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:S35 2.395406
2R:R:S45 2.81419
3R:R:N49 5.706519
4R:R:L63 4.19458
5R:R:N67 4.38459
6R:R:F69 3.5125408
7R:R:L74 3.465419
8R:R:W97 4.4175489
9R:R:F114 5.56506
10R:R:F116 7.29409
11R:R:I134 4.08508
12R:R:Y139 4.3125468
13R:R:M143 4.05468
14R:R:P166 5.12428
15R:R:W170 4.9225426
16R:R:F175 5.06485
17R:R:D176 2.992505
18R:R:M184 3.77527
19R:R:W186 7.37833607
20R:R:S189 2.625426
21R:R:Y192 5.874528
22R:R:F200 6.2275408
23R:R:P204 3.655499
24R:R:M208 2.6925409
25R:R:F216 1.905407
26R:R:Y408 2.855499
27R:R:L412 2.59409
28R:R:W441 12.7425448
29R:R:F444 2.4725408
30R:R:Q446 3.3475439
31R:R:H450 5.014539
32R:R:H458 3.8925409
   

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:G31 R:R:H30 10.38621.59NoNo055
2R:R:G31 R:R:S92 12.08781.86NoNo056
3R:R:S35 R:R:S92 13.77533.26YesNo066
4R:R:S35 R:R:V89 20.38411.62YesNo067
5R:R:V39 R:R:V89 22.0011.6NoNo057
6R:R:I40 R:R:V39 23.60383.07NoNo065
7R:R:F41 R:R:I40 25.19241.26NoNo076
8R:R:F41 R:R:L445 26.76692.44NoNo077
9R:R:I449 R:R:L445 28.32734.28NoNo077
10R:R:I449 R:R:S411 36.75074.64NoNo079
11R:R:Q446 R:R:S411 38.1842.89YesNo099
12R:R:H450 R:R:Q446 71.79984.95YesYes399
13R:R:H450 R:R:P451 63.39051.53YesNo099
14R:R:N49 R:R:P451 31.26466.52YesNo099
15R:R:N49 R:R:S45 13.7332.98YesYes199
16R:R:L52 R:R:P451 37.06141.64NoNo099
17R:R:G455 R:R:L52 35.59271.71NoNo099
18R:R:I465 R:R:V55 12.15146.14NoNo089
19R:R:I461 R:R:I465 15.47692.94NoNo088
20R:R:G455 R:R:I461 34.111.76NoNo098
21R:R:H458 R:R:I461 18.48486.63YesNo098
22R:R:H458 R:R:L63 13.60592.57YesYes098
23R:R:L412 R:R:Q446 1002.66YesYes099
24R:R:F200 R:R:L412 90.99773.65YesYes089
25R:R:F116 R:R:F200 59.097611.79YesYes098
26R:R:A115 R:R:F116 55.44731.39NoYes089
27R:R:A115 R:R:F443 55.12961.39NoNo088
28R:R:F443 R:R:F444 74.54642.14NoYes088
29R:R:F444 R:R:V84 69.13792.62YesNo089
30R:R:Q80 R:R:V84 52.9692.87NoNo089
31R:R:F114 R:R:Q80 51.52169.37YesNo068
32R:R:F114 R:R:T76 34.66782.59YesNo069
33R:R:T76 R:R:W156 29.53473.64NoNo799
34R:R:N72 R:R:W156 28.11555.65NoNo099
35R:R:L152 R:R:N72 24.747612.36NoNo099
36R:R:F69 R:R:L152 23.03892.44YesNo089
37R:R:F69 R:R:L151 17.82812.44YesNo088
38R:R:L151 R:R:M143 14.28372.83NoYes088
39R:R:T111 R:R:V84 19.81223.17NoNo099
40R:R:F103 R:R:W87 14.679110.02NoNo066
41R:R:L107 R:R:W87 16.45133.42NoNo076
42R:R:L107 R:R:T111 18.06821.47NoNo079
43R:R:F103 R:R:L99 12.89278.53NoNo067
44R:R:F96 R:R:L99 11.09234.87NoNo047
45R:R:A180 R:R:D176 14.62261.54NoYes045
46R:R:D176 R:R:N179 17.66574.04YesNo054
47R:R:I436 R:R:N179 22.44587.08NoNo054
48R:R:I436 R:R:L418 22.92592.85NoNo056
49R:R:I439 R:R:L418 23.75915.71NoNo076
50R:R:I439 R:R:P414 24.57111.69NoNo079
51R:R:G413 R:R:P414 30.27614.06NoNo079
52R:R:G413 R:R:L412 31.68111.71NoYes079
53R:R:M184 R:R:W186 25.8498.14YesYes077
54R:R:S196 R:R:W186 33.26983.71NoYes087
55R:R:F200 R:R:S196 33.72875.28YesNo088
56R:R:H112 R:R:Y415 10.15324.36NoNo089
57R:R:W186 R:R:Y415 16.11244.82YesNo079
58R:R:F114 R:R:L113 11.09232.44YesNo068
59R:R:L412 R:R:Y408 76.07852.34YesYes099
60R:R:P204 R:R:Y408 13.77534.17YesYes999
61R:R:H450 R:R:I122 11.46655.3YesNo098
62R:R:M208 R:R:Y408 63.64472.39YesYes099
63R:R:M208 R:R:S126 49.4813.07YesNo099
64R:R:S126 R:R:V127 24.04861.62NoNo097
65R:R:S126 R:R:V207 24.04861.62NoNo097
66R:R:C211 R:R:V127 22.53761.71NoNo087
67R:R:C211 R:R:V207 22.53761.71NoNo087
68R:R:I134 R:R:Y130 38.773.63YesNo088
69R:R:C211 R:R:Y130 41.92616.72NoNo088
70R:R:H135 R:R:I134 19.734510.61NoYes078
71R:R:H135 R:R:L131 13.21051.29NoNo076
72R:R:M184 R:R:Y192 13.40824.79YesYes278
73R:R:F444 R:R:I440 18.44952.51YesNo088
74R:R:I440 R:R:L181 16.93852.85NoNo084
75R:R:A422 R:R:W186 10.66862.59NoYes057
76R:R:I203 R:R:P204 10.62633.39NoYes069
77R:R:M208 R:R:Y212 15.70292.39YesNo099
78R:R:I401 R:R:Y212 10.55573.63NoNo099
79R:R:V453 R:R:Y452 11.85481.26NoNo097
80R:R:D176 R:R:L181 15.47692.71YesNo054
81R:R:F443 R:R:Y415 21.29499.28NoNo089
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 2.59 4 No No 5 6 2 2
R:R:R34 R:R:W441 3 4 No Yes 5 8 2 1
R:R:V37 R:R:W441 8.58 0 No Yes 6 8 2 1
R:R:T437 R:R:W441 7.28 4 No Yes 6 8 2 1
R:R:W441 W:W:?1 32.11 4 Yes No 8 0 1 0

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
50.00Single8W8RAA-148W8R-GPR101-AA-14-chim(NtGi1-Gs)/β1/γ2
14.29Single7F61Cholesterol7F61-H3-PF-03654746-Cholesterol
12.50Single9B9Y7DY9B9Y-CB1-7DY
11.11Single5U09Taranabant5U09-CB1-Taranabant
11.11Single9BA0A1AKN9BA0-CB1-A1AKN
10.00Single8K2WAMG4878K2W-CXCR3-AMG487
10.00Single8X7ATreprostinil8X7A-I2-Treprostinil-Gs/β1/γ2
10.00Consensuscb1_offOrthosteric Ligand5U09-CB1-Taranabant 5TGZ-CB1-AM6538
10.00Consensuscxcr3_offOrthosteric Ligand8K2W-CXCR3-AMG487
9.09Single2Y01Dobutamine2Y01-β1-Dobutamine
9.09Single5TGZAM65385TGZ-CB1-AM6538
9.09Single6IIVDaltroban6IIV-TP-Daltroban
9.09Single7YXAONO-54306087YXA-S1P5-ONO-5430608
9.09Single9B9ZA1AKO9B9Z-CB1-A1AKO
9.09Consensuslipid_offOrthosteric Ligandcannabinoid_off paf_off lpl_off prostanoid_off leukotriene_off
8.33Single2Y00Dobutamine2Y00-β1-Dobutamine
8.33Single4JKVTaladegib4JKV-SMO-Taladegib
8.33Single5T1APubChem 68764898; PubChem 120931705T1A-CCR2-PubChem 68764898; PubChem 12093170
8.33Single5YHLPubChem 1351213525YHL-EP4-PubChem 135121352
8.33Single5YWYONO-AE3-2085YWY-EP4-ONO-AE3-208
8.33Single6GPXMK08126GPX-CCR2-MK0812
8.33Single6M9TMisoprostol-FA6M9T-EP3-Misoprostol-FA
8.33Single6XBKCholesterol6XBK-SMO-Cholesterol-Gi1/β1/γ2
8.33Single8GD9Rivenprost8GD9-EP4-Rivenprost-Gs/β1/γ2
8.33Single8GDCPGE28GDC-EP3-PGE2-Gi1/β1/γ2
8.33Consensusep4_offOrthosteric Ligand5YWY-EP4-ONO-AE3-208 5YHL-EP4-PubChem 135121352
8.33Consensusep_offOrthosteric Ligandep4_off
8.33Consensuss1p5_offOrthosteric Ligand7YXA-S1P5-ONO-5430608
7.69Single3PDSHydroxybenzylisoproterenol3PDS-β2-Hydroxybenzylisoproterenol
7.69Single5V56TC1145V56-SMO-TC114
7.69Single5V57TC1145V57-SMO-TC114
7.69Single6O3CCholesterol6O3C-SMO-SAG21k-Cholesterol
7.69Single7R0CAVP7R0C-V2-AVP-Arrestin2
7.69Single8GDBPGE28GDB-EP4-PGE2-Gs/β1/γ2
7.69Single8IUKPGF2-alpha8IUK-FP-alpha-PGF2-α-chim(NtGi1-Gs-CtGq)/β1/γ2
7.69Single8X79MRE-2698X79-I2-MRE-269-Gs/β1/γ2
7.69Single8XJMLatanoprost8XJM-FP-alpha-Latanoprost-chim(NtGi2-Gs-CtGq)/β1/γ2
7.69Single9BJKNAM9BJK-μ-Naloxone-NAM
7.14Single4N4WSANT-14N4W-SMO-SANT-1
7.14Single6AK3Dinoprostone IPGE26AK3-EP3-Dinoprostone IPGE2
7.14Single6H7NS-Xamoterol6H7N-β1-S-Xamoterol
7.14Single6IIURamatroban6IIU-TP-Ramatroban
7.14Single8GCPPGE28GCP-EP4-PGE2-Gi1/β1/γ2
7.14Single8XJNCloprosetnol8XJN-TP-Cloprosetnol-chim(NtGi1-Gs-CtGq)/β1/γ2
7.14Consensuscannabinoid_offOrthosteric Ligandcb2_off cb1_off
7.14Consensuslipid_offonOrthosteric Ligandlipid_off lipid_on
7.14Consensuslipid_offon_gpOrthosteric Ligandlipid_on_gp lipid_off
6.67Single6H7LDobutamine6H7L-β1-Dobutamine
6.67Single7CX4Evatanepag7CX4-EP2-Evatanepag-Gs/β1/γ2
6.67Single7D7MDinoprostone7D7M-EP4-Dinoprostone-Gs/β1/γ1
6.67Single7QVMOxytocin7QVM-OT-Oxytocin-chim(NtGi1-Go-CtGq)/β1/γ2
6.67Single8XJKCloprosetnol8XJK-FP-alpha-Cloprosetnol-chim(NtGi1-Gs-CtGq)/β1/γ2
6.67Single8XJOU466198XJO-TP-U46619-chim(NtGi1-Gs-CtGq)/β1/γ2
6.67Consensusbeta1_onOrthosteric Ligand8DCR-β1-Dobutamine-Gs/β1/γ2 7S0F-β1-Isoprenaline-Gi1/β1/γ2
6.67Consensusbeta1_on_gpOrthosteric Ligand8DCR-β1-Dobutamine-Gs/β1/γ2 7S0F-β1-Isoprenaline-Gi1/β1/γ2
6.67Consensusfp-alpha_on_gpOrthosteric Ligand8IUK-FP-alpha-PGF2-α-chim(NtGi1-Gs-CtGq)/β1/γ2 8IUL-FP-alpha-Latanoprost-chim(NtGi1-Gs-CtGq)/β1/γ2 8IUM-FP-alpha-Tafluprost acid-chim(NtGi1-Gs-CtGq)/β1/γ2
6.67Consensusprostanoid_offOrthosteric Ligandep_off dp_off
6.67Consensusprostanoid_onOrthosteric Ligandtp_on fp-alpha_on
6.67Consensusprostanoid_on_gpOrthosteric Ligandtp_on_gp fp-alpha_on_gp
6.67Consensustp_onOrthosteric Ligand8XJO-TP-U46619-chim(NtGi1-Gs-CtGq)/β1/γ2
6.67Consensustp_on_gpOrthosteric Ligand8XJO-TP-U46619-chim(NtGi1-Gs-CtGq)/β1/γ2
6.25Single7CX2PGE27CX2-EP2-PGE2-Gs/β1/γ2
6.25Single7F2OBradykinin7F2O-BK2-Bradykinin-chim(NtGi1-Gs-CtGq)/β1/γ2
6.25Single8GDAL9026888GDA-EP4-L902688-Gs/β1/γ2
6.25Single8IQ4Carboprost8IQ4-FP-alpha-Carboprost-chim(NtGi1-Gs-CtGq)/β1/γ2
6.25Single8IUMTafluprost acid8IUM-FP-alpha-Tafluprost acid-chim(NtGi1-Gs-CtGq)/β1/γ2
5.88Single4AMJS-Carvedilol4AMJ-β1-S-Carvedilol
5.88Single7CX3Taprenepag7CX3-EP2-Taprenepag-Gs/β1/γ2
5.88Single8DCRDobutamine8DCR-β1-Dobutamine-Gs/β1/γ2
5.88Single8FYLVilazodone8FYL-5-HT1A-Vilazodone-Gi1/β1/γ1
5.00Single7AD3Alpha-factor mating pheromone7AD3-STE2-α-factor mating pheromone-Gi1/STE4/γ2
5.00Single7KH0AVP7KH0-V2-AVP-chim(NtGi1-Gs)/β1/γ2
4.76Single7F6HBradykinin7F6H-BK2-Bradykinin-Gq/β1/γ2
4.76Single7F6IKallidin7F6I-BK2-Kallidin-Gq/β1/γ2
4.76Single7QBIAlpha-factor mating pheromone7QBI-STE2-α-factor mating pheromone
4.55Single7QBIAlpha-factor mating pheromone7QBI-STE2-α-factor mating pheromone
4.35Single7AD3Alpha-factor mating pheromone7AD3-STE2-α-factor mating pheromone-Gi1/STE4/γ2
4.35Single7EIBDes-Arg10-Kallidin7EIB-BK1-Des-Arg10-Kallidin-chim(NtGi1-Gs-CtGq)/β1/γ2
4.17Consensusbk2_onOrthosteric Ligand7F6H-BK2-Bradykinin-Gq/β1/γ2 7F6I-BK2-Kallidin-Gq/β1/γ2
4.17Consensusbk2_on_gpOrthosteric Ligand7F6H-BK2-Bradykinin-Gq/β1/γ2 7F6I-BK2-Kallidin-Gq/β1/γ2
4.17Consensusbradykinin_onOrthosteric Ligandbk2_on
4.17Consensusbradykinin_on_gpOrthosteric Ligandbk2_on_gp
4.17Consensusgq_bradykininOrthosteric Ligand7F6H-BK2-Bradykinin-Gq/β1/γ2 7F6I-BK2-Kallidin-Gq/β1/γ2

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 R:R:L99 4.87 0 No No 4 7 1 2
R:R:F96 W:W:?2 9.36 0 No No 4 0 1 0
R:R:N100 W:W:?2 14.08 0 No No 8 0 1 0
R:R:F96 R:R:L95 1.22 0 No No 4 6 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
66.67Single8W8RAA-148W8R-GPR101-AA-14-chim(NtGi1-Gs)/β1/γ2
25.00Single8TLMAnti-murine CCR8 antibody8TLM-CCR8-Anti-murine CCR8 antibody
8.33Single8YICSAR2477998YIC-S1P1-SAR247799-Gi1/β1/γ2
8.33Single9IMATalquetamab9IMA-GPRC5D-Talquetamab
7.14Single7XBDGalanin7XBD-GAL2-Galanin-chim(NtGi2L-Gs-CtGq)/β1/γ2
7.14Single7XJLSpexin7XJL-GAL2-Spexin-chim(NtGi2L-Gs-CtGq)/β1/γ2
6.67Single4PY02MeSATP4PY0-P2Y12-2MeSATP
6.67Single7WQ4Galanin7WQ4-GAL2-Galanin-chim(NtGi1-Gs-CtGq)/β1/γ2
6.67Single7XJKGalanin7XJK-GAL2-Galanin-chim(NtGi2L-Gs-CtGq)/β1/γ2
6.67Single7XXI2MeSADP7XXI-P2Y12-2MeSADP-Gi2/β1/γ2
6.67Consensusgalanin_onOrthosteric Ligandgal2_on gal1_on
6.67Consensusgalanin_on_gpOrthosteric Ligandgal2_on_gp gal1_on_gp
6.67Consensusgi_p2yOrthosteric Ligand7XXI-P2Y12-2MeSADP-Gi2/β1/γ2
6.67Consensusp2y12_on_gpOrthosteric Ligand7XXI-P2Y12-2MeSADP-Gi2/β1/γ2
6.25Single8HN1Toxin AdTx18HN1-Alpha1A-Toxin AdTx1
6.25Single8XWVCXCL18XWV-CXCR2-CXCL1-Go/β1/γ2
6.25Consensusgal2_onOrthosteric Ligand7WQ4-GAL2-Galanin-chim(NtGi1-Gs-CtGq)/β1/γ2 7XJL-GAL2-Spexin-chim(NtGi2L-Gs-CtGq)/β1/γ2
6.25Consensusgal2_on_gpOrthosteric Ligand7WQ4-GAL2-Galanin-chim(NtGi1-Gs-CtGq)/β1/γ2 7XJL-GAL2-Spexin-chim(NtGi2L-Gs-CtGq)/β1/γ2
5.88Single5VBLApelin mimetic peptide agonist5VBL-Apelin-Apelin mimetic peptide agonist
5.88Consensuskiss1_onOrthosteric Ligand8ZJD-Kiss1-Kisspeptin-10-chim(NtGi1-Gq)/β1/γ1
5.88Consensuskisspeptin_onOrthosteric Ligandkiss1_on
5.56Single7F4ISHU91197F4I-MC1-SHU9119-chim(NtGi1-Gs)/β1/γ2
5.56Single8KIGSHU91198KIG-MC3-SHU9119-Ca
5.56Single8WKYPG-9348WKY-MC4-PG-934
5.56Single8ZJDKisspeptin-108ZJD-Kiss1-Kisspeptin-10-chim(NtGi1-Gq)/β1/γ1
5.56Consensusgq_kisspeptinOrthosteric Ligand8ZJD-Kiss1-Kisspeptin-10-chim(NtGi1-Gq)/β1/γ1
5.56Consensuskiss1_on_gpOrthosteric Ligand8ZJD-Kiss1-Kisspeptin-10-chim(NtGi1-Gq)/β1/γ1
5.56Consensuskisspeptin_on_gpOrthosteric Ligandkiss1_on_gp
5.26Single8IOCGamma-MSH8IOC-MC3-γ-MSH-Ca-chim(NtGi1-Gs)/β1/γ2
5.26Single9EAINanobody AT2099EAI-AT1-Losartan-Nanobody AT209
5.26Consensusmc5_onOrthosteric Ligand8INR-MC5-α-MSH-Ca-chim(NtGi1-Gs)/β1/γ2 8IOD-MC5-PG-901-Ca-chim(NtGi1-Gs)/β1/γ2
5.00Single7F4DAlpha-MSH7F4D-MC1-α-MSH-chim(NtGi1-Gs)/β1/γ2
5.00Consensusmc3_onOrthosteric Ligand8IOC-MC3-γ-MSH-Ca-chim(NtGi1-Gs)/β1/γ2
5.00Consensusmc3_on_gpOrthosteric Ligand8IOC-MC3-γ-MSH-Ca-chim(NtGi1-Gs)/β1/γ2
4.76Single7DW9AVP7DW9-V2-AVP-chim(NtGi1-Gs)/β1/γ2
4.76Single7F4HAfamelanotide7F4H-MC1-Afamelanotide-chim(NtGi1-Gs)/β1/γ2
4.76Single7XK8Neuromedin-U-257XK8-NMUR2-Neuromedin-U-25-Gi1/β1/γ2
4.76Consensusgs_vasop-oxyOrthosteric Ligand7DW9-V2-AVP-chim(NtGi1-Gs)/β1/γ2
4.76Consensusmc5_on_gpOrthosteric Ligand8INR-MC5-α-MSH-Ca-chim(NtGi1-Gs)/β1/γ2 8IOD-MC5-PG-901-Ca-chim(NtGi1-Gs)/β1/γ2
4.76Consensusv2_onOrthosteric Ligand7DW9-V2-AVP-chim(NtGi1-Gs)/β1/γ2
4.76Consensusv2_on_gpOrthosteric Ligand7DW9-V2-AVP-chim(NtGi1-Gs)/β1/γ2
4.76Consensusvasop-oxy_onOrthosteric Ligandv2_on
4.76Consensusvasop-oxy_on_gpOrthosteric Ligandv2_on_gp
4.55Single8IODPG-9018IOD-MC5-PG-901-Ca-chim(NtGi1-Gs)/β1/γ2
4.55Single8XGOTAK4488XGO-Kiss1-TAK448-chim(NtGi1-Gq)/β1/γ2
4.55Consensusmc1_onOrthosteric Ligand7F4H-MC1-Afamelanotide-chim(NtGi1-Gs)/β1/γ2 7F4D-MC1-α-MSH-chim(NtGi1-Gs)/β1/γ2 7F4I-MC1-SHU9119-chim(NtGi1-Gs)/β1/γ2
4.55Consensusmc1_on_gpOrthosteric Ligand7F4H-MC1-Afamelanotide-chim(NtGi1-Gs)/β1/γ2 7F4D-MC1-α-MSH-chim(NtGi1-Gs)/β1/γ2 7F4I-MC1-SHU9119-chim(NtGi1-Gs)/β1/γ2
4.17Single7F53Alpha-MSH7F53-MC4-α-MSH-Gs/β1/γ2
4.17Single8ZJGChemerin8ZJG-CML1-Chemerin-Gi1/β1/γ2
4.00Single8Y52BA18Y52-BB3-BA1-chim(NtGi1-Gs-CtGq)/β1/γ2
4.00Consensusetb_onOrthosteric Ligand8IY5-ETB-Endothelin-1-Gi1/β1/γ2 8HBD-ETB-IRL1620-Gi1/β1/γ2
4.00Consensusgs_melanocortinOrthosteric Ligand7F4H-MC1-Afamelanotide-chim(NtGi1-Gs)/β1/γ2 7F54-MC4-Afamelanotide-Gs/β1/γ2 7F4D-MC1-α-MSH-chim(NtGi1-Gs)/β1/γ2 8INR-MC5-α-MSH-Ca-chim(NtGi1-Gs)/β1/γ2 7F53-MC4-α-MSH-Gs/β1/γ2 7F55-MC4-Bremelanotide-Gs/β1/γ2 8GY7-MC2-Corticotropin-Ca-chim(NtGi1-Gs)/β1/γ2; MRAP1 8IOC-MC3-γ-MSH-Ca-chim(NtGi1-Gs)/β1/γ2 8IOD-MC5-PG-901-Ca-chim(NtGi1-Gs)/β1/γ2 7AUE-MC4-Setmelanotide-chim(NtGi1L-Gs)/β1/γ2 7F4I-MC1-SHU9119-chim(NtGi1-Gs)/β1/γ2 7F58-MC4-THIQ-Gs/β1/γ2
3.85Single8ZJETAK-4488ZJE-Kiss1-TAK-448-chim(NtGi1-Gq)/β1/γ1
3.70Single8HBDIRL16208HBD-ETB-IRL1620-Gi1/β1/γ2
3.70Consensusetb_on_gpOrthosteric Ligand8IY5-ETB-Endothelin-1-Gi1/β1/γ2 8HBD-ETB-IRL1620-Gi1/β1/γ2
3.70Consensusmelanocortin_onOrthosteric Ligandmc1_on mc4_on mc2_on mc3_on mc5_on
3.70Consensusmelanocortin_on_gpOrthosteric Ligandmc1_on_gp mc4_on_gp mc2_on_gp mc3_on_gp mc5_on_gp
3.57Single6LRYSarafotoxin-B6LRY-ETB-Sarafotoxin-B
3.23Consensusmc2_onOrthosteric Ligand8GY7-MC2-Corticotropin-Ca-chim(NtGi1-Gs)/β1/γ2; MRAP1
3.23Consensusmc2_on_gpOrthosteric Ligand8GY7-MC2-Corticotropin-Ca-chim(NtGi1-Gs)/β1/γ2; MRAP1

PDB Summary
PDB 8W8S
Class A
SubFamily Orphan
Type Orphan
SubType GPR101
Species Homo Sapiens
Ligand -
Other Ligand(s) AA-14
Protein Partners -
PDB Resolution 3.3
Date 2024-01-03
D.O.I. 10.1038/s41589-023-01456-6
Net Summary
Imin 1.62
Number of Linked Nodes 252
Number of Links 269
Number of Hubs 32
Number of Links mediated by Hubs 117
Number of Communities 11
Number of Nodes involved in Communities 40
Number of Links involved in Communities 45
Path Summary
Number Of Nodes in MetaPath 82
Number Of Links MetaPath 81
Number of Shortest Paths 32598
Length Of Smallest Path 3
Average Path Length 13.9211
Length of Longest Path 34
Minimum Path Strength 1.23
Average Path Strength 3.82664
Maximum Path Strength 20.345
Minimum Path Correlation 0.7
Average Path Correlation 0.927595
Maximum Path Correlation 0.99
Minimum % Of Corr. Nodes 3.22581
Average % Of Corr. Nodes 54.169
Maximum % Of Corr. Nodes 100
Minimum Path Hubs % 0
Average Path Hubs % 36.7456
Maximum Path Hubs % 100
AnnotationTypeLinks
Gene OntologyMolecular Function
Gene OntologyBiological Process• cellular response to stimulus   • positive regulation of cell communication   • regulation of cellular process   • positive regulation of signal transduction   • response to stimulus   • signaling   • positive regulation of biological process   • regulation of signal transduction   • intracellular signal transduction   • cell communication   • positive regulation of response to stimulus   • regulation of intracellular signal transduction   • intracellular signaling cassette   • signal transduction   • positive regulation of cellular process   • regulation of biological process   • regulation of signaling   • positive regulation of MAPK cascade   • biological regulation   • positive regulation of intracellular signal transduction   • regulation of MAPK cascade   • regulation of response to stimulus   • MAPK cascade   • regulation of cell communication   • cellular process   • positive regulation of signaling   • adenylate cyclase-activating adrenergic receptor signaling pathway   • adenylate cyclase-activating G protein-coupled receptor signaling pathway   • adrenergic receptor signaling pathway   • adenylate cyclase-modulating G protein-coupled receptor signaling pathway   • G protein-coupled receptor signaling pathway   • protein-containing complex   • receptor complex   • cell periphery   • cellular anatomical structure   • plasma membrane   • membrane
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
Identifier
FormulaC14 H12 F3 N3 S
Molecular Weight311.325
SMILES
PubChem848971
Formal Charge0
Total Atoms33
Total Chiral Atoms0
Total Bonds34
Total Aromatic Bonds12

PDBsumOpen PDBsum Page
ChainR
ProteinReceptor
UniProtQ96P66
Sequence
>8W8S_Chain_R
SLAHGIIRS TVLVIFLAA SFVGNIVLA LVLQRKPQL LQVTNRFIF 
NLLVTDLLQ ISLVAPWVV ATSVPLFWP LNSHFCTAL VSLTHLFAF 
ASVNTIVVV SVDRYLSII HPLSYPSKM TQRRGYLLL YGTWIVAIL 
QSTPPLYGW GQAAFDERN ALCSMIWGA SPSYTILSV VSFIVIPLI 
VMIACYSVV FCAARRQHA LLYNCKAAK VIFIIIFSY VLSLGPYCF 
LAVLAVWVD VETQVPQWV ITIIIWLFF LQCCIHPYV YGYMHKTIK 
KEIQDMLKK FF


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
8W8SAOrphanOrphanGPR101Homo sapiens-AA-14-3.32024-01-0310.1038/s41589-023-01456-6
8W8RAOrphanOrphanGPR101Homo sapiens-AA-14chim(NtGi1-Gs)/β1/γ23.32024-01-0310.1038/s41589-023-01456-6
8W8QAOrphanOrphanGPR101Homo sapiens--Gs/β1/γ22.892024-01-0310.1038/s41589-023-01456-6




You can download a compressed (zip) file with structure(s), 3D outputs (as PyMol and VMD scripts) and numerical data files (as csv and plain text files).

Download 8W8S.zip



You can click to copy the link of this page to easily come back here later

or use this QR code to link and share this page.



You can also  read or  download a guide explaining the meaning of all files and numerical data.