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]
1GRM2_HUMAN32 99% 0.550 PF07562 C1_S147 - (0)20 - / 7 / 23 10
2GRM6_HUMAN30 66% 0.493 PF07562 C1_S143 - (0)20 - / 4 / 20 10
3GRM4_HUMAN28 68% 0.539 PF07562 C1_S144 - (0)19 - / 4 / 18 10
4GRM7_HUMAN25 99% 0.569 PF07562 C1_S144 - (0)19 - / 3 / 19 10
5GRM8_HUMAN32 71% 0.523 PF07562 C2_S145 - (0)20 - / 4 / 21 10
6GRM3_HUMAN35 99% 0.507 PF07562 C1_S137 - (0)17 - / 6 / 18 9
7GABR1_HUMAN20 100% 0.579 PF01094 C3_S132 - (0)8 - / 2 / 6 8
8GRM1_HUMAN26 99% 0.555 PF07562 C1_S135 - (0)11 - / 3 / 10 7
9GRM5_HUMAN27 99% 0.555 PF07562 C1_S137 - (0)11 - / 3 / 10 7
10CASR_HUMAN24 35% 0.459 PF07562 C2_S137 - (0)15 - / - / 13 6
11ACM1_HUMAN20 63% 0.264 PF00001 C3_S143 - (0)6 - / 7 / - 3
12ACM4_HUMAN20 84% 0.218 PF00001 C5_S155 - (0)5 - / 6 / - 3
13OPRK_HUMAN20 98% 0.361 PF00001 C2_S157 - (0)4 - / 3 / 5 2
14CALCR_HUMAN9 65% 0.408 PF02793 C4_S17 - (0)3 - / 3 / - 2
15ACM5_HUMAN20 78% 0.220 PF00001 C2_S147 - (0)1 - / 1 / - 1
16OPRD_HUMAN20 100% 0.402 PF00001 C2_S147 - (0)1 - / 3 / - 1
17OPRX_HUMAN20 98% 0.393 PF00001 C3_S160 - (0)2 - / 3 / 1 1
18ADRB1_HUMAN32 86% 0.414 PF00001 C3_S1191 - (0)7 - / 6 / 16 1
19CCR1_HUMAN20 48% 0.353 PF00001 C2_S162 - (0)2 2 / - / - 1
20CCR5_HUMAN20 85% 0.306 PF00001 C2_S154 - (0)2 2 / - / - 1
21P2RY1_HUMAN20 97% 0.236 PF00001 C1_S152 - (0)2 - / 2 / 1 1
22S1PR4_HUMAN19 41% 0.321 PF00001 C5_S132 - (0)? - / - / 1 0
23GPR26_HUMAN10 29% 0.256 PF00001 74 - (0)? - / - / - 0
24AGRF5_HUMAN16 34% 0.252 PF07686 20 - (0)? - / - / - 0
25O10S1_HUMAN13 40% 0.251 PF00001 52 - (0)? - / - / - 0
26O52L2_HUMAN12 28% 0.256 PF00001 42 - (0)? - / - / - 0
275HT1B_HUMAN22 76% 0.281 PF00001 C5_S1174 - (0)3 - / 2 / 1 0
28AGRL1_HUMAN15 97% 0.609 PF02793 2 - (0)1 - / - / - 0
29OR1L4_HUMAN5 34% 0.222 PF00001 84 - (0)? - / - / - 0
30OR6C2_HUMAN4 34% 0.276 PF10413 30 - (0)? - / - / - 0
31OR8K1_HUMAN13 31% 0.300 PF00001 33 - (0)? - / - / - 0
32CELR2_HUMAN10 32% 0.367 PF08758 0 - (0)? - / - / - 0
33O13A1_HUMAN11 38% 0.289 PF00001 43 - (0)? - / - / - 0
34CXCR4_HUMAN20 99% 0.277 PF00001 C5_S155 - (0)? - / - / 2 0
35AGRE2_HUMAN18 86% 0.354 PF00084 1 - (0)? - / - / - 0
36GP161_HUMAN20 32% 0.336 PF00001 111 - (0)? - / - / - 0
37NK1R_HUMAN20 100% 0.245 PF00001 52 - (0)? - / - / - 0
38GRPR_HUMAN20 36% 0.216 PF00001 39 - (0)? - / - / - 0
39OR7AH_HUMAN11 33% 0.226 PF00001 40 - (0)? - / - / - 0
40TA2R4_HUMAN11 28% 0.165 PF00001 10 - (0)? - / - / - 0
41ACM3_HUMAN20 98% 0.237 PF00001 83 - (0)? - / - / - 0
42O10AD_HUMAN8 41% 0.195 PF00001 45 - (0)? - / - / - 0
43GP179_HUMAN1 38% 0.509 PF00001 8 - (0)? - / - / - 0
44O11G2_HUMAN13 38% 0.235 PF00001 35 - (0)? - / - / - 0
45O5AK2_HUMAN12 27% 0.261 PF00001 35 - (0)? - / - / - 0
46FFAR2_HUMAN11 33% 0.268 PF00001 42 - (0)? - / - / - 0
47NMUR2_HUMAN20 35% 0.372 PF00001 68 - (0)? - / - / - 0
48OR8G5_HUMAN11 31% 0.273 PF00001 36 - (0)? - / - / - 0
49O51B2_HUMAN11 33% 0.290 PF00001 36 - (0)? - / - / - 0
50PE2R3_HUMAN14 32% 0.338 PF00001 42 - (0)? - / - / - 0

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