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]
1GABR1_HUMAN20 100% 0.579 PF01094 C3_S132 - (0)8 - / 2 / 6 8
2OX2R_HUMAN20 100% 0.299 PF00001 93 - (0)? - / - / - 0
3CRFR1_HUMAN12 100% 0.418 PF02793 C4_S110 - (0)? - / 1 / 8 0
4NK1R_HUMAN20 100% 0.245 PF00001 52 - (0)? - / - / - 0
5LGR4_HUMAN19 100% 0.407 PF01462 23 - (0)? - / - / - 0
6GABR2_HUMAN20 100% 0.488 PF07562 48 - (0)? - / - / - 0
7LPAR1_HUMAN20 100% 0.290 PF00001 27 - (0)? - / - / - 0
8CXCR1_HUMAN20 100% 0.227 PF00001 69 - (0)2 - / - / - 0
9P2Y12_HUMAN19 100% 0.290 PF00001 67 - (0)? - / - / - 0
10FZD4_HUMAN16 100% 0.551 PF01392 12 - (0)2 - / - / - 0
11OPRD_HUMAN20 100% 0.402 PF00001 C2_S147 - (0)1 - / 3 / - 1
12CRFR2_HUMAN13 100% 0.442 PF02793 C4_S122 - (0)? - / 1 / 9 0
13LGR5_HUMAN19 100% 0.446 PF01462 24 - (0)4 - / - / - 0
14AGRL3_HUMAN23 100% 0.534 PF02140 C2_S113 - (0)1 1 / - / 3 0
15FZD8_HUMAN14 100% 0.566 PF01392 13 - (0)? - / - / - 0
16GLP1R_HUMAN8 100% 0.622 PF02793 C5_S116 - (0)? - / 1 / - 0
17DRD3_HUMAN12 100% 0.299 PF00001 126 - (0)? - / - / - 0
18SMO_HUMAN16 100% 0.319 PF01392 C1_S113 - (0)2 1 / - / - 0
19CXCR4_HUMAN20 99% 0.277 PF00001 C5_S155 - (0)? - / - / 2 0
20GLR_HUMAN10 99% 0.321 PF00001 C3_S116 - (0)2 - / 1 / 1 0
21GRM1_HUMAN26 99% 0.555 PF07562 C1_S135 - (0)11 - / 3 / 10 7
22GRM7_HUMAN25 99% 0.569 PF07562 C1_S144 - (0)19 - / 3 / 19 10
23GRM5_HUMAN27 99% 0.555 PF07562 C1_S137 - (0)11 - / 3 / 10 7
24GRM2_HUMAN32 99% 0.550 PF07562 C1_S147 - (0)20 - / 7 / 23 10
25GRM3_HUMAN35 99% 0.507 PF07562 C1_S137 - (0)17 - / 6 / 18 9
26AA2AR_HUMAN31 99% 0.413 PF00001 C5_S1193 - (0)8 - / - / 4 0
27S1PR1_HUMAN20 99% 0.284 PF00001 C2_S140 - (0)? - / 1 / - 0
28FFAR1_HUMAN13 98% 0.366 PF10413 80 - (0)? - / - / - 0
29ACM3_HUMAN20 98% 0.237 PF00001 83 - (0)? - / - / - 0
30OPRK_HUMAN20 98% 0.361 PF00001 C2_S157 - (0)4 - / 3 / 5 2
31OPRX_HUMAN20 98% 0.393 PF00001 C3_S160 - (0)2 - / 3 / 1 1
32OPRM_HUMAN20 97% 0.365 PF00001 C3_S150 - (0)3 - / 1 / 2 0
33AGRL1_HUMAN15 97% 0.609 PF02793 2 - (0)1 - / - / - 0
34ACM2_HUMAN19 97% 0.222 PF00001 C9_S1106 - (0)1 - / - / 1 0
35P2RY1_HUMAN20 97% 0.236 PF00001 C1_S152 - (0)2 - / 2 / 1 1
36HRH1_HUMAN20 96% 0.204 PF00001 134 - (0)? - / - / - 0
37GHRHR_HUMAN6 96% 0.408 PF02793 20 - (0)? - / - / - 0
38CNR1_HUMAN20 95% 0.245 PF00001 84 - (0)? - / - / - 0
39V2R_HUMAN13 93% 0.307 PF10413 72 - (0)? - / - / - 0
40OPSD_HUMAN26 93% 0.359 PF10413 C8_S124 - (0)5 - / - / 3 0
41ADRB2_HUMAN37 90% 0.393 PF00001 C3_S1220 - (0)7 - / 8 / 17 0
42NTR1_HUMAN20 90% 0.476 PF00001 75 - (0)2 - / - / - 0
43CXCR2_HUMAN20 87% 0.267 PF00001 71 - (0)1 - / - / - 0
44ADRB1_HUMAN32 86% 0.414 PF00001 C3_S1191 - (0)7 - / 6 / 16 1
45AGRL2_HUMAN20 86% 0.526 PF02140 C1_S113 - (0)1 1 / - / 3 0
46AGRE2_HUMAN18 86% 0.354 PF00084 1 - (0)? - / - / - 0
47CCR5_HUMAN20 85% 0.306 PF00001 C2_S154 - (0)2 2 / - / - 1
48CD97_HUMAN18 85% 0.367 PF00084 1 - (0)? - / - / - 0
49ACM4_HUMAN20 84% 0.218 PF00001 C5_S155 - (0)5 - / 6 / - 3
50FZD5_HUMAN21 83% 0.220 PF01392 C2_S113 - (0)3 - / - / 3 0

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