Code9IG
Name3-(2-chlorophenyl)-N-[(1R)-1-(3-methoxyphenyl)ethyl]propan-1-amine
Synonyms
Identifier3-(2-chlorophenyl)-~{N}-[(1~{R})-1-(3-methoxyphenyl)ethyl]propan-1-amine
FormulaC18 H22 Cl N O
Molecular Weight303.826
SMILESC[C@H](c1cccc(c1)OC)NCCCc2ccccc2Cl
PubChem158797
Formal Charge0
Total Atoms43
Total Chiral Atoms1
Total Bonds44
Total Aromatic Bonds12
Networks3
 missing image

This ligand is also present in the following 3 networks:
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
7SIL C Ion Calcium-sensing CaS Homo sapiens Ca Ca; Ca; Ca; Cyclomethyltryptophan; 9IG; PO4 - 2.7 2022-01-19 10.1073/pnas.2115849118

A 2D representation of the interactions of 9IG in 7SIL
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:F684 R:R:S664 3.96 10 Yes No 8 6 1 2
R:R:E837 R:R:F668 7 10 Yes No 9 9 1 2
R:R:F668 R:R:I841 3.77 0 No No 9 9 2 2
R:R:E767 R:R:Q681 11.47 10 No Yes 7 9 2 1
R:R:L773 R:R:Q681 5.32 10 Yes Yes 8 9 1 1
R:R:E837 R:R:Q681 5.1 10 Yes Yes 9 9 1 1
R:R:Q681 W:W:?1 19.07 10 Yes Yes 9 0 1 0
R:R:F684 R:R:F688 7.5 10 Yes Yes 8 8 1 2
R:R:F684 R:R:W818 9.02 10 Yes Yes 8 9 1 1
R:R:F684 R:R:I841 18.84 10 Yes No 8 9 1 2
R:R:F684 W:W:?1 17.45 10 Yes Yes 8 0 1 0
R:R:F688 R:R:F814 10.72 0 Yes Yes 8 9 2 1
R:R:T780 R:R:V689 4.76 0 No No 7 7 1 2
R:R:E767 R:R:L773 3.98 10 No Yes 7 8 2 1
R:R:I777 R:R:L773 5.71 10 No Yes 8 8 1 1
R:R:L773 W:W:?1 6.26 10 Yes Yes 8 0 1 0
R:R:I777 W:W:?1 15.07 10 No Yes 8 0 1 0
R:R:T780 W:W:?1 11.12 0 No Yes 7 0 1 0
R:R:A784 R:R:F814 4.16 10 No Yes 8 9 2 1
R:R:A784 R:R:F815 4.16 10 No No 8 7 2 2
R:R:F814 R:R:F815 11.79 10 Yes No 9 7 1 2
R:R:F814 R:R:W818 9.02 10 Yes Yes 9 9 1 1
R:R:F814 W:W:?1 3.67 10 Yes Yes 9 0 1 0
R:R:W818 R:R:Y825 6.75 10 Yes Yes 9 9 1 1
R:R:A840 R:R:W818 7.78 0 No Yes 9 9 2 1
R:R:W818 W:W:?1 17.18 10 Yes Yes 9 0 1 0
R:R:F821 R:R:Y825 5.16 10 Yes Yes 9 9 2 1
R:R:F821 R:R:V836 3.93 10 Yes No 9 8 2 2
R:R:V836 R:R:Y825 6.31 10 No Yes 8 9 2 1
R:R:E837 R:R:Y825 7.86 10 Yes Yes 9 9 1 1
R:R:Y825 W:W:?1 7.07 10 Yes Yes 9 0 1 0
R:R:E837 W:W:?1 10.99 10 Yes Yes 9 0 1 0
R:R:E837 R:R:V833 2.85 10 Yes No 9 6 1 2
R:R:C661 R:R:F684 2.79 0 No Yes 7 8 2 1
R:R:L770 R:R:L773 2.77 0 No Yes 3 8 2 1
R:R:C781 R:R:I777 1.64 0 No No 7 8 2 1
StatisticsValue
Average Number Of Links9.00
Average Number Of Links With An Hub7.00
Average Interaction Strength11.99
Average Nodes In Shell25.00
Average Hubs In Shell10.00
Average Links In Shell36.00
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 🔍)

A 2D representation of the interactions of 9IG in 7SIL
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
S:S:F684 S:S:S664 3.96 13 Yes No 8 6 1 2
S:S:E837 S:S:F668 13.99 13 Yes No 9 9 1 2
S:S:F668 S:S:I841 3.77 0 No No 9 9 2 2
S:S:E767 S:S:Q681 6.37 0 No No 7 9 2 1
S:S:E837 S:S:Q681 3.82 13 Yes No 9 9 1 1
S:S:Q681 X:X:?1 19.07 13 No Yes 9 0 1 0
S:S:F684 S:S:F688 9.65 13 Yes Yes 8 8 1 2
S:S:F684 S:S:W818 9.02 13 Yes Yes 8 9 1 1
S:S:F684 S:S:I841 15.07 13 Yes No 8 9 1 2
S:S:F684 X:X:?1 17.45 13 Yes Yes 8 0 1 0
S:S:F688 S:S:F814 9.65 0 Yes Yes 8 9 2 1
S:S:T780 S:S:V689 4.76 0 No No 7 7 1 2
S:S:E767 S:S:L773 13.25 0 No No 7 8 2 1
S:S:L770 S:S:L773 4.15 0 No No 3 8 2 1
S:S:L773 X:X:?1 7.31 0 No Yes 8 0 1 0
S:S:I777 X:X:?1 15.07 0 No Yes 8 0 1 0
S:S:T780 X:X:?1 11.12 0 No Yes 7 0 1 0
S:S:A784 S:S:F814 4.16 13 No Yes 8 9 2 1
S:S:A784 S:S:F815 4.16 13 No No 8 7 2 2
S:S:F814 S:S:F815 10.72 13 Yes No 9 7 1 2
S:S:F814 S:S:W818 9.02 13 Yes Yes 9 9 1 1
S:S:F814 X:X:?1 3.67 13 Yes Yes 9 0 1 0
S:S:W818 S:S:Y825 6.75 13 Yes Yes 9 9 1 1
S:S:A840 S:S:W818 6.48 0 No Yes 9 9 2 1
S:S:W818 X:X:?1 16.32 13 Yes Yes 9 0 1 0
S:S:F821 S:S:Y825 4.13 13 Yes Yes 9 9 2 1
S:S:F821 S:S:V836 5.24 13 Yes No 9 8 2 2
S:S:A840 S:S:F821 4.16 0 No Yes 9 9 2 2
S:S:V836 S:S:Y825 7.57 13 No Yes 8 9 2 1
S:S:E837 S:S:Y825 17.96 13 Yes Yes 9 9 1 1
S:S:Y825 X:X:?1 6.19 13 Yes Yes 9 0 1 0
S:S:E837 X:X:?1 14.99 13 Yes Yes 9 0 1 0
S:S:C781 S:S:F814 2.79 0 No Yes 7 9 2 1
StatisticsValue
Average Number Of Links9.00
Average Number Of Links With An Hub5.00
Average Interaction Strength12.35
Average Nodes In Shell23.00
Average Hubs In Shell8.00
Average Links In Shell33.00
Average Links Mediated by Hubs In Shell27.00
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
9AXF C Ion Calcium-sensing CaS Homo Sapiens Ca Ca; Ca; Ca; Cyclomethyltryptophan; 9IG; PO4 chim(NtGi1-Gs-CtGq)/Beta1/Gamma2 3.5 2024-04-17 10.1038/s41586-024-07331-1

A 2D representation of the interactions of 9IG in 9AXF
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:F684 R:R:S664 5.28 3 Yes No 8 6 1 2
R:R:I841 R:R:S664 3.1 3 Yes No 9 6 1 2
R:R:I841 R:R:S665 4.64 3 Yes No 9 8 1 2
R:R:F668 R:R:R680 16.03 0 Yes Yes 9 8 2 2
R:R:E837 R:R:F668 15.16 3 Yes Yes 9 9 1 2
R:R:F668 R:R:I841 3.77 0 Yes Yes 9 9 2 1
R:R:Q681 R:R:R680 2.34 3 Yes Yes 9 8 1 2
R:R:P682 R:R:Q681 3.16 0 No Yes 5 9 2 1
R:R:Q681 R:R:W742 3.29 3 Yes Yes 9 9 1 2
R:R:E767 R:R:Q681 7.65 3 No Yes 7 9 2 1
R:R:L773 R:R:Q681 5.32 3 No Yes 8 9 2 1
R:R:E837 R:R:Q681 5.1 3 Yes Yes 9 9 1 1
R:R:Q681 W:W:?3 10.04 3 Yes Yes 9 0 1 0
R:R:F684 R:R:G685 1.51 3 Yes No 8 8 1 2
R:R:F684 R:R:F688 7.5 3 Yes Yes 8 8 1 2
R:R:F684 R:R:W818 2 3 Yes Yes 8 9 1 1
R:R:F684 R:R:I841 17.58 3 Yes Yes 8 9 1 1
R:R:F684 W:W:?3 11.94 3 Yes Yes 8 0 1 0
R:R:G685 R:R:Q735 1.64 0 No Yes 8 9 2 2
R:R:F688 R:R:I692 7.54 3 Yes Yes 8 7 2 2
R:R:F688 R:R:T780 2.59 3 Yes Yes 8 7 2 1
R:R:F688 R:R:F814 4.29 3 Yes Yes 8 9 2 2
R:R:A844 R:R:F688 2.77 3 Yes Yes 9 8 2 2
R:R:Q735 R:R:V689 7.16 3 Yes Yes 9 7 2 2
R:R:T780 R:R:V689 4.76 3 Yes Yes 7 7 1 2
R:R:I692 R:R:T780 1.52 3 Yes Yes 7 7 2 1
R:R:Q735 R:R:T780 2.83 3 Yes Yes 9 7 2 1
R:R:E767 R:R:W742 2.18 3 No Yes 7 9 2 2
R:R:L773 R:R:W742 3.42 3 No Yes 8 9 2 2
R:R:E767 R:R:L773 5.3 3 No No 7 8 2 2
R:R:G778 R:R:I777 1.76 0 No No 5 8 2 1
R:R:C781 R:R:I777 1.64 0 No No 7 8 2 1
R:R:I777 W:W:?3 6.46 0 No Yes 8 0 1 0
R:R:T780 W:W:?3 4.45 3 Yes Yes 7 0 1 0
R:R:I813 R:R:V817 1.54 3 Yes Yes 8 9 2 2
R:R:I813 R:R:W818 2.35 3 Yes Yes 8 9 2 1
R:R:A844 R:R:I813 1.62 3 Yes Yes 9 8 2 2
R:R:F814 R:R:W818 11.02 3 Yes Yes 9 9 2 1
R:R:V817 R:R:W818 2.45 3 Yes Yes 9 9 2 1
R:R:F821 R:R:V817 2.62 3 Yes Yes 9 9 1 2
R:R:A840 R:R:W818 2.59 3 No Yes 9 9 1 1
R:R:A844 R:R:W818 3.89 3 Yes Yes 9 9 2 1
R:R:W818 W:W:?3 15.46 3 Yes Yes 9 0 1 0
R:R:F821 R:R:S820 3.96 3 Yes No 9 7 1 2
R:R:S820 S:S:A824 1.71 3 No No 7 7 2 2
R:R:F821 R:R:V836 7.87 3 Yes No 9 8 1 2
R:R:F821 R:R:I839 3.77 3 Yes No 9 7 1 2
R:R:F821 S:S:A824 4.16 3 Yes No 9 7 1 2
R:R:F821 W:W:?3 1.84 3 Yes Yes 9 0 1 0
R:R:E837 R:R:Y825 11.22 3 Yes No 9 9 1 1
R:R:Y825 W:W:?3 13.26 3 No Yes 9 0 1 0
R:R:E837 W:W:?3 10.99 3 Yes Yes 9 0 1 0
R:R:A840 W:W:?3 2.38 3 No Yes 9 0 1 0
R:R:I841 R:R:S845 1.55 3 Yes No 9 8 1 2
R:R:I841 W:W:?3 2.15 3 Yes Yes 9 0 1 0
StatisticsValue
Average Number Of Links10.00
Average Number Of Links With An Hub7.00
Average Interaction Strength7.90
Average Nodes In Shell35.00
Average Hubs In Shell19.00
Average Links In Shell55.00
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 🔍)

A 2D representation of the interactions of 9IG in 9AXF
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
S:S:F684 S:S:S664 5.28 3 Yes No 8 6 1 2
S:S:I841 S:S:S665 3.1 3 Yes Yes 9 8 1 2
S:S:F668 S:S:R680 19.24 3 Yes Yes 9 8 2 2
S:S:F668 S:S:Q681 3.51 3 Yes Yes 9 9 2 1
S:S:E837 S:S:F668 11.66 3 Yes Yes 9 9 1 2
S:S:F668 S:S:I841 3.77 3 Yes Yes 9 9 2 1
S:S:Q681 S:S:R680 2.34 3 Yes Yes 9 8 1 2
S:S:P682 S:S:Q681 1.58 3 Yes Yes 5 9 2 1
S:S:Q681 S:S:W742 3.29 3 Yes Yes 9 9 1 2
S:S:L773 S:S:Q681 6.65 3 Yes Yes 8 9 1 1
S:S:E837 S:S:Q681 6.37 3 Yes Yes 9 9 1 1
S:S:Q681 X:X:?3 18.07 3 Yes Yes 9 0 1 0
S:S:P682 S:S:W742 4.05 3 Yes Yes 5 9 2 2
S:S:F684 S:S:G685 1.51 3 Yes No 8 8 1 1
S:S:F684 S:S:F688 11.79 3 Yes Yes 8 8 1 2
S:S:F684 S:S:W818 3.01 3 Yes Yes 8 9 1 1
S:S:F684 S:S:I841 11.3 3 Yes Yes 8 9 1 1
S:S:F684 X:X:?3 13.78 3 Yes Yes 8 0 1 0
S:S:G685 X:X:?3 2.58 3 No Yes 8 0 1 0
S:S:F688 S:S:I692 5.02 0 Yes Yes 8 7 2 2
S:S:F688 S:S:F814 9.65 0 Yes Yes 8 9 2 2
S:S:Q735 S:S:V689 7.16 3 Yes No 9 7 2 2
S:S:T780 S:S:V689 4.76 3 Yes No 7 7 1 2
S:S:I692 S:S:T780 1.52 0 Yes Yes 7 7 2 1
S:S:Q735 S:S:T780 2.83 3 Yes Yes 9 7 2 1
S:S:E767 S:S:W742 2.18 0 No Yes 7 9 1 2
S:S:L773 S:S:W742 6.83 3 Yes Yes 8 9 1 2
S:S:E767 X:X:?3 2 0 No Yes 7 0 1 0
S:S:I777 S:S:L773 4.28 3 No Yes 8 8 1 1
S:S:L773 X:X:?3 8.35 3 Yes Yes 8 0 1 0
S:S:C781 S:S:I777 1.64 0 No No 7 8 2 1
S:S:I777 X:X:?3 7.54 3 No Yes 8 0 1 0
S:S:F814 S:S:T780 2.59 3 Yes Yes 9 7 2 1
S:S:T780 X:X:?3 4.45 3 Yes Yes 7 0 1 0
S:S:C781 S:S:F814 2.79 0 No Yes 7 9 2 2
S:S:F814 S:S:W818 11.02 3 Yes Yes 9 9 2 1
S:S:V817 S:S:W818 6.13 3 Yes Yes 9 9 2 1
S:S:A840 S:S:V817 1.7 3 No Yes 9 9 2 2
S:S:F821 S:S:W818 12.03 3 Yes Yes 9 9 1 1
S:S:A840 S:S:W818 5.19 3 No Yes 9 9 2 1
S:S:W818 X:X:?3 20.62 3 Yes Yes 9 0 1 0
S:S:F821 S:S:Y825 10.32 3 Yes Yes 9 9 1 1
S:S:F821 S:S:V836 2.62 3 Yes Yes 9 8 1 2
S:S:E837 S:S:F821 4.66 3 Yes Yes 9 9 1 1
S:S:F821 X:X:?3 3.67 3 Yes Yes 9 0 1 0
S:S:V836 S:S:Y825 2.52 3 Yes Yes 8 9 2 1
S:S:E837 S:S:Y825 7.86 3 Yes Yes 9 9 1 1
S:S:Y825 X:X:?3 8.84 3 Yes Yes 9 0 1 0
S:S:E837 X:X:?3 10.99 3 Yes Yes 9 0 1 0
S:S:I841 S:S:S845 1.55 3 Yes No 9 8 1 2
S:S:I841 X:X:?3 2.15 3 Yes Yes 9 0 1 0
StatisticsValue
Average Number Of Links12.00
Average Number Of Links With An Hub9.00
Average Interaction Strength8.59
Average Nodes In Shell29.00
Average Hubs In Shell21.00
Average Links In Shell51.00
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
9AYF C Ion Calcium-sensing CaS Homo Sapiens Ca Ca; Ca; Ca; Cyclomethyltryptophan; 9IG; PO4 Gi1/Beta1/Gamma2 3.6 2024-04-17 10.1038/s41586-024-07331-1

A 2D representation of the interactions of 9IG in 9AYF
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
S:S:F684 S:S:S664 5.28 3 Yes No 8 6 1 2
S:S:I841 S:S:S665 1.55 3 Yes Yes 9 8 1 2
S:S:F668 S:S:R680 16.03 3 Yes Yes 9 8 2 2
S:S:F668 S:S:Q681 5.86 3 Yes Yes 9 9 2 1
S:S:E837 S:S:F668 16.32 3 Yes Yes 9 9 1 2
S:S:F668 S:S:I841 3.77 3 Yes Yes 9 9 2 1
S:S:Q681 S:S:R680 2.34 3 Yes Yes 9 8 1 2
S:S:P682 S:S:Q681 1.58 3 Yes Yes 5 9 2 1
S:S:Q681 S:S:W742 3.29 3 Yes Yes 9 9 1 2
S:S:E767 S:S:Q681 2.55 3 Yes Yes 7 9 1 1
S:S:L773 S:S:Q681 7.99 3 Yes Yes 8 9 1 1
S:S:E837 S:S:Q681 2.55 3 Yes Yes 9 9 1 1
S:S:Q681 X:X:?3 13.05 3 Yes Yes 9 0 1 0
S:S:C739 S:S:P682 5.65 3 Yes Yes 7 5 2 2
S:S:P682 S:S:W742 4.05 3 Yes Yes 5 9 2 2
S:S:F684 S:S:G685 3.01 3 Yes No 8 8 1 2
S:S:F684 S:S:F688 7.5 3 Yes Yes 8 8 1 2
S:S:F684 S:S:W818 4.01 3 Yes Yes 8 9 1 1
S:S:F684 S:S:I841 16.33 3 Yes Yes 8 9 1 1
S:S:F684 X:X:?3 14.7 3 Yes Yes 8 0 1 0
S:S:G685 S:S:Q735 1.64 3 No Yes 8 9 2 2
S:S:G685 S:S:L776 1.71 3 No Yes 8 8 2 1
S:S:F688 S:S:I692 5.02 0 Yes No 8 7 2 2
S:S:F688 S:S:F814 6.43 0 Yes Yes 8 9 2 2
S:S:Q735 S:S:V689 10.03 3 Yes Yes 9 7 2 2
S:S:T780 S:S:V689 4.76 0 No Yes 7 7 1 2
S:S:I692 S:S:T780 1.52 0 No No 7 7 2 1
S:S:C739 S:S:Q735 1.53 3 Yes Yes 7 9 2 2
S:S:L776 S:S:Q735 6.65 3 Yes Yes 8 9 1 2
S:S:C739 S:S:L776 1.59 3 Yes Yes 7 8 2 1
S:S:E767 S:S:W742 2.18 3 Yes Yes 7 9 1 2
S:S:L773 S:S:W742 3.42 3 Yes Yes 8 9 1 2
S:S:E767 S:S:L773 3.98 3 Yes Yes 7 8 1 1
S:S:E767 X:X:?3 8.99 3 Yes Yes 7 0 1 0
S:S:L770 X:X:?3 2.09 0 No Yes 3 0 1 0
S:S:G774 S:S:L773 1.71 0 No Yes 4 8 2 1
S:S:L773 X:X:?3 8.35 3 Yes Yes 8 0 1 0
S:S:L776 X:X:?3 3.13 3 Yes Yes 8 0 1 0
S:S:G778 S:S:I777 1.76 0 No No 5 8 2 1
S:S:C781 S:S:I777 1.64 0 No No 7 8 2 1
S:S:I777 X:X:?3 11.84 0 No Yes 8 0 1 0
S:S:T780 X:X:?3 4.45 0 No Yes 7 0 1 0
S:S:C781 S:S:F814 2.79 0 No Yes 7 9 2 2
S:S:F814 S:S:W818 13.03 0 Yes Yes 9 9 2 1
S:S:V817 S:S:W818 3.68 3 Yes Yes 9 9 2 1
S:S:A840 S:S:V817 1.7 3 No Yes 9 9 2 2
S:S:F821 S:S:W818 10.02 3 Yes Yes 9 9 1 1
S:S:A840 S:S:W818 3.89 3 No Yes 9 9 2 1
S:S:W818 X:X:?3 15.46 3 Yes Yes 9 0 1 0
S:S:F821 S:S:Y825 8.25 3 Yes Yes 9 9 1 1
S:S:F821 S:S:V836 2.62 3 Yes Yes 9 8 1 2
S:S:A840 S:S:F821 2.77 3 No Yes 9 9 2 1
S:S:F821 X:X:?3 3.67 3 Yes Yes 9 0 1 0
S:S:V833 S:S:Y825 2.52 0 No Yes 6 9 2 1
S:S:V836 S:S:Y825 2.52 3 Yes Yes 8 9 2 1
S:S:E837 S:S:Y825 2.24 3 Yes Yes 9 9 1 1
S:S:Y825 X:X:?3 15.03 3 Yes Yes 9 0 1 0
S:S:E837 X:X:?3 5 3 Yes Yes 9 0 1 0
S:S:I841 S:S:S845 1.55 3 Yes No 9 8 1 2
S:S:I841 X:X:?3 2.15 3 Yes Yes 9 0 1 0
StatisticsValue
Average Number Of Links13.00
Average Number Of Links With An Hub10.00
Average Interaction Strength8.30
Average Nodes In Shell35.00
Average Hubs In Shell23.00
Average Links In Shell60.00
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 🔍)

A 2D representation of the interactions of 9IG in 9AYF
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:F684 R:R:S664 3.96 5 Yes No 8 6 1 2
R:R:I841 R:R:S665 3.1 5 Yes Yes 9 8 1 2
R:R:F668 R:R:R680 11.76 0 No Yes 9 8 2 2
R:R:E837 R:R:F668 8.16 5 No No 9 9 1 2
R:R:F668 R:R:I841 2.51 0 No Yes 9 9 2 1
R:R:Q681 R:R:R680 2.34 5 Yes Yes 9 8 1 2
R:R:P682 R:R:Q681 3.16 0 No Yes 5 9 2 1
R:R:Q681 R:R:W742 5.48 5 Yes Yes 9 9 1 2
R:R:E767 R:R:Q681 5.1 0 No Yes 7 9 2 1
R:R:L773 R:R:Q681 3.99 5 Yes Yes 8 9 1 1
R:R:Q681 W:W:?3 10.04 5 Yes Yes 9 0 1 0
R:R:F684 R:R:G685 1.51 5 Yes No 8 8 1 1
R:R:F684 R:R:F688 5.36 5 Yes Yes 8 8 1 2
R:R:F684 R:R:I841 18.84 5 Yes Yes 8 9 1 1
R:R:F684 W:W:?3 11.94 5 Yes Yes 8 0 1 0
R:R:G685 R:R:Q735 1.64 5 No Yes 8 9 1 2
R:R:G685 W:W:?3 2.58 5 No Yes 8 0 1 0
R:R:F688 R:R:F814 6.43 0 Yes Yes 8 9 2 1
R:R:Q735 R:R:V689 7.16 5 Yes Yes 9 7 2 2
R:R:T780 R:R:V689 1.59 0 No Yes 7 7 1 2
R:R:L776 R:R:Q735 7.99 0 Yes Yes 8 9 1 2
R:R:I738 R:R:L776 2.85 0 No Yes 8 8 2 1
R:R:L776 R:R:W742 3.42 0 Yes Yes 8 9 1 2
R:R:G774 R:R:L773 1.71 0 No Yes 4 8 2 1
R:R:I777 R:R:L773 4.28 5 Yes Yes 8 8 1 1
R:R:L773 W:W:?3 3.13 5 Yes Yes 8 0 1 0
R:R:L776 W:W:?3 3.13 0 Yes Yes 8 0 1 0
R:R:G778 R:R:I777 1.76 5 No Yes 5 8 2 1
R:R:C781 R:R:I777 1.64 5 No Yes 7 8 2 1
R:R:I777 W:W:?3 16.15 5 Yes Yes 8 0 1 0
R:R:C781 R:R:G778 1.96 5 No No 7 5 2 2
R:R:T780 W:W:?3 6.67 0 No Yes 7 0 1 0
R:R:F814 R:R:F815 8.57 5 Yes No 9 7 1 2
R:R:F814 R:R:W818 11.02 5 Yes No 9 9 1 1
R:R:F814 W:W:?3 1.84 5 Yes Yes 9 0 1 0
R:R:A840 R:R:W818 7.78 0 No No 9 9 2 1
R:R:W818 W:W:?3 21.48 5 No Yes 9 0 1 0
R:R:V833 R:R:Y825 2.52 0 No No 6 9 2 1
R:R:E837 R:R:Y825 5.61 5 No No 9 9 1 1
R:R:Y825 W:W:?3 9.73 5 No Yes 9 0 1 0
R:R:E837 W:W:?3 11.99 5 No Yes 9 0 1 0
R:R:I841 R:R:S845 1.55 5 Yes No 9 8 1 2
R:R:I841 W:W:?3 2.15 5 Yes Yes 9 0 1 0
StatisticsValue
Average Number Of Links12.00
Average Number Of Links With An Hub7.00
Average Interaction Strength8.40
Average Nodes In Shell31.00
Average Hubs In Shell14.00
Average Links In Shell43.00
Average Links Mediated by Hubs In Shell38.00
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 Links10.83
Average Number Of Links With An Hub7.50
Average Interaction Strength9.59
Average Nodes In Shell29.67
Average Hubs In Shell15.83
Average Links In Shell46.33
Average Links Mediated by Hubs In Shell42.50

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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 🔍)