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]
1GRM8_HUMAN32 71% 0.523 PF07562 C2_S145 - (0)20 - / 4 / 21 10
2GRM4_HUMAN28 68% 0.539 PF07562 C1_S144 - (0)19 - / 4 / 18 10
3GRM6_HUMAN30 66% 0.493 PF07562 C1_S143 - (0)20 - / 4 / 20 10
4GRM2_HUMAN32 99% 0.550 PF07562 C1_S147 - (0)20 - / 7 / 23 10
5GRM7_HUMAN25 99% 0.569 PF07562 C1_S144 - (0)19 - / 3 / 19 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
11ACM4_HUMAN20 84% 0.218 PF00001 C5_S155 - (0)5 - / 6 / - 3
12ACM1_HUMAN20 63% 0.264 PF00001 C3_S143 - (0)6 - / 7 / - 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
15OPRD_HUMAN20 100% 0.402 PF00001 C2_S147 - (0)1 - / 3 / - 1
16P2RY1_HUMAN20 97% 0.236 PF00001 C1_S152 - (0)2 - / 2 / 1 1
17CCR5_HUMAN20 85% 0.306 PF00001 C2_S154 - (0)2 2 / - / - 1
18OPRX_HUMAN20 98% 0.393 PF00001 C3_S160 - (0)2 - / 3 / 1 1
19ACM5_HUMAN20 78% 0.220 PF00001 C2_S147 - (0)1 - / 1 / - 1
20ADRB1_HUMAN32 86% 0.414 PF00001 C3_S1191 - (0)7 - / 6 / 16 1
21CCR1_HUMAN20 48% 0.353 PF00001 C2_S162 - (0)2 2 / - / - 1
22O52A4_HUMAN11 32% 0.044 PF00001 39 - (0)? - / - / - 0
23S1PR2_HUMAN20 54% 0.257 PF00001 C3_S138 - (0)? - / - / 1 0
24OPSR_HUMAN21 42% 0.370 PF10413 C10_S124 - (0)5 - / - / 3 0
25O52E8_HUMAN2 41% 0.267 PF00001 74 - (0)? - / - / - 0
26SSR4_HUMAN20 47% 0.414 PF00001 C6_S1223 - (0)5 - / - / 4 0
27O5AP2_HUMAN5 40% 0.301 PF00001 35 - (0)? - / - / - 0
28OR2B6_HUMAN5 27% 0.255 PF10413 37 - (0)? - / - / - 0
29TAAR3_HUMAN20 50% 0.301 PF00001 74 - (0)? - / - / - 0
30O52L1_HUMAN11 29% 0.299 PF00001 45 - (0)? - / - / - 0
31PE2R3_HUMAN14 32% 0.338 PF00001 42 - (0)? - / - / - 0
32O14K1_HUMAN5 47% 0.284 PF00001 69 - (0)? - / - / - 0
33SMO_HUMAN16 100% 0.319 PF01392 C1_S113 - (0)2 1 / - / - 0
34O10G7_HUMAN7 34% 0.269 PF00001 42 - (0)? - / - / - 0
35GP158_HUMAN0 26% 0.146 PF00066 1 - (0)? - / - / - 0
36OR1M1_HUMAN4 35% 0.298 PF00001 39 - (0)? - / - / - 0
37GP146_HUMAN10 45% 0.272 PF00001 32 - (0)? - / - / - 0
38OR5G3_HUMAN13 35% 0.305 PF00001 27 - (0)? - / - / - 0
39O4C46_HUMAN13 29% 0.247 PF00001 18 - (0)? - / - / - 0
40O10A3_HUMAN6 27% 0.271 PF00001 34 - (0)? - / - / - 0
41VN1R2_HUMAN11 35% 0.189 PF00001 12 - (0)? - / - / - 0
42O52A5_HUMAN5 31% 0.269 PF00001 57 - (0)? - / - / - 0
43ACKR4_HUMAN20 36% 0.209 PF00001 72 - (0)1 - / - / - 0
44CRFR2_HUMAN13 100% 0.442 PF02793 C4_S122 - (0)? - / 1 / 9 0
45GPR22_HUMAN9 38% 0.208 PF00001 37 - (0)? - / - / - 0
46TA2R4_HUMAN11 28% 0.165 PF00001 10 - (0)? - / - / - 0
47OR2T1_HUMAN13 63% 0.307 PF00001 35 - (0)? - / - / - 0
48O13C4_HUMAN6 59% 0.302 PF00001 32 - (0)? - / - / - 0
49OR1J1_HUMAN6 37% 0.222 PF00001 46 - (0)? - / - / - 0
50O52L2_HUMAN12 28% 0.256 PF00001 42 - (0)? - / - / - 0

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