Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
GPCR_HUMAN_201601 (GPCR_HUMAN - Jan 2016)

Download : Data.csv | 3D Models


Tab legend :
    Full name of ligand selected in the comparative docking column:

    General color information : Quality: [ Good | Correct | Uncertain ]
QueryStructural Alignment (SA)3D Modeling AnnotationLigands from PDB templatesPredicted Complexes - pKd:[ ‹nMol | ‹μMol | ‹mMol ]




Query Sequence
Filter:
Significants
SA found
Seq Ident. 3D Core
(QMean Score)
Classification code

Binding Site Ligands Found
(Procognate)
Profile Complexes by comparative docking
(ligands from PDB templates)

Targets
for screening


Sort by entries

[Nb of SA]
[Best Ident]
[Best Score]
Main Code
[Name]
[Number]
[Number]
Distribution of CDocking pKd
[Number]
15HT1A_HUMAN20 41% 0.285 PF00001 C4_S1145 - (0)2 - / - / 2 0
25HT1B_HUMAN22 76% 0.281 PF00001 C5_S1174 - (0)3 - / 2 / 1 0
35HT1D_HUMAN26 55% 0.281 PF00001 C4_S1198 - (0)6 - / - / 4 0
45HT1E_HUMAN23 44% 0.271 PF00001 C5_S1124 - (0)5 - / - / 2 0
55HT1F_HUMAN20 46% 0.342 PF00001 161 - (0)? - / - / - 0
65HT2A_HUMAN30 57% 0.356 PF00001 C6_S1185 - (0)7 - / - / 6 0
75HT2B_HUMAN21 77% 0.333 PF00001 127 - (0)1 - / - / - 0
85HT2C_HUMAN36 47% 0.356 PF00001 C4_S1220 - (0)8 - / 1 / 16 0
95HT4R_HUMAN24 40% 0.325 PF00001 C4_S1263 - (0)4 - / - / 4 0
105HT5A_HUMAN20 56% 0.350 PF00001 84 - (0)? - / - / - 0
115HT6R_HUMAN25 35% 0.343 PF00001 C5_S1167 - (0)2 - / - / 3 0
125HT7R_HUMAN24 38% 0.314 PF00001 C5_S1230 - (0)5 - / - / 2 0
13AA1R_HUMAN28 53% 0.383 PF00001 C5_S1223 - (0)6 - / - / 7 0
14AA2AR_HUMAN31 99% 0.413 PF00001 C5_S1193 - (0)8 - / - / 4 0
15AA2BR_HUMAN33 63% 0.403 PF00001 C2_S1261 - (0)6 - / - / 3 0
16AA3R_HUMAN20 43% 0.351 PF00001 C2_S171 - (0)1 - / - / 1 0
17ACKR1_HUMAN9 37% 0.170 PF00001 14 - (0)? - / - / - 0
18ACKR2_HUMAN20 39% 0.363 PF00001 48 - (0)? - / - / - 0
19ACKR3_HUMAN19 42% 0.269 PF00001 62 - (0)? - / - / - 0
20ACKR4_HUMAN20 36% 0.209 PF00001 72 - (0)1 - / - / - 0
21ACM1_HUMAN20 63% 0.264 PF00001 C3_S143 - (0)6 - / 7 / - 3
22ACM2_HUMAN19 97% 0.222 PF00001 C9_S1106 - (0)1 - / - / 1 0
23ACM3_HUMAN20 98% 0.237 PF00001 83 - (0)? - / - / - 0
24ACM4_HUMAN20 84% 0.218 PF00001 C5_S155 - (0)5 - / 6 / - 3
25ACM5_HUMAN20 78% 0.220 PF00001 C2_S147 - (0)1 - / 1 / - 1
26ACTHR_HUMAN20 46% 0.345 PF00001 82 - (0)2 - / - / - 0
27ADA1A_HUMAN26 37% 0.330 PF00001 C5_S1162 - (0)6 - / - / 2 0
28ADA1B_HUMAN27 36% 0.322 PF00001 C7_S1224 - (0)7 - / - / 3 0
29ADA1D_HUMAN20 39% 0.245 PF00001 235 - (0)1 - / - / - 0
30ADA2A_HUMAN20 42% 0.320 PF00001 136 - (0)? - / - / - 0
31ADA2B_HUMAN20 53% 0.368 PF00001 114 - (0)? - / - / - 0
32ADA2C_HUMAN20 42% 0.239 PF00001 97 - (0)? - / - / - 0
33ADRB1_HUMAN32 86% 0.414 PF00001 C3_S1191 - (0)7 - / 6 / 16 1
34ADRB2_HUMAN37 90% 0.393 PF00001 C3_S1220 - (0)7 - / 8 / 17 0
35ADRB3_HUMAN32 80% 0.322 PF00001 C3_S1285 - (0)10 - / - / 21 0
36AGRA1_HUMAN11 28% 0.068 PF00001 14 - (0)? - / - / - 0
37AGRA3_HUMAN16 46% 0.387 PF01462 21 - (0)? - / - / - 0
38AGRB2_HUMAN8 55% 0.353 PF00090 9 - (0)1 - / - / - 0
39AGRB3_HUMAN9 64% 0.402 PF00090 13 - (0)? - / - / - 0
40AGRD1_HUMAN11 32% 0.387 PF07952 4 - (0)? - / - / - 0
41AGRD2_HUMAN8 29% 0.417 PF07952 12 - (0)? - / - / - 0
42AGRE1_HUMAN6 44% 0.410 PF00084 6 - (0)? - / - / - 0
43AGRE2_HUMAN18 86% 0.354 PF00084 1 - (0)? - / - / - 0
44AGRE3_HUMAN7 51% 0.501 PF00089 0 - (0)? - / - / - 0
45AGRE4_HUMAN11 26% 0.122 PF00001 12 - (0)? - / - / - 0
46AGRF1_HUMAN8 37% 0.349 PF00001 11 - (0)? - / - / - 0
47AGRF2_HUMAN12 30% 0.287 PF00001 13 - (0)? - / - / - 0
48AGRF3_HUMAN5 27% 0.380 PF07654 11 - (0)? - / - / - 0
49AGRF4_HUMAN5 47% 0.142 PF00001 8 - (0)? - / - / - 0
50AGRF5_HUMAN16 34% 0.252 PF07686 20 - (0)? - / - / - 0

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