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
1A:A:K34 4.464204
2A:A:H41 4.13754226
3A:A:L46 3.43754238
4A:A:F212 5.55409
5A:A:F219 5.635228
6A:A:Q227 3.8325449
7A:A:K233 4.7125449
8A:A:W234 4.942509
9A:A:F238 5.942509
10A:A:R265 5.035249
11A:A:L270 5.4725406
12A:A:W277 7.6165256
13A:A:W281 8.296525
14A:A:N292 4.65509
15A:A:D331 5.2075404
16A:A:V334 1.9325404
17A:A:Y339 4.9875403
18A:A:R342 4.65404
19A:A:F345 5.806508
20A:A:Y358 4.8185154
21A:A:Y360 5.514158
22A:A:F363 7.164265
23A:A:T364 6.36254139
24A:A:N371 3.6354139
25A:A:R374 5.4054134
26A:A:D378 7.355407
27A:A:Q384 4.0054276
28A:A:R385 8.2954155
29A:A:L393 2.9375408
30B:B:L7 3.43408
31B:B:L30 4.385405
32B:B:V40 4.95754163
33B:B:H54 6.665659
34B:B:K57 7.322529
35B:B:Y59 5.238528
36B:B:W63 5.135407
37B:B:Q75 7.4075429
38B:B:D76 8.1375409
39B:B:W82 7.28429759
40B:B:N88 4.075407
41B:B:K89 5.552559
42B:B:H91 4.9425405
43B:B:L95 4.06754178
44B:B:W99 6.746509
45B:B:Y105 3.435406
46B:B:N119 3.925409
47B:B:I123 3.8385336
48B:B:Y124 5.3454176
49B:B:T128 4.86754183
50B:B:L139 5.1375409
51B:B:H142 5.64429769
52B:B:Y145 4.52429748
53B:B:D163 7.8025469
54B:B:W169 7.26167668
55B:B:F180 7.474537
56B:B:H183 7.142539
57B:B:D186 4.762549
58B:B:L198 4.065403
59B:B:F199 6.976539
60B:B:V200 4.035416
61B:B:S201 4.9825439
62B:B:C204 4.384547
63B:B:K209 9.2675436
64B:B:W211 9.498538
65B:B:F222 5.85518
66B:B:H225 6.59714719
67B:B:D228 6.37449
68B:B:I232 3.52518
69B:B:F234 3.95415
70B:B:F235 5.14143786
71B:B:P236 4.585487
72B:B:F241 5.654516
73B:B:T243 4.122518
74B:B:D247 6.5625419
75B:B:T249 4.6225416
76B:B:R251 8.786518
77B:B:F253 5.07616
78B:B:D254 5.32409
79B:B:D258 7.295417
80B:B:M262 5.43404
81B:B:Y264 5.522505
82B:B:C271 3.83425
83B:B:F278 3.67587
84B:B:Y289 4.95571727
85B:B:D290 4.7025426
86B:B:D298 6.86254169
87B:B:L300 6.714166
88B:B:H311 7.5925109
89B:B:R314 8.305428
90B:B:W332 7.48167629
91B:B:L336 3.7025457
92B:B:K337 5.375406
93B:B:W339 7.79333609
94R:R:L28 3.234114
95R:R:V37 4.7354125
96R:R:N49 4.77409
97R:R:L56 4.055408
98R:R:L63 3.8785288
99R:R:F69 3.655408
100R:R:L73 3.9075499
101R:R:D77 4.11409
102R:R:P94 4.774115
103R:R:W97 3.17754119
104R:R:F114 4.798507
105R:R:N120 3.24368
106R:R:R129 6.3125409
107R:R:I134 3.8425378
108R:R:Y139 6.78254359
109R:R:Q162 5.694368
110R:R:P165 5.06754198
111R:R:W170 4.1165197
112R:R:N179 7.83754384
113R:R:W186 8.3075407
114R:R:Y192 4.74754198
115R:R:F200 5.68508
116R:R:P204 3.655409
117R:R:L205 1.81754397
118R:R:L226 4.6054155
119R:R:V427 3.594575
120R:R:V431 3.2725476
121R:R:W441 7.2265128
122R:R:H450 6.132599
123R:R:Y454 7.095499
124R:R:Y456 4.91254298
125R:R:H458 6.594289
126R:R:I461 3.145288
127R:R:I465 2.894508
128G:G:L19 2.15409
129G:G:R27 4.0325408
130G:G:Y40 6.2875486
131G:G:L51 5.6025406
132G:G:F61 5.2265318
   

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
1B:B:S84 B:B:W63 10.65636.18NoYes057
2B:B:L70 B:B:W63 16.99936.83NoYes057
3B:B:L70 B:B:W82 17.36324.56NoYes059
4B:B:H54 B:B:W82 20.55983.17YesYes599
5B:B:H54 B:B:S74 23.120912.55YesNo099
6B:B:D76 B:B:S74 23.8287.36YesNo099
7B:B:D76 B:B:K78 17.74076.91YesNo098
8B:B:K78 B:B:P94 16.28293.35NoNo085
9B:B:I93 B:B:P94 15.91693.39NoNo075
10B:B:D76 B:B:L55 40.717114.93YesNo096
11A:A:K34 B:B:L55 80.34785.64YesNo046
12A:A:K34 R:R:Q64 79.9232.71YesNo2048
13A:A:Y37 B:B:L55 87.10643.52NoNo046
14A:A:R42 A:A:Y37 87.2512.35NoNo094
15A:A:R38 R:R:Q64 79.979121.03NoNo048
16A:A:R38 R:R:P140 79.88732.88NoNo047
17A:A:F212 A:A:M60 16.29654.98YesNo099
18A:A:M60 A:A:Q59 16.84948.16NoNo099
19A:A:N371 A:A:Q59 17.95333.96YesNo099
20A:A:N371 A:A:R374 18.23443.62YesYes1394
21A:A:H362 A:A:R374 33.13656.77NoYes094
22A:A:D378 A:A:H362 47.46858.82YesNo079
23A:A:D378 A:A:Y360 49.01598.05YesYes078
24A:A:R385 A:A:Y360 13.8336.17YesYes1558
25A:A:R385 R:R:Q222 42.109111.68YesNo058
26A:A:Q384 R:R:Q222 40.9875.12YesNo068
27A:A:L388 A:A:Q384 39.60562.66NoYes086
28A:A:L388 A:A:L393 34.66312.77NoYes088
29A:A:L393 R:R:I401 37.36772.85YesNo089
30R:R:I401 R:R:Y212 37.98576.04NoNo099
31R:R:R129 R:R:Y212 38.61655.14YesNo099
32A:A:Y391 R:R:R129 74.538512.35NoYes049
33A:A:Y391 R:R:H458 74.59167.62NoYes049
34R:R:H458 R:R:L63 71.17013.86YesYes2898
35R:R:L63 R:R:T66 79.25514.42YesNo088
36R:R:D128 R:R:T66 79.34354.34NoNo098
37R:R:D128 R:R:Y139 79.28485.75NoYes3599
38R:R:P140 R:R:Y139 79.70434.17NoYes079
39A:A:F222 A:A:R42 87.66783.21NoNo079
40A:A:F222 B:B:W99 88.413610.02NoYes079
41A:A:F238 A:A:L44 40.319910.96YesNo099
42A:A:L44 A:A:L46 39.9635.54NoYes2398
43A:A:F246 A:A:L46 40.21933.65NoYes098
44A:A:D249 A:A:K293 13.439517.97NoNo099
45A:A:K293 A:A:N292 14.55554.2NoYes099
46A:A:N292 A:A:T364 25.68264.39YesYes099
47A:A:F290 A:A:T364 13.272811.67NoYes099
48A:A:F290 A:A:H362 13.80725.66NoNo099
49A:A:R374 A:A:T364 13.27686.47YesYes1349
50B:B:L117 B:B:W99 17.67795.69NoYes099
51B:B:L117 B:B:Y145 16.75063.52NoYes498
52A:A:R231 A:A:W234 20.12066NoYes099
53A:A:D272 A:A:R231 19.792810.72NoNo089
54B:B:Q75 B:B:W99 64.08065.48YesYes099
55B:B:K57 B:B:Q75 32.18776.78YesYes299
56B:B:K57 B:B:W332 30.955613.92YesYes299
57B:B:R314 B:B:W332 10012YesYes289
58B:B:Q75 B:B:Y59 32.018711.27YesYes298
59B:B:W332 B:B:Y59 70.76813.86YesYes298
60A:A:C237 A:A:F238 33.15262.79NoYes089
61A:A:F246 A:A:L289 60.00553.65NoNo099
62A:A:F345 A:A:L289 68.65874.87YesNo089
63A:A:F345 A:A:L270 26.08259.74YesYes086
64A:A:I348 A:A:L270 25.42092.85NoYes046
65A:A:F273 A:A:I348 22.14646.28NoNo094
66A:A:F273 A:A:F345 44.6495.36NoYes098
67A:A:C359 A:A:F273 22.66232.79NoNo059
68A:A:I348 A:A:K274 47.30824.36NoNo045
69A:A:K274 A:A:N278 47.10864.2NoNo058
70A:A:C359 A:A:S349 22.6223.44NoNo057
71A:A:S349 A:A:W277 22.5423.71NoYes076
72A:A:N278 A:A:S352 46.8855.96NoNo2585
73A:A:S352 A:A:W277 22.46324.94NoYes2556
74B:B:D290 B:B:R314 73.12298.34YesYes268
75A:A:L289 A:A:L291 20.47022.77NoNo098
76A:A:F363 A:A:L291 19.35353.65YesNo058
77A:A:T335 A:A:Y339 13.69392.5NoYes043
78A:A:T335 A:A:V334 10.27861.59NoYes044
79A:A:D354 A:A:G355 68.25341.68NoNo032
80A:A:D354 A:A:G353 68.61751.68NoNo034
81A:A:G353 A:A:S352 68.98231.86NoNo045
82A:A:R385 A:A:Y358 28.07989.26YesYes1554
83A:A:G355 A:A:Y358 67.89142.9NoYes024
84B:B:C271 B:B:D290 74.45493.11YesYes256
85B:B:C271 B:B:Y289 72.06384.03YesYes257
86B:B:I273 B:B:Y289 42.435410.88NoYes067
87B:B:G244 B:B:I273 43.24793.53NoNo056
88B:B:G244 B:B:T243 41.25933.64NoYes058
89B:B:F253 B:B:T243 20.99583.89YesYes168
90B:B:F222 B:B:F253 16.42166.43YesYes186
91B:B:D258 B:B:F222 12.89784.78YesYes178
92B:B:D258 B:B:R22 10.22617.15YesNo076
93B:B:W297 B:B:Y289 25.66262.89NoYes287
94B:B:W297 B:B:Y264 25.26945.79NoYes085
95B:B:R314 B:B:T274 22.72413.88YesNo288
96B:B:S275 B:B:T274 23.7283.2NoNo088
97B:B:L318 B:B:S275 22.69863NoNo068
98B:B:L318 B:B:S277 15.31043NoNo065
99B:B:S277 B:B:V320 14.23264.85NoNo057
100B:B:V320 B:B:V327 13.69273.21NoNo076
101B:B:V327 B:B:W339 13.15233.68NoYes069
102B:B:M101 B:B:Y145 10.27953.59NoYes098
103B:B:S147 B:B:Y145 18.95512.54NoYes098
104B:B:S147 B:B:S160 18.58283.26NoNo096
105B:B:S160 B:B:V187 18.20996.46NoNo069
106B:B:S201 B:B:V187 11.63213.23YesNo399
107B:B:S201 B:B:W211 10.95177.41YesYes398
108B:B:I93 B:B:L79 10.35494.28NoNo077
109B:B:G162 B:B:Y145 15.96035.79NoYes098
110B:B:G162 B:B:S161 15.58313.71NoNo099
111B:B:H142 B:B:S161 12.86613.95YesNo699
112B:B:I232 B:B:T243 14.73424.56YesYes188
113B:B:L285 B:B:Y264 12.52034.69NoYes065
114B:B:F278 B:B:L285 12.00324.87YesNo076
115R:R:R129 R:R:Y454 90.89025.14YesYes099
116R:R:V453 R:R:Y454 15.287410.09NoYes099
117R:R:S407 R:R:V453 14.89631.62NoNo079
118R:R:I449 R:R:S407 14.50463.1NoNo077
119R:R:I449 R:R:L445 14.11232.85NoNo076
120R:R:F41 R:R:L445 13.71946.09NoNo076
121R:R:F41 R:R:V37 13.32592.62NoYes075
122R:R:V37 R:R:W441 12.13269.81YesYes1258
123R:R:L73 R:R:Y454 41.42114.69YesYes999
124R:R:H450 R:R:L73 39.26665.14YesYes999
125R:R:D77 R:R:H450 75.71126.3YesYes099
126R:R:C447 R:R:D77 68.473.11NoYes099
127R:R:I122 R:R:Y454 39.36718.46NoYes999
128R:R:H450 R:R:I122 39.05915.3YesNo999
129R:R:C447 R:R:Q80 63.82373.05NoNo098
130R:R:Q80 R:R:T111 58.47742.83NoNo089
131R:R:F443 R:R:T111 55.78912.59NoNo089
132R:R:F443 R:R:Y415 55.115612.38NoNo089
133R:R:H112 R:R:Y415 16.43625.44NoNo089
134R:R:H112 R:R:V108 15.72855.54NoNo087
135R:R:M184 R:R:V108 13.60093.04NoNo077
136R:R:M184 R:R:Y192 12.89053.59NoYes078
137R:R:W186 R:R:Y415 38.77165.79YesNo079
138R:R:S196 R:R:W186 36.7044.94NoYes087
139R:R:F200 R:R:S196 36.01362.64YesNo088
140R:R:I133 R:R:I134 10.6832.94NoYes088
141R:R:C416 R:R:F200 25.52754.19NoYes088
142R:R:C416 R:R:I201 23.42994.91NoNo088
143R:R:G413 R:R:I201 18.55681.76NoNo078
144R:R:G413 R:R:P414 17.85064.06NoNo079
145R:R:I439 R:R:P414 13.60093.39NoNo079
146R:R:I439 R:R:L418 12.89055.71NoNo077
147R:R:L418 R:R:V427 12.17954.47NoYes075
148A:A:Y358 A:A:Y360 37.30172.98YesYes1548
149A:A:D272 A:A:F246 19.63378.36NoNo089
150A:A:W234 B:B:Y145 18.78794.82YesYes098
151A:A:C237 B:B:Y59 32.32712.69NoYes288
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:R34 R:R:T437 6.47 12 No No 6 6 2 2
R:R:R34 R:R:W441 4 12 No Yes 6 8 2 1
R:R:V37 R:R:W441 9.81 12 Yes Yes 5 8 1 1
R:R:V37 W:W:?1 4.97 12 Yes No 5 0 1 0
R:R:T437 R:R:W441 4.85 12 No Yes 6 8 2 1
R:R:W441 W:W:?1 15.19 12 Yes No 8 0 1 0
R:R:F41 R:R:V37 2.62 0 No Yes 7 5 2 1
R:R:L38 R:R:W441 2.28 0 No Yes 7 8 2 1
R:R:I33 R:R:V37 1.54 0 No Yes 4 5 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

ShowSimilarityNetwork TypeNameLigandDescription
50.00Single8W8SAA-148W8S-GPR101-AA-14
28.57Single7F61Cholesterol7F61-H3-PF-03654746-Cholesterol
28.57Consensush3_on_alloOther Ligand7F61-H3-PF-03654746-Cholesterol
16.67Single5YHLPubChem 1351213525YHL-EP4-PubChem 135121352
16.67Single5YWYONO-AE3-2085YWY-EP4-ONO-AE3-208
16.67Consensusep4_offOrthosteric Ligand5YWY-EP4-ONO-AE3-208 5YHL-EP4-PubChem 135121352
16.67Consensusep_offOrthosteric Ligandep4_off
11.11Single7XP6Strychnine7XP6-T2R46-Strychnine-chim(Gs-CtGt3)/&β;1/&γ;2
11.11Consensusclass-t_onOrthosteric Ligandtaste2_on
11.11Consensusgs_class-tOrthosteric Ligandgs_taste
11.11Consensusgs_tasteOrthosteric Ligand7XP6-T2R46-Strychnine-chim(Gs-CtGt3)/&β;1/&γ;2
11.11Consensustaste2_onOrthosteric Ligand7XP6-T2R46-Strychnine-chim(Gs-CtGt3)/&β;1/&γ;2
10.00Single5U09Taranabant5U09-CB1-Taranabant
9.09Single8GCML9026888GCM-EP4-L902688-Gi1/&β;1/&γ;2
9.09Single8JD6N-(3-chlorophenyl)pyridine-2-carboxamide8JD6-mGlu4; mGlu4-Phosphoserine-N-(3-chlorophenyl)pyridine-2-carboxamide-Gi3/&β;1/&γ;2
9.09Single8K2WAMG4878K2W-CXCR3-AMG487
9.09Single8X7ATreprostinil8X7A-I2-Treprostinil-Gs/&β;1/&γ;2
9.09Consensuscb1_offOrthosteric Ligand5TGZ-CB1-AM6538 5U09-CB1-Taranabant
8.33Single2Y01Dobutamine2Y01-β1-Dobutamine
8.33Single5TGZAM65385TGZ-CB1-AM6538
8.33Single6IIVDaltroban6IIV-TP-Daltroban
8.33Consensuslipid_offOrthosteric Ligandcannabinoid_off leuko_off lpl_off paf_off prostanoid_off
8.33Consensusprostanoid_offOrthosteric Ligandep_off tp_off dp_off
8.33Consensustp_offOrthosteric Ligand6IIV-TP-Daltroban 6IIU-TP-Ramatroban
7.69Single2Y00Dobutamine2Y00-β1-Dobutamine
7.69Single4JKVTaladegib (LY2940680)4JKV-SMO-Taladegib (LY2940680)
7.69Single5T1APubChem 68764898; PubChem 120931705T1A-CCR2-PubChem 68764898; PubChem 12093170
7.69Single6GPXMK08126GPX-CCR2-MK0812
7.69Single6M9TMisoprostol-FA6M9T-EP3-Misoprostol-FA
7.69Single6XBKCholesterol6XBK-SMO-Cholesterol-Gi1/&β;1/&γ;2
7.69Single7YXAONO-54306087YXA-S1P5-ONO-5430608
7.69Single8GD9Rivenprost8GD9-EP4-Rivenprost-Gs/&β;1/&γ;2
7.69Single8GDAL9026888GDA-EP4-L902688-Gs/&β;1/&γ;2
7.69Single8GDCPGE28GDC-EP3-PGE2-Gi1/&β;1/&γ;2
7.69Consensusccr2_off_alloOther Ligand5T1A-CCR2-PubChem 68764898; PubChem 12093170 6GPX-CCR2-MK0812
7.69Consensusep3_onOrthosteric Ligand8GDC-EP3-PGE2-Gi1/&β;1/&γ;2
7.14Single3PDSHydroxybenzylisoproterenol3PDS-β2-Hydroxybenzylisoproterenol
7.14Single5V56TC1145V56-SMO-TC114
7.14Single5V57TC1145V57-SMO-TC114
7.14Single6O3CCholesterol6O3C-SMO-SAG21k-Cholesterol
7.14Single7R0CAcyclovir triphosphate7R0C-V2-Acyclovir triphosphate-Arrestin2
7.14Single8GDBPGE28GDB-EP4-PGE2-Gs/&β;1/&γ;2
7.14Single8IUKPGF2-alpha8IUK-FP-alpha-PGF2-alpha-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2
7.14Single8JD5BQI; HZE; PEF8JD5-mGlu2; mGlu4-Glutamate-BQI; HZE; PEF-Gi1/&β;1/&γ;2
7.14Single8X79MRE-2698X79-I2-MRE-269-Gs/&β;1/&γ;2
7.14Single8XJMLatanoprost8XJM-FP-alpha-Latanoprost-chim(NtGi2-Gs-CtGq)/&β;1/&γ;2
6.67Single4N4WSANT-14N4W-SMO-SANT-1
6.67Single6AK3Dinoprostone IPGE26AK3-EP3-Dinoprostone IPGE2
6.67Single6H7N(S)-Xamoterol6H7N-β1-(S)-Xamoterol
6.67Single6IIURamatroban6IIU-TP-Ramatroban
6.67Single7D7MDinoprostone7D7M-EP4-Dinoprostone-Gs/&β;1/&γ;1
6.67Single8GCPPGE28GCP-EP4-PGE2-Gi1/&β;1/&γ;2
6.67Consensusbeta1_onOrthosteric Ligand7JJO-β1-Isoprenaline-Gs/&β;1/&γ;2 8DCR-β1-Dobutamine-Gs/&β;1/&γ;2
6.67Consensuscannabinoid_offOrthosteric Ligandcb1_off cb2_off
6.67Consensusep_onOrthosteric Ligandep4_on ep2_on ep3_on
6.67Consensusgi_prostanoidOrthosteric Ligand8GCP-EP4-PGE2-Gi1/&β;1/&γ;2 8GDC-EP3-PGE2-Gi1/&β;1/&γ;2 8GCM-EP4-L902688-Gi1/&β;1/&γ;2
6.67Consensusprostanoid_onOrthosteric Ligandep_on fpa_on
6.25Single6H7LDobutamine6H7L-β1-Dobutamine
6.25Single7CX2PGE27CX2-EP2-PGE2-Gs/&β;1/&γ;2
6.25Single7CX4Evatanepag7CX4-EP2-Evatanepag-Gs/&β;1/&γ;2
6.25Single7QVMOxytocin7QVM-OT-Oxytocin-chim(NtGi1-Go-CtGq)/&β;1/&γ;2
6.25Single8XJOU466198XJO-TP-U46619-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2
6.25Consensusep2_onOrthosteric Ligand7CX4-EP2-Evatanepag-Gs/&β;1/&γ;2 7CX2-EP2-PGE2-Gs/&β;1/&γ;2 7CX3-EP2-Taprenepag-Gs/&β;1/&γ;2
6.25Consensusep4_onOrthosteric Ligand7D7M-EP4-Dinoprostone-Gs/&β;1/&γ;1 8GCP-EP4-PGE2-Gi1/&β;1/&γ;2 8GD9-EP4-Rivenprost-Gs/&β;1/&γ;2 8GDA-EP4-L902688-Gs/&β;1/&γ;2
6.25Consensusfpa_onOrthosteric Ligand8IUK-FP-alpha-PGF2-alpha-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2 8IUM-FP-alpha-Tafluprost acid-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2 8IUL-FP-alpha-Latanoprost-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2
6.25Consensusgs_lipidOrthosteric Ligandgs_ffa gs_prostanoid
6.25Consensusgs_prostanoidOrthosteric Ligand8IUK-FP-alpha-PGF2-alpha-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2 8IUM-FP-alpha-Tafluprost acid-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2 7CX2-EP2-PGE2-Gs/&β;1/&γ;2 7CX3-EP2-Taprenepag-Gs/&β;1/&γ;2 7D7M-EP4-Dinoprostone-Gs/&β;1/&γ;1 7CX4-EP2-Evatanepag-Gs/&β;1/&γ;2 8IUL-FP-alpha-Latanoprost-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2
6.25Consensusot_onOrthosteric Ligand7QVM-OT-Oxytocin-chim(NtGi1-Go-CtGq)/&β;1/&γ;2
5.88Single7F2OBradykinin7F2O-BK2-Bradykinin-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2
5.88Single8IQ4Carboprost8IQ4-FP-alpha-Carboprost-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2
5.88Single8IUMTafluprost acid8IUM-FP-alpha-Tafluprost acid-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2
5.88Consensusgo_vasopressinOrthosteric Ligand7QVM-OT-Oxytocin-chim(NtGi1-Go-CtGq)/&β;1/&γ;2
5.56Single4AMJ(S)-Carvedilol4AMJ-β1-(S)-Carvedilol
5.56Single7CX3Taprenepag7CX3-EP2-Taprenepag-Gs/&β;1/&γ;2
5.56Single8DCRDobutamine8DCR-β1-Dobutamine-Gs/&β;1/&γ;2
5.56Consensusste2_offOrthosteric Ligand7QA8-STE2-Peptide
5.26Consensusvasopressin-ot_onOrthosteric Ligandot_on v2_on
4.76Single7AD3Alpha-factor mating pheromone7AD3-STE2-Alpha-factor mating pheromone-Gi1/STE4/&γ;2
4.76Consensusbk2_onOrthosteric Ligand7F2O-BK2-Bradykinin-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2 7F6I-BK2-Kallidin-Gq/&β;1/&γ;2
4.76Consensusclass-d_onOrthosteric Ligandste2_on
4.76Consensusgi_class-dOrthosteric Ligandgi_ste
4.76Consensusgi_steOrthosteric Ligand7AD3-STE2-Alpha-factor mating pheromone-Gi1/STE4/&γ;2
4.76Consensusste2_onOrthosteric Ligand7AD3-STE2-Alpha-factor mating pheromone-Gi1/STE4/&γ;2
4.55Single7F6HBradykinin7F6H-BK2-Bradykinin-Gq/&β;1/&γ;2
4.55Single7F6IKallidin7F6I-BK2-Kallidin-Gq/&β;1/&γ;2
4.55Single7KH0Acyclovir triphosphate7KH0-V2-Acyclovir triphosphate-chim(NtGi1-Gs)/&β;1/&γ;2
4.55Single7QBIAlpha-factor mating pheromone7QBI-STE2-Alpha-factor mating pheromone
4.55Consensusbk1_onOrthosteric Ligand7EIB-BK1-Des-Arg10-Kallidin-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2
4.55Consensusgs_bradykininOrthosteric Ligand7F2O-BK2-Bradykinin-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2 7EIB-BK1-Des-Arg10-Kallidin-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2
4.35Single7QBIAlpha-factor mating pheromone7QBI-STE2-Alpha-factor mating pheromone
4.35Consensusbradykinin_onOrthosteric Ligandbk2_on bk1_on
4.35Consensusclass-d_onOrthosteric Ligandste2_on
4.35Consensusgs_vasopressin-otOrthosteric Ligand7RYC-OT-Oxytocin-chim(NtGi2L-Gs-CtGq)/&β;1/&γ;2 7DW9-V2-Acyclovir triphosphate-chim(NtGi1-Gs)/&β;1/&γ;2
4.17Single7AD3Alpha-factor mating pheromone7AD3-STE2-Alpha-factor mating pheromone-Gi1/STE4/&γ;2
4.17Single7EIBDes-Arg10-Kallidin7EIB-BK1-Des-Arg10-Kallidin-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2
4.17Consensusgi_class-dOrthosteric Ligandgi_ste
4.17Consensusgi_steOrthosteric Ligand7AD3-STE2-Alpha-factor mating pheromone-Gi1/STE4/&γ;2
4.00Consensusgq_bradykininOrthosteric Ligand7F6H-BK2-Bradykinin-Gq/&β;1/&γ;2 7F6I-BK2-Kallidin-Gq/&β;1/&γ;2

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:F96 W:W:?2 24.36 0 No No 4 0 1 0
R:R:N100 W:W:?2 13.73 0 No No 8 0 1 0
R:R:F103 W:W:?2 10.15 0 No No 5 0 1 0
R:R:F96 R:R:L95 2.44 0 No No 4 5 1 2
R:R:F103 R:R:L99 2.44 0 No No 5 7 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

ShowSimilarityNetwork TypeNameLigandDescription
66.67Single8W8SAA-148W8S-GPR101-AA-14
16.67Single8TLMAnti-murine CCR8 antibody8TLM-CCR8-Anti-murine CCR8 antibody
16.67Consensusccr8_offOrthosteric Ligand8TLM-CCR8-Anti-murine CCR8 antibody
9.09Single4XNVBPTU4XNV-P2Y1-BPTU
7.69Single7F83PF-051904577F83-Ghrelin-PF-05190457
6.90Consensusmc2_onOrthosteric Ligand8GY7-MC2-Corticotropin-Ca-chim(NtGi1-Gs)/&β;1/&γ;2; MRAP1
6.67Single7XBDGalanin7XBD-GAL2-Galanin-chim(NtGi2L-Gs-CtGq)/&β;1/&γ;2
6.67Single7XJLSpexin7XJL-GAL2-Spexin-chim(NtGi2L-Gs-CtGq)/&β;1/&γ;2
6.25Single4PY02MeSATP4PY0-P2Y12-2MeSATP
6.25Single7WQ4Galanin7WQ4-GAL2-Galanin-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2
6.25Single7XJKGalanin7XJK-GAL2-Galanin-chim(NtGi2L-Gs-CtGq)/&β;1/&γ;2
6.25Single7XXI2MeSADP7XXI-P2Y12-2MeSADP-Gi2/&β;1/&γ;2
6.25Consensusgalanin_onOrthosteric Ligandgal2_on gal1_on
5.88Single4PXZ2MeSADP4PXZ-P2Y12-2MeSADP
5.88Single8HN1Toxin AdTx18HN1-Alpha1A-Toxin AdTx1
5.88Consensusgal2_onOrthosteric Ligand7WQ4-GAL2-Galanin-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2 7XJL-GAL2-Spexin-chim(NtGi2L-Gs-CtGq)/&β;1/&γ;2
5.88Consensusgs_galaninOrthosteric Ligand7WQ4-GAL2-Galanin-chim(NtGi1-Gs-CtGq)/&β;1/&γ;2 7XJL-GAL2-Spexin-chim(NtGi2L-Gs-CtGq)/&β;1/&γ;2
5.26Single7F4ISHU91197F4I-MC1-SHU9119-chim(NtGi1-Gs)/&β;1/&γ;2
5.26Consensusalpha1a_offOrthosteric Ligand7YMJ-Alpha1A-Tamsulosin 8HN1-Alpha1A-Toxin AdTx1
5.00Single8IOCGamma-MSH8IOC-MC3-Gamma-MSH-Ca-chim(NtGi1-Gs)/&β;1/&γ;2
5.00Consensusalpha1_offOrthosteric Ligandalpha1a_off alpha1b_off
4.76Single7F4DAlpha-MSH7F4D-MC1-Alpha-MSH-chim(NtGi1-Gs)/&β;1/&γ;2
4.76Consensusmc3_onOrthosteric Ligand8IOC-MC3-Gamma-MSH-Ca-chim(NtGi1-Gs)/&β;1/&γ;2
4.76Consensusmc5_onOrthosteric Ligand8INR-MC5-Alpha-MSH-Ca-chim(NtGi1-Gs)/&β;1/&γ;2 8IOD-MC5-PG-901-Ca-chim(NtGi1-Gs)/&β;1/&γ;2
4.55Single7DW9Acyclovir triphosphate7DW9-V2-Acyclovir triphosphate-chim(NtGi1-Gs)/&β;1/&γ;2
4.55Consensusv2_onOrthosteric Ligand7DW9-V2-Acyclovir triphosphate-chim(NtGi1-Gs)/&β;1/&γ;2
4.35Single8IODPG-9018IOD-MC5-PG-901-Ca-chim(NtGi1-Gs)/&β;1/&γ;2
4.35Consensusgs_melanocortinOrthosteric Ligand7F4D-MC1-Alpha-MSH-chim(NtGi1-Gs)/&β;1/&γ;2 7F4H-MC1-Afamelanotide-chim(NtGi1-Gs)/&β;1/&γ;2 7F54-MC4-Afamelanotide-Gs/&β;1/&γ;2 7F53-MC4-Alpha-MSH-Gs/&β;1/&γ;2 7F55-MC4-Bremelanotide-Gs/&β;1/&γ;2 7PIV-MC4-Setmelanotide-Gs/&β;1/&γ;2 7F4I-MC1-SHU9119-chim(NtGi1-Gs)/&β;1/&γ;2 7F58-MC4-THIQ-Gs/&β;1/&γ;2
4.35Consensusmc1_onOrthosteric Ligand7F4H-MC1-Afamelanotide-chim(NtGi1-Gs)/&β;1/&γ;2 7F4D-MC1-Alpha-MSH-chim(NtGi1-Gs)/&β;1/&γ;2 7F4I-MC1-SHU9119-chim(NtGi1-Gs)/&β;1/&γ;2
4.17Consensusgi_neuromedinOrthosteric Ligand7XK8-NMUR2-Neuromedin-U-25-Gi1/&β;1/&γ;2
4.00Single7F53Alpha-MSH7F53-MC4-Alpha-MSH-Gs/&β;1/&γ;2
4.00Single7XK8Neuromedin-U-257XK8-NMUR2-Neuromedin-U-25-Gi1/&β;1/&γ;2
3.57Single8HBDIRL16208HBD-ETB-IRL1620-Gi1/&β;1/&γ;2
3.57Consensusmelanocortin_onOrthosteric Ligandmc2_on mc1_on mc3_on mc4_on mc5_on
3.45Single6LRYSarafotoxin-B6LRY-ETB-Sarafotoxin-B
2.78Single8GY7Corticotropin8GY7-MC2-Corticotropin-Ca-chim(NtGi1-Gs)/&β;1/&γ;2; MRAP1

PDB Summary
PDB 8W8R
Class A
SubFamily Orphan
Type A orphans
SubType GPR101
Species Homo Sapiens
Ligand -
Other Ligand(s) AA-14
Protein Partners chim(NtGi1-Gs)/Beta1/Gamma2
PDB Resolution 3.3
Date 2024-01-03
D.O.I. 10.1038/s41589-023-01456-6
Net Summary
Imin 2.69
Number of Linked Nodes 846
Number of Links 971
Number of Hubs 132
Number of Links mediated by Hubs 493
Number of Communities 39
Number of Nodes involved in Communities 199
Number of Links involved in Communities 258
Path Summary
Number Of Nodes in MetaPath 152
Number Of Links MetaPath 151
Number of Shortest Paths 781704
Length Of Smallest Path 3
Average Path Length 28.6446
Length of Longest Path 59
Minimum Path Strength 1.285
Average Path Strength 5.6454
Maximum Path Strength 19.045
Minimum Path Correlation 0.7
Average Path Correlation 0.976598
Maximum Path Correlation 1
Minimum % Of Corr. Nodes 2.94118
Average % Of Corr. Nodes 45.8413
Maximum % Of Corr. Nodes 100
Minimum Path Hubs % 0
Average Path Hubs % 42.6469
Maximum Path Hubs % 100
AnnotationTypeLinks
Gene OntologyMolecular Function
Gene OntologyBiological Process
Gene OntologyCellular Component
SCOP2Domain Identifier
SCOP2Family Identifier
Membrane Protein Annotations-• Orientations of Proteins in Membranes database (OPM)   • Protein Data Bank of Transmembrane Proteins (PDBTM)   • MemProtMD


Details about the values in these tables can be found in the corresponding documentation page .
CodeU7D
PDB ResiduesW:W:?1 W:W:?2
Environment DetailsOpen EMBL-EBI Page
CodeU7D
Name1-(4-methylpyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]thiourea
SynonymsCHEMBL2134995
Identifier1-(4-methylpyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]thiourea
FormulaC14 H12 F3 N3 S
Molecular Weight311.325
SMILESCc1ccnc(c1)NC(=S)Nc2cccc(c2)C(F)(F)F
PubChem848971
Formal Charge0
Total Atoms33
Total Chiral Atoms0
Total Bonds34
Total Aromatic Bonds12

PDBsumOpen PDBsum Page
ChainA
ProteinG Protein α Sub unit
UniProtP63092
Sequence
>8W8R_Chain_A
TLSAEDKAA VERSKMIEK QLQKDKQVY RATHRLLLL GADNSGKST 
IVKQMRIYV KTSGIFETK FQVDKVNFH MFDVGAQRD ERRKWIQCF 
NDVTAIIFV VDSSDYNRL QEALNDFKS IWNNRWLRT ISVILFLNK 
QDLLAEKVL AGKSKIEDY FPEFARYTT PEDATPEPG EDPRVTRAK 
YFIRDEFLR ISTASGDGR HYCYPHFTC SVDTENARR IFNDCRDII 
QRMHLRQYE LL


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  

ChainB
ProteinG Protein β Sub unit
UniProtP62873
Sequence
>8W8R_Chain_B
QLRQEAEQL KNQIRDARK ACADATLSQ ITNNIDPVG RIQMRTRRT 
LRGHLAKIY AMHWGTDSR LLVSASQDG KLIIWDSYT TNKVHAIPL 
RSSWVMTCA YAPSGNYVA CGGLDNICS IYNLKTREG NVRVSRELA 
GHTGYLSCC RFLDDNQIV TSSGDTTCA LWDIETGQQ TTTFTGHTG 
DVMSLSLAP DTRLFVSGA CDASAKLWD VREGMCRQT FTGHESDIN 
AICFFPNGN AFATGSDDA TCRLFDLRA DQELMTYSH DNIICGITS 
VSFSKSGRL LLAGYDDFN CNVWDALKA DRAGVLAGH DNRVSCLGV 
TDDGMAVAT GSWDSFLKI WN


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  

ChainR
ProteinReceptor
UniProtQ96P66
Sequence
>8W8R_Chain_R
LAHGIIRST VLVIFLAAS FVGNIVLAL VLQRKPQLL QVTNRFIFN 
LLVTDLLQI SLVAPWVVA TSVPLFWPL NSHFCTALV SLTHLFAFA 
SVNTIVVVS VDRYLSIIH PLSYPSKMT QRRGYLLLY GTWIVAILQ 
STPPLYGWG QAAFDERNA LCSMIWGAS PSYTILSVV SFIVIPLIV 
MIACYSVVF CAARRQHAL LYNCKAAKV IFIIIFSYV LSLGPYCFL 
AVLAVWVDV ETQVPQWVI TIIIWLFFL QCCIHPYVY GYMHKTIKK 
EIQDMLKKF F


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  

ChainG
ProteinG Protein γ Sub unit
UniProtP59768
Sequence
>8W8R_Chain_G
NTASIAQAR KLVEQLKME ANIDRIKVS KAAADLMAY CEAHAKEDP 
LLTPVPASE NPFR


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
8W8QAOrphanA orphansGPR101Homo sapiens--Gs/&β;1/&γ;22.892024-01-0310.1038/s41589-023-01456-6
8W8RAOrphanA orphansGPR101Homo sapiens-AA-14chim(NtGi1-Gs)/&β;1/&γ;23.32024-01-0310.1038/s41589-023-01456-6
8W8SAOrphanA orphansGPR101Homo sapiens-AA-14-3.32024-01-0310.1038/s41589-023-01456-6




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