Color ConSurf Grade
      No Conservation data available
      1
      2
      3
      4
      5
      6
      7
      8
      9

Index: hub id, click on each number to highlight the corresponding hub in the 3D visualization.

Hub: the hub being considered.

Avg Int. Strength: the average interaction strength of all the links of the corresponding hub.

Num Of Links: the number of links of the corresponding hub.

Community: the id of the community the link belong to, otherwise 0.

ConSurf: this column reports the ConSurf conservation grades of each hub.

Index Hub Avg Int. Strength Num Of Links Community ConSurf
1R:R:V39 4.61566
2R:R:L50 4.52167665
3R:R:P51 3.4775405
4R:R:L57 3.765467
5R:R:I60 4.1145174
6R:R:I67 4.155665
7R:R:H70 4.625454
8R:R:F72 4.62167669
9R:R:I78 4.555467
10R:R:I81 5.09468
11R:R:Y82 10.2375414
12R:R:I85 3.7125406
13R:R:Q91 6.23453
14R:R:H95 8.1125455
15R:R:F97 5.26833669
16R:R:Y98 8.652552
17R:R:L100 4.3525468
18R:R:H105 8.976517
19R:R:R109 10.832515
20R:R:N110 6.146516
21R:R:L114 4.68428
22R:R:Y116 5.4025453
23R:R:D118 7.8875455
24R:R:F130 7.75333616
25R:R:F134 7.955615
26R:R:N135 5.6025418
27R:R:T136 5.31833629
28R:R:L138 5428
29R:R:F141 5.95167627
30R:R:K146 6.612554
31R:R:F153 11.2825405
32R:R:F154 5.93626
33R:R:L156 4.3725427
34R:R:E157 8.34167618
35R:R:T159 6.25415
36R:R:D160 5.566518
37R:R:M164 4.88527
38R:R:N170 10.1654108
39R:R:F172 5.99833628
40R:R:Q173 8.464102
41R:R:L175 6.752527
42R:R:E178 8425
43R:R:L180 3.725427
44R:R:L182 5.82526
45R:R:K183 6.7725416
46R:R:Y185 8.035417
47R:R:N187 6.512529
48R:R:F189 8.474528
49R:R:Y195 5.40254104
50R:R:F197 6.695409
51R:R:N198 9.7865107
52R:R:T200 5.11428
53R:R:L202 5.302528
54R:R:V205 3.742527
55R:R:Y206 4.804516
56R:R:N208 6.816515
57R:R:K209 4.49833607
58R:R:F221 6.8275429
59R:R:P228 4.998528
60R:R:L230 6.062514
61R:R:D232 10.4775419
62R:R:V233 3.094197
63R:R:S234 4.3475419
64R:R:L241 3.7865199
65R:R:L246 4.2675427
66R:R:I253 6.778514
67R:R:R255 4.8425414
68R:R:P264 4.47509
69R:R:F269 4.5454157
70R:R:R274 9.135413
71R:R:Y279 7.4685129
72R:R:F286 4.566676158
73R:R:F405 7.7225438
74R:R:E409 8.234209
75R:R:I411 4.392588
76R:R:Y414 5.86254224
77R:R:V421 4.3175409
78R:R:L429 3.15407
79R:R:V435 3.954579
80R:R:I438 5.835478
81R:R:L439 4.0625478
82R:R:V448 4.056549
83R:R:R450 5.61409
84R:R:F451 5.478549
85R:R:L456 5.94833649
86R:R:D460 6.378549
87R:R:M463 5.378539
88R:R:Y466 6.034539
89R:R:L467 3.734539
90R:R:Y481 5.53667688
91R:R:Y482 5.2925408
92R:R:I486 6.624128
93R:R:W488 6.366589
94R:R:T501 4.45509
95R:R:V502 3.786539
96R:R:E506 6.012538
97R:R:L507 5.6725409
98R:R:T511 3.725449
99R:R:W520 5.17407
100R:R:M542 4.834549
101R:R:W546 6.484549
102R:R:Y563 9.026539
103R:R:I568 5.07439
104R:R:L570 6.074539
105R:R:M572 7.37439
106R:R:Y582 5.35167639
107R:R:V586 5.1025437
108R:R:F594 7.875408
109R:R:Y601 6.72667649
110R:R:D633 5.2875408
111R:R:Y643 7.9475408
112R:R:I648 2.584536
113R:R:L663 5.1675439
114R:R:Y667 5.63167639
115R:R:P668 4.69439
116R:R:N674 7.965449
117R:R:Y678 4.97143749
118R:R:F685 5.58667679
119R:R:V689 3.15475
120N:N:F42 8.835116
121N:N:M53 6.97754244
122N:N:F57 5.3775497
123N:N:R59 10.882598
124N:N:Y61 9.874598
125N:N:S79 4.18419
126N:N:C84 4.4854139
127N:N:C108 5.3954139
128N:N:Y112 8.45415
129N:N:Y113 5.4725404
130N:N:H114 5.656518
131N:N:K115 6.415419
132L:L:Y27 5.528596
133L:L:M29 4.3407
134L:L:H30 6.734286
135L:L:I42 4.3854277
136L:L:N57 6.5475407
137L:L:L62 3.51754113
138L:L:Y65 8.85514
139L:L:V71 6.115416
140L:L:Y74 5.832508
141L:L:F77 8.30254144
142L:L:Y79 11.7254148
143L:L:I84 3.62754296
144L:L:C87 4.864299
145L:L:Y97 7.215276
146L:L:V99 5.24408
147L:L:C108 5.075419
148L:L:D114 6.2175419
149L:L:C115 5.4025419
150L:L:I116 4.985417
151L:L:I120 5.24254173
152W:W:?1 6.967141430
153H:H:?1 12.9785100
154H:H:?5 7.8745260
   

Color ConSurf Grade
      No Conservation data available
      1
      2
      3
      4
      5
      6
      7
      8
      9

Index: link id, click on each number to highlight the corresponding link in the 3D visualization.

Node1 Node2: the two nodes of the corresponding link.

Recurrence: the relative Recurrence in the pool of shortest paths.

Int. Strength: the interaction strength between the two nodes.

Hub1?, Hub2?: "Yes" if the corresponding node has more than 3 links, otherwise "No".

Community: the id of the community the link belong to, otherwise 0.

ConSurf1, ConSurf2: these columns report the ConSurf conservation grades of the two nodes involved in a link.

Index Node1 Node2 Recurrence Int. Strength Hub1? Hub2? Community ConSurf1 ConSurf2
1R:R:C176 R:R:F154 99.96378.38NoYes266
2R:R:C176 R:R:E178 1003.04NoYes265
3R:R:E178 R:R:I152 98.86339.56YesNo053
4R:R:F153 R:R:I152 98.73615.02YesNo053
5N:N:Y113 R:R:F153 67.8144.13YesYes045
6N:N:Y112 N:N:Y113 46.92873.97YesYes054
7N:N:Y112 R:R:F130 40.557312.38YesYes156
8R:R:F130 R:R:F134 27.20283.22YesYes165
9R:R:F134 R:R:R109 26.613114.97YesYes155
10L:L:I116 R:R:R109 17.31145.01YesYes175
11R:R:E157 R:R:F130 13.6764.66YesYes186
12L:L:K64 R:R:F153 31.564322.33NoYes055
13L:L:K64 R:R:D203 23.326320.74NoNo1856
14R:R:D203 R:R:T181 25.13684.34NoNo067
15R:R:L156 R:R:L182 50.13474.15YesYes276
16R:R:L180 R:R:L182 50.05284.15YesYes276
17R:R:K183 R:R:T181 24.15093YesNo067
18N:N:C111 N:N:H114 10.13065.9NoYes198
19L:L:Q69 N:N:Y113 22.76536.76NoYes094
20R:R:L182 R:R:V205 95.24154.47YesYes267
21R:R:K183 R:R:Y206 17.33.58YesYes166
22R:R:N208 R:R:Y185 12.80145.81YesYes157
23R:R:K209 R:R:N208 13.826.99YesYes075
24R:R:L231 R:R:V205 94.42732.98NoYes077
25L:L:D111 R:R:K209 18.2725.53NoYes067
26R:R:L231 R:R:V233 94.86124.47NoYes077
27R:R:L241 R:R:V233 94.41792.98YesYes1997
28R:R:L241 R:R:P264 50.63933.28YesYes099
29R:R:L263 R:R:P264 48.10783.28NoYes089
30R:R:H282 R:R:L263 46.79866.43NoNo098
31R:R:H282 R:R:Y279 93.02086.53NoYes099
32R:R:L241 R:R:L252 46.88792.77YesNo099
33R:R:L252 R:R:L277 46.79942.77NoNo099
34R:R:H282 R:R:L277 46.44023.86NoNo099
35R:R:I486 R:R:Y279 91.39513.3YesYes1289
36R:R:A485 R:R:I281 90.61433.25NoNo099
37R:R:I281 R:R:I486 90.83362.94NoYes098
38L:L:N57 N:N:H103 12.859214.03YesNo079
39L:L:D55 N:N:H103 13.2997.56NoNo079
40L:L:D55 N:N:C52 13.51863.11NoNo079
41N:N:C52 N:N:C84 14.17635.46NoYes099
42L:L:T53 N:N:C84 15.26873.38NoYes099
43L:L:T53 N:N:C83 15.48666.76NoNo099
44L:L:Q69 N:N:C83 13.990112.21NoNo199
45R:R:A485 R:R:Y481 90.39486.67NoYes098
46R:R:S567 R:R:Y481 19.165.09NoYes898
47R:R:K660 R:R:S567 18.95983.06NoNo099
48R:R:I568 R:R:K660 16.38814.36YesNo099
49R:R:I568 R:R:L570 13.12575.71YesYes399
50R:R:L570 W:W:?1 11.541813.32YesYes390
51R:R:I411 R:R:Y481 67.43977.25YesYes888
52R:R:I411 R:R:I470 63.30032.94YesNo088
53R:R:I470 R:R:Y466 63.07668.46NoYes089
54R:R:M463 R:R:Y466 50.19423.59YesYes399
55R:R:M463 R:R:S671 50.23956.13YesNo099
56R:R:D460 R:R:S671 49.73034.42YesNo099
57R:R:D460 R:R:L456 24.74945.43YesYes499
58R:R:D460 R:R:N674 15.57249.42YesYes499
59R:R:L456 R:R:Y678 10.72583.52YesYes499
60R:R:N674 R:R:Y678 10.38044.65YesYes499
61R:R:Y601 R:R:Y678 17.23632.98YesYes499
62R:R:T516 R:R:Y601 11.708412.48NoYes099
63R:R:C600 R:R:T516 11.17783.38NoNo099
64N:N:T78 N:N:Y61 14.458214.98NoYes098
65L:L:I116 N:N:T78 14.68266.08YesNo079
66L:L:Y27 N:N:Y61 11.46752.98YesYes968
67L:L:N109 L:L:Y112 16.406315.12NoNo055
68L:L:D111 L:L:N109 17.338412.12NoNo065
69R:R:F154 R:R:L156 46.8373.65YesYes267
70R:R:F154 R:R:L180 50.80133.65YesYes267
Download PSN data

2D representation of the global metapath, ligand(s) interactions and
histograms of path distribution according to several parameters
(click on the image to enlarge it 🔍):

A 2D representation of the global communication in the network.

ConSurf Conservation Grade (See documentation): 

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

Number of shortest communication paths as a function of the average residue correlation.

Number of shortest communication paths as a function of the average interaction strength of their links.

Number of shortest communication paths as a function of the % of hub nodes in each path.

Number of shortest communication paths as a function of the number of nodes in each path.

Number of shortest communication paths as a function of the % of correlated nodes in each path.


2D representation of the interactions of this orthosteric/allosteric ligand.


Links and nodes colored according to ConSurf Conservation Grade (See documentation): 

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

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
R:R:E35 R:R:R38 4.65 0 No No 1 4 2 1
R:R:R38 R:R:T56 6.47 0 No No 4 5 1 2
L:L:E118 R:R:R38 10.47 0 No No 5 4 0 1
L:L:Y124 R:R:K42 4.78 0 No No 4 2 0 1
R:R:R80 R:R:T56 7.76 1 No No 4 5 2 2
R:R:I60 R:R:K58 4.36 17 Yes No 4 5 1 2
R:R:K58 R:R:Y82 9.55 0 No Yes 5 4 2 2
R:R:I60 R:R:S84 3.1 17 Yes No 4 7 1 1
L:L:I120 R:R:I60 8.83 17 Yes Yes 3 4 0 1
N:N:R66 R:R:E61 3.49 0 No No 6 5 0 1
R:R:R80 R:R:Y82 8.23 1 No Yes 4 4 2 2
R:R:H105 R:R:R80 3.39 1 Yes No 7 4 1 2
R:R:H105 R:R:Y82 13.07 1 Yes Yes 7 4 1 2
R:R:E107 R:R:Y82 10.1 1 No Yes 6 4 2 2
L:L:I120 R:R:S84 4.64 17 Yes No 3 7 0 1
R:R:I85 R:R:N110 4.25 0 Yes Yes 6 6 1 1
N:N:S67 R:R:I85 3.1 0 No Yes 7 6 0 1
N:N:T70 R:R:I85 4.56 0 No Yes 9 6 0 1
L:L:I120 R:R:I85 2.94 17 Yes Yes 3 6 0 1
N:N:T70 R:R:V87 3.17 0 No No 9 4 0 1
R:R:F130 R:R:H105 16.97 1 Yes Yes 6 7 1 1
N:N:Y112 R:R:H105 8.71 1 Yes Yes 5 7 0 1
R:R:E107 R:R:R109 18.61 1 No Yes 6 5 2 1
R:R:E107 R:R:F134 7 1 No Yes 6 5 2 2
R:R:N110 R:R:R109 7.23 1 Yes Yes 6 5 1 1
R:R:F134 R:R:R109 14.97 1 Yes Yes 5 5 2 1
L:L:D114 R:R:R109 8.34 1 Yes Yes 9 5 0 1
L:L:I116 R:R:R109 5.01 1 Yes Yes 7 5 0 1
R:R:N110 R:R:N135 5.45 1 Yes Yes 6 8 1 1
N:N:M71 R:R:N110 8.41 1 No Yes 9 6 0 1
L:L:D114 R:R:N110 5.39 1 Yes Yes 9 6 0 1
N:N:L72 R:R:R112 7.29 1 No No 3 6 0 1
R:R:F130 R:R:G132 3.01 1 Yes No 6 5 1 2
R:R:F130 R:R:F134 3.22 1 Yes Yes 6 5 1 2
R:R:F130 R:R:I155 6.28 1 Yes No 6 5 1 2
R:R:E157 R:R:F130 4.66 1 Yes Yes 8 6 1 1
N:N:Y112 R:R:F130 12.38 1 Yes Yes 5 6 0 1
R:R:F134 R:R:G132 4.52 1 Yes No 5 5 2 2
R:R:E157 R:R:F134 12.83 1 Yes Yes 8 5 1 2
R:R:F134 R:R:T159 5.19 1 Yes Yes 5 5 2 2
R:R:D160 R:R:N135 4.04 1 Yes Yes 8 8 1 1
N:N:M71 R:R:N135 7.01 1 No Yes 9 8 0 1
N:N:V73 R:R:N135 5.91 1 No Yes 7 8 0 1
R:R:F153 R:R:I152 5.02 0 Yes No 5 3 1 2
N:N:Y113 R:R:F153 4.13 0 Yes Yes 4 5 0 1
L:L:K59 R:R:F153 13.65 0 No Yes 5 5 0 1
L:L:K64 R:R:F153 22.33 18 No Yes 5 5 0 1
R:R:I155 R:R:T181 4.56 0 No No 5 7 2 2
R:R:E157 R:R:T159 4.23 1 Yes Yes 8 5 1 2
R:R:E157 R:R:K183 12.15 1 Yes Yes 8 6 1 2
R:R:E157 R:R:Y185 6.73 1 Yes Yes 8 7 1 2
N:N:K115 R:R:E157 9.45 1 Yes Yes 9 8 0 1
R:R:D160 R:R:T159 4.34 1 Yes Yes 8 5 1 2
R:R:T159 R:R:Y185 11.24 1 Yes Yes 5 7 2 2
R:R:D160 R:R:N186 5.39 1 Yes No 8 7 1 2
N:N:V73 R:R:D160 4.38 1 No Yes 7 8 0 1
N:N:K75 R:R:D160 9.68 0 No Yes 9 8 0 1
R:R:P162 R:R:Y163 6.95 1 No No 7 4 1 1
N:N:L72 R:R:P162 8.21 1 No No 3 7 0 1
N:N:V73 R:R:P162 5.3 1 No No 7 7 0 1
N:N:L72 R:R:Y163 5.86 1 No No 3 4 0 1
R:R:K201 R:R:T179 3 0 No No 4 5 2 1
R:R:D203 R:R:T179 14.45 18 No No 6 5 1 1
L:L:K64 R:R:T179 4.5 18 No No 5 5 0 1
R:R:K183 R:R:T181 3 1 Yes No 6 7 2 2
R:R:D203 R:R:T181 4.34 18 No No 6 7 1 2
R:R:K183 R:R:Y185 8.36 1 Yes Yes 6 7 2 2
R:R:K183 R:R:Y206 3.58 1 Yes Yes 6 6 2 2
R:R:N208 R:R:Y185 5.81 1 Yes Yes 5 7 2 2
R:R:K209 R:R:N186 4.2 0 Yes No 7 7 1 2
L:L:K64 R:R:D203 20.74 18 No No 5 6 0 1
R:R:A204 R:R:Y206 5.34 1 No Yes 5 6 1 2
R:R:A204 R:R:L230 3.15 1 No Yes 5 4 1 1
L:L:Y65 R:R:A204 4 1 Yes No 4 5 0 1
R:R:N208 R:R:Y206 3.49 1 Yes Yes 5 6 2 2
R:R:L230 R:R:Y206 5.86 1 Yes Yes 4 6 1 2
R:R:K209 R:R:N208 6.99 0 Yes Yes 7 5 1 2
N:N:S116 R:R:K209 3.06 0 No Yes 9 7 0 1
L:L:T110 R:R:K209 4.5 0 No Yes 7 7 0 1
L:L:D111 R:R:K209 5.53 0 No Yes 6 7 0 1
R:R:E251 R:R:L230 5.3 1 No Yes 5 4 1 1
R:R:I253 R:R:L230 4.28 1 Yes Yes 4 4 2 1
L:L:Y65 R:R:L230 11.72 1 Yes Yes 4 4 0 1
R:R:E251 R:R:R274 12.79 1 No Yes 5 3 1 2
L:L:Y65 R:R:E251 13.47 1 Yes No 4 5 0 1
R:R:I253 R:R:R274 6.26 1 Yes Yes 4 3 2 2
N:N:F42 R:R:S383 5.28 11 Yes No 6 4 0 1
L:L:I56 R:R:S383 4.64 11 No No 5 4 0 1
L:L:L62 R:R:S383 3 11 Yes No 3 4 0 1
N:N:F41 R:R:H384 5.66 0 No No 1 3 0 1
R:R:D386 R:R:Y385 4.6 0 No No 5 4 1 2
L:L:L62 R:R:D386 5.43 11 Yes No 3 5 0 1
N:N:F41 R:R:Y387 16.5 0 No No 1 4 0 1
N:N:F98 R:R:Y387 7.22 0 No No 3 4 0 1
L:L:F61 R:R:Y387 29.91 11 No No 3 4 0 1
N:N:F41 R:R:T388 7.78 0 No No 1 4 0 1
H:H:?5 N:N:P48 4.42 26 Yes No 0 6 1 0
H:H:?5 N:N:I49 3.84 26 Yes No 0 5 1 0
H:H:?5 N:N:L50 3.73 26 Yes No 0 5 1 0
H:H:?6 N:N:N76 25.87 14 No No 0 9 1 0
H:H:?5 N:N:N102 23.41 26 Yes No 0 9 1 0
H:H:?5 N:N:T104 3.97 26 Yes No 0 9 1 0
H:H:?7 L:L:E26 10.7 0 No No 0 9 1 0
H:H:?7 L:L:N43 33.27 0 No No 0 8 1 0
H:H:?6 L:L:Y79 30.5 14 No Yes 0 8 1 0
H:H:?6 L:L:Y112 3.16 14 No No 0 5 1 0
R:R:I60 R:R:K42 2.91 17 Yes No 4 2 1 1
R:R:H105 R:R:T104 2.74 1 Yes No 7 5 1 2
R:R:K209 R:R:Q235 2.71 0 Yes No 7 4 1 2
L:L:Y65 R:R:S229 2.54 1 Yes No 4 5 0 1
R:R:T88 R:R:V87 1.59 0 No No 4 4 2 1
R:R:E61 R:R:I60 1.37 0 No Yes 5 4 1 1
L:L:L62 R:R:D382 1.36 11 Yes No 3 4 0 1
R:R:K139 R:R:Y163 1.19 0 No No 4 4 2 1

Location and physicochemical properties of the interaction partners of this ligand

Interactions of this ligand

Similarities between the interactions of this ligand and those of other networks

2D representation of the interactions of this orthosteric/allosteric ligand.


Links and nodes colored according to ConSurf Conservation Grade (See documentation): 

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

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
R:R:D403 R:R:F405 8.36 0 No Yes 8 8 2 1
R:R:F405 R:R:K565 14.89 3 Yes No 8 7 1 2
R:R:F405 R:R:M572 3.73 3 Yes Yes 8 9 1 1
R:R:F405 W:W:?1 3.91 3 Yes Yes 8 0 1 0
R:R:T501 R:R:V502 3.17 0 Yes Yes 9 9 2 2
R:R:L570 R:R:T501 2.95 3 Yes Yes 9 9 1 2
R:R:T501 R:R:Y667 3.75 0 Yes Yes 9 9 2 2
R:R:V502 R:R:Y563 5.05 3 Yes Yes 9 9 2 2
R:R:P571 R:R:V502 3.53 3 No Yes 9 9 1 2
R:R:V502 R:R:Y582 3.79 3 Yes Yes 9 9 2 2
R:R:E506 R:R:L552 3.98 3 Yes No 8 7 2 2
R:R:E506 R:R:V586 8.56 3 Yes Yes 8 7 2 1
R:R:L552 R:R:V586 2.98 3 No Yes 7 7 2 1
R:R:P571 R:R:Y563 8.34 3 No Yes 9 9 1 2
R:R:I568 R:R:V566 3.07 3 Yes No 9 9 2 2
R:R:M572 R:R:V566 6.09 3 Yes No 9 9 1 2
R:R:I568 R:R:L570 5.71 3 Yes Yes 9 9 2 1
R:R:I568 R:R:L663 7.14 3 Yes Yes 9 9 2 2
R:R:L570 R:R:M572 4.24 3 Yes Yes 9 9 1 1
R:R:L570 R:R:L663 4.15 3 Yes Yes 9 9 1 2
R:R:L570 W:W:?1 13.32 3 Yes Yes 9 0 1 0
R:R:P571 W:W:?1 8.43 3 No Yes 9 0 1 0
R:R:M572 W:W:?1 15.42 3 Yes Yes 9 0 1 0
R:R:V586 R:R:Y582 5.05 3 Yes Yes 7 9 1 2
R:R:I583 R:R:I648 2.94 3 No Yes 7 6 1 1
R:R:I583 W:W:?1 7.33 3 No Yes 7 0 1 0
R:R:V586 W:W:?1 3.82 3 Yes Yes 7 0 1 0
R:R:A644 R:R:L587 4.73 3 No No 9 8 1 1
R:R:L587 W:W:?1 7.99 3 No Yes 8 0 1 0
R:R:I640 R:R:Y667 3.63 0 No Yes 9 9 1 2
R:R:I640 W:W:?1 7.33 0 No Yes 9 0 1 0
R:R:L662 R:R:Y643 5.86 0 No Yes 8 8 1 2
R:R:A644 W:W:?1 5.05 3 No Yes 9 0 1 0
R:R:A647 W:W:?1 6.07 0 No Yes 9 0 1 0
R:R:I648 W:W:?1 5.49 3 Yes Yes 6 0 1 0
R:R:P652 W:W:?1 3.16 0 No Yes 9 0 1 0
R:R:S659 R:R:V656 3.23 0 No No 9 7 1 2
R:R:S659 W:W:?1 5.78 0 No Yes 9 0 1 0
R:R:L662 W:W:?1 4.44 0 No Yes 8 0 1 0
R:R:L663 R:R:Y667 3.52 3 Yes Yes 9 9 2 2
R:R:L587 R:R:L645 2.77 3 No No 8 7 1 2
R:R:I648 R:R:V584 1.54 3 Yes No 6 5 1 2
R:R:I583 R:R:T574 1.52 3 No No 7 6 1 2
R:R:I648 R:R:T574 1.52 3 Yes No 6 6 1 2
R:R:I648 R:R:L649 1.43 3 Yes No 6 5 1 2

Location and physicochemical properties of the interaction partners of this ligand

Interactions of this ligand

Similarities between the interactions of this ligand and those of other networks

PDB Summary
PDB 7XW5_nogp
Class
SubFamily
Type
SubType
Species
Ligand
Other Ligand(s)
Protein Partners
PDB Resolution
Date
D.O.I.
Net Summary
Imin 2.94
Number of Linked Nodes 735
Number of Links 925
Number of Hubs 154
Number of Links mediated by Hubs 540
Number of Communities 30
Number of Nodes involved in Communities 252
Number of Links involved in Communities 358
Path Summary
Number Of Nodes in MetaPath 71
Number Of Links MetaPath 70
Number of Shortest Paths 1384830
Length Of Smallest Path 3
Average Path Length 31.0127
Length of Longest Path 56
Minimum Path Strength 1.355
Average Path Strength 5.85449
Maximum Path Strength 23.205
Minimum Path Correlation 0.7
Average Path Correlation 0.986024
Maximum Path Correlation 1
Minimum % Of Corr. Nodes 3.0303
Average % Of Corr. Nodes 50.4742
Maximum % Of Corr. Nodes 100
Minimum Path Hubs % 0
Average Path Hubs % 56.0633
Maximum Path Hubs % 100

Details about the values in these tables can be found in the corresponding documentation page .
CodeHOI
PDB ResiduesW:W:?1
Environment DetailsOpen EMBL-EBI Page
CodeHOI
Name~{N}-[4-[[2-methoxy-5-[(2~{S})-5-oxidanyl-4-oxidanylidene-3-(phenylmethyl)-1,2-dihydroquinazolin-2-yl]phenyl]methoxy]phenyl]ethanamide
Synonyms
Identifier
FormulaC31 H29 N3 O5
Molecular Weight523.579
SMILES
PubChem118685720
Formal Charge0
Total Atoms68
Total Chiral Atoms1
Total Bonds72
Total Aromatic Bonds24

CodeNAG
PDB ResiduesH:H:?1 H:H:?2 H:H:?3 H:H:?4 H:H:?5 H:H:?6 H:H:?7
Environment DetailsOpen EMBL-EBI Page
CodeNAG
NameN-Acetylglucosamine
SynonymsN-Acetylchitosamine
Identifier
FormulaC8 H15 N O6
Molecular Weight221.208
SMILES
PubChem24139
Formal Charge0
Total Atoms30
Total Chiral Atoms5
Total Bonds30
Total Aromatic Bonds0

PDBsumOpen PDBsum Page
ChainR
ProteinReceptor
UniProtP16473
Sequence
>7XW5_nogp_Chain_R
ECHQEEDFR VTCKDIQRI PSLPPSTQT LKLIETHLR TIPSHAFSN 
LPNISRIYV SIDVTLQQL ESHSFYNLS KVTHIEIRN TRNLTYIDP 
DALKELPLL KFLGIFNTG LKMFPDLTK VYSTDIFFI LEITDNPYM 
TSIPVNAFQ GLCNETLTL KLYNNGFTS VQGYAFNGT KLDAVYLNK 
NKYLTVIDK DAFGGVYSG PSLLDVSQT SVTALPSKG LEHLKELIA 
RNTWTLKKL PLSLSFLHL TRADLSYPI HCCAFKNQK DSHYDYTIC 
GDSEDMVCT PKSDEFNPC EDIMGYKFL RIVVWFVSL LALLGNVFV 
LLILLTSHY KLNVPRFLM CNLAFADFC MGMYLLLIA SVDLYTHSE 
YYNHAIDWQ TGPGCNTAG FFTVFASEL SVYTLTVIT LERWYAITF 
AMRLDRKIR LRHACAIMV GGWVCCFLL ALLPLVGIS SYAKVSICL 
PMDTETPLA LAYIVFVLT LNIVAFVIV CCCYVKIYI TVRNPDKDT 
KIAKRMAVL IFTDFICMA PISFYALSA ILNKPLITV SNSKILLVL 
FYPLNSCAN PFLYAIFTK AFQRDVFIL LSKFG


Click on each residue to open a popup with some information about it.

ConSurf Conservation Grade (See documentation): 

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

ChainL
ProteinTSH
UniProtP01215
Sequence
>7XW5_nogp_Chain_L
FCIPTEYTM HIERRECAY CLTINTTIC AGYCMTRDI NGKLFLPKY 
ALSQDVCTY RDFIYRTVE IPGCPLHVA PYFSYPVAL SCKCGKCNT 
DYSDCIHEA IKTNYC


Click on each residue to open a popup with some information about it.

ConSurf Conservation Grade (See documentation): 

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




This receptor, from the same or other species and bound to the same or other ligands, is also present in the following networks:
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
7T9IAProteinGlycoprotein HormoneTSHHomo sapiensTSH-Gs/β1/γ22.92022-08-03doi.org/10.1038/s41586-022-05159-1
7T9I (No Gprot) AProteinGlycoprotein HormoneTSHHomo sapiensTSH-2.92022-08-03doi.org/10.1038/s41586-022-05159-1
7T9NAProteinGlycoprotein HormoneTSHHomo sapiensM22 FabDPPCGs/β1/γ22.92022-08-03doi.org/10.1038/s41586-022-05159-1
7T9N (No Gprot) AProteinGlycoprotein HormoneTSHHomo sapiensM22 FabDPPC2.92022-08-03doi.org/10.1038/s41586-022-05159-1
7UTZAProteinGlycoprotein HormoneTSHHomo sapiensTSHDPPCGs/β1/γ22.42022-08-03doi.org/10.1038/s41586-022-05159-1
7UTZ (No Gprot) AProteinGlycoprotein HormoneTSHHomo sapiensTSHDPPC2.42022-08-03doi.org/10.1038/s41586-022-05159-1
7T9MAProteinGlycoprotein HormoneTSHHomo sapiens-CS-17 Antibody-3.12022-08-10doi.org/10.1038/s41586-022-05159-1
7XW6AProteinGlycoprotein HormoneTSHHomo sapiensM22 FabML109Gs/β1/γ22.782022-08-17doi.org/10.1038/s41586-022-05173-3
7XW6 (No Gprot) AProteinGlycoprotein HormoneTSHHomo sapiensM22 FabML1092.782022-08-17doi.org/10.1038/s41586-022-05173-3
7XW7AProteinGlycoprotein HormoneTSHHomo sapiensK1-70--5.52022-08-17doi.org/10.1038/s41586-022-05173-3
7XW5AProteinGlycoprotein HormoneTSHHomo sapiensTSHML109Gs/β1/γ22.962022-08-24doi.org/10.1038/s41586-022-05173-3
7XW5 (No Gprot) AProteinGlycoprotein HormoneTSHHomo sapiensTSHML1092.962022-08-24doi.org/10.1038/s41586-022-05173-3




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