell51.00
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 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
2YCY A Amine Adrenergic Beta1 Meleagris gallopavo Cyanopindolol - - 3.15 2011-06-08 10.1073/pnas.1100185108

A 2D representation of the interactions of P32 in 2YCY
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:D121 R:R:V94 5.84 1 No No 7 7 1 2
R:R:V94 R:R:Y333 6.31 1 No Yes 7 7 2 1
R:R:V95 R:R:W330 4.9 1 Yes Yes 7 6 2 2
R:R:V95 R:R:Y333 5.05 1 Yes Yes 7 7 2 1
R:R:W107 R:R:W117 18.74 1 Yes Yes 7 6 2 1
R:R:C199 R:R:W107 11.75 1 No Yes 9 7 2 2
R:R:C199 R:R:W117 3.92 1 No Yes 9 6 2 1
L:L:?1 R:R:W117 5.37 1 Yes Yes 0 6 0 1
R:R:F201 R:R:T118 5.19 1 Yes No 4 6 1 2
R:R:D121 R:R:Y333 10.34 1 No Yes 7 7 1 1
L:L:?1 R:R:D121 17.37 1 Yes No 0 7 0 1
L:L:?1 R:R:V122 12.04 1 Yes No 0 6 0 1
R:R:S215 R:R:T126 9.59 0 No Yes 6 6 1 2
R:R:F201 R:R:W182 5.01 1 Yes Yes 4 5 1 2
R:R:T203 R:R:W182 6.06 1 No Yes 4 5 2 2
R:R:W182 R:R:Y207 5.79 1 Yes Yes 5 7 2 2
R:R:F201 R:R:T203 7.78 1 Yes No 4 4 1 2
R:R:F201 R:R:Y207 4.13 1 Yes Yes 4 7 1 2
L:L:?1 R:R:F201 8.2 1 Yes Yes 0 4 0 1
R:R:T203 R:R:Y207 6.24 1 No Yes 4 7 2 2
R:R:S211 R:R:Y207 16.53 0 No Yes 6 7 1 2
L:L:?1 R:R:S211 8.09 1 Yes No 0 6 0 1
L:L:?1 R:R:S215 4.04 1 Yes No 0 6 0 1
R:R:F216 R:R:F307 27.86 0 Yes Yes 7 7 2 1
R:R:F306 R:R:W303 6.01 1 Yes Yes 7 8 1 2
R:R:F306 R:R:F307 8.57 1 Yes Yes 7 7 1 1
R:R:F306 R:R:N329 13.29 1 Yes No 7 6 1 1
L:L:?1 R:R:F306 7.38 1 Yes Yes 0 7 0 1
L:L:?1 R:R:F307 10.66 1 Yes Yes 0 7 0 1
R:R:F325 R:R:N310 6.04 0 No No 4 6 2 1
L:L:?1 R:R:N310 3.7 1 Yes No 0 6 0 1
R:R:N329 R:R:Y333 6.98 1 No Yes 6 7 1 1
L:L:?1 R:R:N329 13.87 1 Yes No 0 6 0 1
R:R:W330 R:R:Y333 11.58 1 Yes Yes 6 7 2 1
L:L:?1 R:R:Y333 3.95 1 Yes Yes 0 7 0 1
R:R:G98 R:R:W117 2.81 0 No Yes 6 6 2 1
R:R:G98 R:R:W330 2.81 0 No Yes 6 6 2 2
R:R:F307 R:R:S212 2.64 1 Yes No 7 6 1 2
StatisticsValue
Average Number Of Links11.00
Average Number Of Links With An Hub5.00
Average Interaction Strength8.61
Average Nodes In Shell27.00
Average Hubs In Shell14.00
Average Links In Shell38.00
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
4BVN A Amine Adrenergic Beta1 Meleagris gallopavo Cyanopindolol Na - 2.1 2014-04-02 10.1371/journal.pone.0092727

A 2D representation of the interactions of P32 in 4BVN
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:D121 R:R:V94 7.3 1 No No 7 7 1 2
R:R:V94 R:R:Y333 3.79 1 No Yes 7 7 2 1
R:R:V95 R:R:W330 4.9 1 Yes Yes 7 6 2 2
R:R:V95 R:R:Y333 3.79 1 Yes Yes 7 7 2 1
R:R:F201 R:R:T118 7.78 1 Yes No 4 6 1 2
R:R:D121 R:R:Y333 10.34 1 No Yes 7 7 1 1
L:L:?3 R:R:D121 18.28 1 Yes No 0 7 0 1
R:R:S173 R:R:V122 4.85 0 Yes No 7 6 2 1
L:L:?3 R:R:V122 11.04 1 Yes No 0 6 0 1
R:R:V125 R:R:W303 13.48 1 No Yes 6 8 1 1
L:L:?3 R:R:V125 4.01 1 Yes No 0 6 0 1
R:R:S173 R:R:T126 4.8 0 Yes Yes 7 6 2 2
R:R:S215 R:R:T126 9.59 0 No Yes 6 6 1 2
R:R:F201 R:R:W182 11.02 1 Yes Yes 4 5 1 2
R:R:T203 R:R:W182 3.64 1 Yes Yes 4 5 1 2
R:R:W182 R:R:Y207 6.75 1 Yes Yes 5 7 2 1
R:R:F201 R:R:T203 7.78 1 Yes Yes 4 4 1 1
R:R:F201 R:R:Y207 6.19 1 Yes Yes 4 7 1 1
L:L:?3 R:R:F201 9.02 1 Yes Yes 0 4 0 1
R:R:T203 R:R:Y207 6.24 1 Yes Yes 4 7 1 1
L:L:?3 R:R:T203 2.98 1 Yes Yes 0 4 0 1
R:R:N204 R:R:Y207 3.49 0 No Yes 5 7 2 1
R:R:S211 R:R:Y207 15.26 1 No Yes 6 7 1 1
L:L:?3 R:R:Y207 5.53 1 Yes Yes 0 7 0 1
L:L:?3 R:R:S211 7.08 1 Yes No 0 6 0 1
R:R:F307 R:R:S212 3.96 1 Yes Yes 7 6 1 1
R:R:N310 R:R:S212 2.98 1 No Yes 6 6 1 1
R:R:I311 R:R:S212 3.1 0 No Yes 5 6 2 1
L:L:?3 R:R:S212 3.03 1 Yes Yes 0 6 0 1
L:L:?3 R:R:S215 4.04 1 Yes No 0 6 0 1
R:R:F216 R:R:Y217 7.22 1 Yes No 7 5 2 2
R:R:F216 R:R:F307 34.29 1 Yes Yes 7 7 2 1
R:R:F307 R:R:Y217 4.13 1 Yes No 7 5 1 2
R:R:F299 R:R:W303 13.03 1 Yes Yes 9 8 2 1
R:R:F299 R:R:N335 7.25 1 Yes No 9 9 2 2
R:R:F306 R:R:W303 6.01 1 Yes Yes 7 8 1 1
R:R:F307 R:R:W303 6.01 1 Yes Yes 7 8 1 1
R:R:G332 R:R:W303 11.26 0 No Yes 6 8 2 1
R:R:N335 R:R:W303 4.52 1 No Yes 9 8 2 1
L:L:?3 R:R:W303 3.84 1 Yes Yes 0 8 0 1
R:R:F306 R:R:F307 8.57 1 Yes Yes 7 7 1 1
R:R:F306 R:R:F325 4.29 1 Yes No 7 4 1 2
R:R:F306 R:R:N329 12.08 1 Yes No 7 6 1 1
L:L:?3 R:R:F306 9.02 1 Yes Yes 0 7 0 1
L:L:?3 R:R:F307 10.66 1 Yes Yes 0 7 0 1
L:L:?3 R:R:N310 7.4 1 Yes No 0 6 0 1
R:R:N329 R:R:Y333 12.79 1 No Yes 6 7 1 1
L:L:?3 R:R:N329 13.87 1 Yes No 0 6 0 1
R:R:W330 R:R:Y333 14.47 1 Yes Yes 6 7 2 1
L:L:?3 R:R:Y333 5.53 1 Yes Yes 0 7 0 1
R:R:P176 R:R:Y207 2.78 1 No Yes 7 7 2 1
R:R:S173 R:R:V172 1.62 0 Yes No 7 5 2 2
R:R:S215 R:R:V172 1.62 0 No No 6 5 1 2
StatisticsValue
Average Number Of Links15.00
Average Number Of Links With An Hub8.00
Average Interaction Strength7.69
Average Nodes In Shell33.00
Average Hubs In Shell16.00
Average Links In Shell53.00
Average Links Mediated by Hubs In Shell51.00
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
5F8U A Amine Adrenergic Beta1 Meleagris gallopavo Cyanopindolol - - 3.35 2015-12-23 10.1038/nsmb.3130

A 2D representation of the interactions of P32 in 5F8U
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:D121 R:R:V94 5.84 1 No No 7 7 1 2
R:R:V94 R:R:Y333 6.31 1 No Yes 7 7 2 2
R:R:F97 R:R:W117 5.01 0 No Yes 4 6 2 1
R:R:G98 R:R:W117 5.63 0 No Yes 6 6 2 1
R:R:W107 R:R:W117 11.25 1 Yes Yes 7 6 2 1
R:R:T118 R:R:W117 4.85 1 No Yes 6 6 1 1
L:L:?1 R:R:W117 6.14 1 Yes Yes 0 6 0 1
R:R:F201 R:R:T118 3.89 1 Yes No 4 6 1 1
L:L:?1 R:R:T118 3.97 1 Yes No 0 6 0 1
R:R:D121 R:R:Y333 6.9 1 No Yes 7 7 1 2
L:L:?1 R:R:D121 20.11 1 Yes No 0 7 0 1
R:R:S173 R:R:V122 4.85 0 No No 7 6 2 1
L:L:?1 R:R:V122 12.04 1 Yes No 0 6 0 1
R:R:V125 R:R:W303 7.36 1 No Yes 6 8 1 1
L:L:?1 R:R:V125 4.01 1 Yes No 0 6 0 1
R:R:S173 R:R:T126 4.8 0 No Yes 7 6 2 2
R:R:S215 R:R:T126 4.8 0 No Yes 6 6 1 2
R:R:I177 R:R:W182 5.87 1 Yes Yes 6 5 2 2
R:R:F201 R:R:I177 3.77 1 Yes Yes 4 6 1 2
R:R:I177 R:R:Y207 3.63 1 Yes Yes 6 7 2 2
R:R:F201 R:R:W182 13.03 1 Yes Yes 4 5 1 2
R:R:T203 R:R:W182 8.49 1 No Yes 4 5 2 2
R:R:W182 R:R:Y207 6.75 1 Yes Yes 5 7 2 2
R:R:F201 R:R:T203 7.78 1 Yes No 4 4 1 2
R:R:F201 R:R:Y207 9.28 1 Yes Yes 4 7 1 2
L:L:?1 R:R:F201 9.02 1 Yes Yes 0 4 0 1
R:R:T203 R:R:Y207 4.99 1 No Yes 4 7 2 2
R:R:S211 R:R:Y207 10.17 0 No Yes 6 7 1 2
L:L:?1 R:R:S211 11.12 1 Yes No 0 6 0 1
L:L:?1 R:R:S215 4.04 1 Yes No 0 6 0 1
R:R:F216 R:R:F307 27.86 0 Yes Yes 7 7 2 1
R:R:F299 R:R:W303 8.02 0 Yes Yes 9 8 2 1
R:R:F306 R:R:W303 12.03 1 Yes Yes 7 8 1 1
R:R:F307 R:R:W303 8.02 1 Yes Yes 7 8 1 1
R:R:N329 R:R:W303 4.52 1 Yes Yes 6 8 1 1
R:R:G332 R:R:W303 11.26 0 No Yes 6 8 2 1
L:L:?1 R:R:W303 5.37 1 Yes Yes 0 8 0 1
R:R:F306 R:R:F307 13.93 1 Yes Yes 7 7 1 1
R:R:F306 R:R:N310 4.83 1 Yes Yes 7 6 1 1
R:R:F306 R:R:N329 9.67 1 Yes Yes 7 6 1 1
L:L:?1 R:R:F306 9.84 1 Yes Yes 0 7 0 1
R:R:F307 R:R:N310 3.62 1 Yes Yes 7 6 1 1
L:L:?1 R:R:F307 13.12 1 Yes Yes 0 7 0 1
R:R:F325 R:R:N310 3.62 0 No Yes 4 6 2 1
L:L:?1 R:R:N310 9.25 1 Yes Yes 0 6 0 1
R:R:N329 R:R:Y333 17.44 1 Yes Yes 6 7 1 2
L:L:?1 R:R:N329 11.1 1 Yes Yes 0 6 0 1
R:R:S215 R:R:V172 3.23 0 No No 6 5 1 2
R:R:N310 R:R:S212 2.98 1 Yes No 6 6 1 2
L:L:?1 R:R:A208 2.12 1 Yes No 0 6 0 1
StatisticsValue
Average Number Of Links14.00
Average Number Of Links With An Hub7.00
Average Interaction Strength8.66
Average Nodes In Shell32.00
Average Hubs In Shell16.00
Average Links In Shell50.00
Average Links Mediated by Hubs In Shell47.00
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
6H7O A Amine Adrenergic Beta1 Meleagris gallopavo Cyanopindolol - - 2.8 2018-10-17 10.1126/science.aau5595

A 2D representation of the interactions of P32 in 6H7O
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:D121 R:R:V94 7.3 1 No No 7 7 1 2
R:R:V95 R:R:W330 4.9 1 No Yes 7 6 2 2
R:R:V95 R:R:Y333 7.57 1 No Yes 7 7 2 1
R:R:F97 R:R:W107 5.01 1 No Yes 4 7 2 2
R:R:F97 R:R:W117 8.02 1 No Yes 4 6 2 1
R:R:G98 R:R:W117 4.22 0 No Yes 6 6 2 1
R:R:W107 R:R:W117 14.99 1 Yes Yes 7 6 2 1
L:L:?1 R:R:W117 5.37 1 Yes Yes 0 6 0 1
R:R:F201 R:R:T118 5.19 1 Yes No 4 6 1 2
R:R:D121 R:R:Y333 10.34 1 No Yes 7 7 1 1
L:L:?1 R:R:D121 20.11 1 Yes No 0 7 0 1
R:R:I177 R:R:V122 4.61 1 Yes No 6 6 2 1
L:L:?1 R:R:V122 12.04 1 Yes No 0 6 0 1
R:R:V125 R:R:W303 11.03 1 No Yes 6 8 1 1
L:L:?1 R:R:V125 7.02 1 Yes No 0 6 0 1
R:R:S215 R:R:T126 9.59 0 No No 6 6 1 2
R:R:I129 R:R:W303 8.22 0 No Yes 8 8 2 1
R:R:P176 R:R:Y207 4.17 1 No Yes 7 7 2 1
R:R:I177 R:R:W182 7.05 1 Yes Yes 6 5 2 2
R:R:F201 R:R:I177 5.02 1 Yes Yes 4 6 1 2
R:R:F201 R:R:W182 12.03 1 Yes Yes 4 5 1 2
R:R:W182 R:R:Y207 5.79 1 Yes Yes 5 7 2 1
R:R:F201 R:R:T203 7.78 1 Yes No 4 4 1 2
R:R:F201 R:R:Y207 6.19 1 Yes Yes 4 7 1 1
L:L:?1 R:R:F201 8.2 1 Yes Yes 0 4 0 1
R:R:T203 R:R:Y207 8.74 1 No Yes 4 7 2 1
R:R:S211 R:R:Y207 16.53 1 No Yes 6 7 1 1
L:L:?1 R:R:Y207 6.32 1 Yes Yes 0 7 0 1
L:L:?1 R:R:S211 10.11 1 Yes No 0 6 0 1
R:R:F307 R:R:S212 5.28 1 Yes No 7 6 1 2
R:R:N310 R:R:S212 5.96 1 No No 6 6 1 2
L:L:?1 R:R:S215 4.04 1 Yes No 0 6 0 1
R:R:F216 R:R:F307 21.43 0 Yes Yes 7 7 2 1
R:R:F306 R:R:W303 7.02 1 Yes Yes 7 8 1 1
R:R:F307 R:R:W303 10.02 1 Yes Yes 7 8 1 1
R:R:G332 R:R:W303 11.26 0 No Yes 6 8 2 1
R:R:N335 R:R:W303 6.78 0 No Yes 9 8 2 1
L:L:?1 R:R:W303 4.6 1 Yes Yes 0 8 0 1
R:R:F306 R:R:F307 12.86 1 Yes Yes 7 7 1 1
R:R:F306 R:R:N310 4.83 1 Yes No 7 6 1 1
R:R:F306 R:R:F325 4.29 1 Yes No 7 4 1 2
R:R:F306 R:R:N329 13.29 1 Yes No 7 6 1 1
L:L:?1 R:R:F306 10.66 1 Yes Yes 0 7 0 1
L:L:?1 R:R:F307 10.66 1 Yes Yes 0 7 0 1
L:L:?1 R:R:N310 13.87 1 Yes No 0 6 0 1
R:R:N329 R:R:Y333 15.12 1 No Yes 6 7 1 1
L:L:?1 R:R:N329 14.8 1 Yes No 0 6 0 1
R:R:W330 R:R:Y333 6.75 1 Yes Yes 6 7 2 1
L:L:?1 R:R:Y333 6.32 1 Yes Yes 0 7 0 1
R:R:S215 R:R:V172 3.23 0 No No 6 5 1 2
R:R:N204 R:R:Y207 2.33 0 No Yes 5 7 2 1
StatisticsValue
Average Number Of Links14.00
Average Number Of Links With An Hub7.00
Average Interaction Strength9.58
Average Nodes In Shell35.00
Average Hubs In Shell13.00
Average Links In Shell51.00
Average Links Mediated by Hubs In Shell47.00
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
8DCS A Amine Adrenergic Beta1 Meleagris gallopavo Cyanopindolol - Gs/Beta1/Gamma2 2.5 2022-07-27 10.1038/s41467-022-31823-1

A 2D representation of the interactions of P32 in 8DCS
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:D121 R:R:V94 11.69 3 No No 7 7 1 2
R:R:V94 R:R:Y333 3.79 3 No Yes 7 7 2 1
R:R:V95 R:R:Y333 6.31 0 No Yes 7 7 2 1
R:R:F97 R:R:W117 10.02 0 No No 4 6 2 1
R:R:W107 R:R:W117 11.25 22 Yes No 7 6 2 1
R:R:F201 R:R:T118 5.19 3 Yes No 4 6 1 2
R:R:D121 R:R:Y333 10.34 3 No Yes 7 7 1 1
L:L:?1 R:R:D121 20.11 3 Yes No 0 7 0 1
L:L:?1 R:R:V122 12.04 3 Yes No 0 6 0 1
R:R:S215 R:R:T126 9.59 0 No No 6 6 1 2
R:R:F201 R:R:W182 7.02 3 Yes Yes 4 5 1 2
R:R:T203 R:R:W182 3.64 3 Yes Yes 4 5 1 2
R:R:W182 R:R:Y207 4.82 3 Yes Yes 5 7 2 2
R:R:F201 R:R:T203 7.78 3 Yes Yes 4 4 1 1
R:R:F201 R:R:Y207 4.13 3 Yes Yes 4 7 1 2
L:L:?1 R:R:F201 7.38 3 Yes Yes 0 4 0 1
R:R:T203 R:R:Y207 4.99 3 Yes Yes 4 7 1 2
L:L:?1 R:R:T203 3.97 3 Yes Yes 0 4 0 1
R:R:S211 R:R:Y207 13.99 0 No Yes 6 7 1 2
L:L:?1 R:R:S211 10.11 3 Yes No 0 6 0 1
R:R:N310 R:R:S212 4.47 3 No No 6 6 1 2
L:L:?1 R:R:S215 4.04 3 Yes No 0 6 0 1
R:R:F216 R:R:F307 24.65 3 Yes Yes 7 7 2 1
R:R:F306 R:R:W303 7.02 3 Yes Yes 7 8 1 2
R:R:F307 R:R:W303 9.02 3 Yes Yes 7 8 1 2
R:R:F306 R:R:F307 11.79 3 Yes Yes 7 7 1 1
R:R:F306 R:R:F325 6.43 3 Yes No 7 4 1 2
R:R:F306 R:R:N329 9.67 3 Yes No 7 6 1 1
L:L:?1 R:R:F306 9.84 3 Yes Yes 0 7 0 1
R:R:F307 R:R:N310 3.62 3 Yes No 7 6 1 1
L:L:?1 R:R:F307 6.56 3 Yes Yes 0 7 0 1
L:L:?1 R:R:N310 7.4 3 Yes No 0 6 0 1
R:R:N329 R:R:Y333 11.63 3 No Yes 6 7 1 1
L:L:?1 R:R:N329 11.1 3 Yes No 0 6 0 1
R:R:W330 R:R:Y333 7.72 3 Yes Yes 6 7 2 1
L:L:?1 R:R:Y333 3.95 3 Yes Yes 0 7 0 1
L:L:?1 R:R:W117 3.07 3 Yes No 0 6 0 1
L:L:?1 R:R:A208 2.12 3 Yes No 0 6 0 1
R:R:A208 R:R:V314 1.7 0 No No 6 5 1 2
R:R:S211 R:R:V172 1.62 0 No Yes 6 5 1 2
R:R:S215 R:R:V172 1.62 0 No Yes 6 5 1 2
StatisticsValue
Average Number Of Links13.00
Average Number Of Links With An Hub5.00
Average Interaction Strength7.82
Average Nodes In Shell29.00
Average Hubs In Shell13.00
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 🔍)
StatisticsValue
Average Number Of Links13.14
Average Number Of Links With An Hub6.29
Average Interaction Strength8.45
Average Nodes In Shell30.86
Average Hubs In Shell14.43
Average Links In Shell46.71
Average Links Mediated by Hubs In Shell43.71

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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 🔍)