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]
50OPN4_HUMAN20 42% 0.404 PF10413 81 - (0)? - / - / - 0
51AA2BR_HUMAN33 63% 0.403 PF00001 C2_S1261 - (0)6 - / - / 3 0
52AGRB3_HUMAN9 64% 0.402 PF00090 13 - (0)? - / - / - 0
53OPRD_HUMAN20 100% 0.402 PF00001 C2_S147 - (0)1 - / 3 / - 1
54NPBW1_HUMAN20 39% 0.400 PF00001 71 - (0)? - / - / - 0
55SSR3_HUMAN20 43% 0.398 PF00001 43 - (0)? - / - / - 0
56S1PR5_HUMAN10 51% 0.395 PF00001 C4_S136 - (0)? - / - / 1 0
57OX1R_HUMAN20 74% 0.395 PF00001 60 - (0)? - / - / - 0
58CELR3_HUMAN10 34% 0.394 PF08758 0 - (0)? - / - / - 0
59ADRB2_HUMAN37 90% 0.393 PF00001 C3_S1220 - (0)7 - / 8 / 17 0
60O52N5_HUMAN12 34% 0.393 PF00001 35 - (0)? - / - / - 0
61OPRX_HUMAN20 98% 0.393 PF00001 C3_S160 - (0)2 - / 3 / 1 1
62O52K1_HUMAN9 33% 0.390 PF00001 53 - (0)? - / - / - 0
63GPC6A_HUMAN20 37% 0.389 PF07562 26 - (0)? - / - / - 0
64LGR6_HUMAN19 62% 0.388 PF01462 29 - (0)? - / - / - 0
65AGRD1_HUMAN11 32% 0.387 PF07952 4 - (0)? - / - / - 0
66MC5R_HUMAN20 40% 0.387 PF00001 88 - (0)2 - / - / - 0
67AGRA3_HUMAN16 46% 0.387 PF01462 21 - (0)? - / - / - 0
68PE2R2_HUMAN13 29% 0.386 PF00001 85 - (0)? - / - / - 0
69GPR25_HUMAN20 34% 0.384 PF00001 55 - (0)? - / - / - 0
70SSR1_HUMAN20 47% 0.384 PF00001 C5_S175 - (0)1 - / - / 1 0
71AA1R_HUMAN28 53% 0.383 PF00001 C5_S1223 - (0)6 - / - / 7 0
72OR8K3_HUMAN12 33% 0.382 PF00001 65 - (0)? - / - / - 0
73UR2R_HUMAN19 34% 0.380 PF00001 64 - (0)? - / - / - 0
74AGRF3_HUMAN5 27% 0.380 PF07654 11 - (0)? - / - / - 0
75O52K2_HUMAN10 35% 0.377 PF00001 42 - (0)? - / - / - 0
76TA2R_HUMAN8 34% 0.375 PF00001 107 - (0)? - / - / - 0
77GPR98_HUMAN11 38% 0.373 PF01699 0 - (0)? - / - / - 0
78NMUR2_HUMAN20 35% 0.372 PF00001 68 - (0)? - / - / - 0
79OR9K2_HUMAN13 36% 0.371 PF00001 39 - (0)? - / - / - 0
80OPSR_HUMAN21 42% 0.370 PF10413 C10_S124 - (0)5 - / - / 3 0
81GHSR_HUMAN20 37% 0.370 PF00001 77 - (0)1 - / - / - 0
82OR2M4_HUMAN4 57% 0.370 PF10413 C1_S141 - (0)? - / - / 1 0
83OR5B3_HUMAN9 42% 0.369 PF00001 33 - (0)? - / - / - 0
84CCR10_HUMAN20 38% 0.369 PF00001 65 - (0)? - / - / - 0
85ADA2B_HUMAN20 53% 0.368 PF00001 114 - (0)? - / - / - 0
86OR2A7_HUMAN9 38% 0.368 PF00001 49 - (0)? - / - / - 0
87CCR4_HUMAN20 43% 0.368 PF00001 63 - (0)2 - / - / - 0
88CD97_HUMAN18 85% 0.367 PF00084 1 - (0)? - / - / - 0
89CELR1_HUMAN9 32% 0.367 PF08758 0 - (0)? - / - / - 0
90CELR2_HUMAN10 32% 0.367 PF08758 0 - (0)? - / - / - 0
91OR8U9_HUMAN14 39% 0.367 PF00001 41 - (0)? - / - / - 0
92FFAR1_HUMAN13 98% 0.366 PF10413 80 - (0)? - / - / - 0
93OPRM_HUMAN20 97% 0.365 PF00001 C3_S150 - (0)3 - / 1 / 2 0
94O2T34_HUMAN4 43% 0.365 PF10413 45 - (0)? - / - / - 0
95OR8H2_HUMAN7 33% 0.364 PF00001 44 - (0)? - / - / - 0
96O51B5_HUMAN9 30% 0.363 PF00001 36 - (0)? - / - / - 0
97ACKR2_HUMAN20 39% 0.363 PF00001 48 - (0)? - / - / - 0
98O52B2_HUMAN11 33% 0.362 PF00001 38 - (0)? - / - / - 0
99O51S1_HUMAN7 30% 0.362 PF00001 36 - (0)? - / - / - 0
100OPRK_HUMAN20 98% 0.361 PF00001 C2_S157 - (0)4 - / 3 / 5 2

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