Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
KINOME_2015 (Oct 2015)

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]
1AAK1_HUMAN6 100% 0.518 PF00069 C1_S126 - (7)17 2 / 2 / 12 6
2AAPK1_HUMAN83 99% 0.428 PF00069 C4_S1102 - (13)20 2 / 17 / 6 9
3AAPK2_HUMAN82 100% 0.453 PF00069 C4_S1105 - (14)20 2 / 10 / 8 5
4ABL1_HUMAN34 100% 0.827 PF00018 C3_S134 - (4)20 23 / 11 / - 12
5ABL2_HUMAN96 100% 0.861 PF00018 C4_S1101 - (11)20 52 / 35 / 9 29
6ACK1_HUMAN50 100% 0.495 PF01030 C3_S198 - (26)20 10 / 19 / 22 20
7ACV1B_HUMAN35 90% 0.551 PF08515 C1_S163 - (2)20 1 / 22 / 13 16
8ACV1C_HUMAN36 83% 0.449 PF08515 C2_S155 - (0)20 2 / 23 / 12 18
9ACVL1_HUMAN35 99% 0.547 PF08515 C1_S153 - (2)20 2 / 22 / 13 16
10ACVR1_HUMAN35 99% 0.443 PF08515 C1_S152 - (4)20 1 / 27 / 8 16
11ADCK1_HUMAN0 0% - -0 - (0)? - / - / - 1
12ADCK2_HUMAN0 0% - -0 - (0)? - / - / - 0
13ADCK3_HUMAN0 0% - -0 - (0)? - / - / - 0
14ADCK4_HUMAN0 0% - -0 - (0)? - / - / - 0
15ADCK5_HUMAN0 0% - -0 - (0)? - / - / - 0
16AKT1_HUMAN107 100% 0.511 PF00433 C1_S1133 - (20)20 6 / 79 / 21 53
17AKT2_HUMAN106 100% 0.512 PF00433 C1_S1130 - (25)20 7 / 74 / 24 44
18AKT3_HUMAN72 86% 0.512 PF00433 C1_S191 - (14)20 4 / 56 / 12 38
19ALK_HUMAN77 100% 0.522 PF07714 C1_S190 - (6)20 10 / 50 / 17 34
20ALPK1_HUMAN14 42% 0.227 PF00400 C3_S120 - (19)12 - / - / 15 4
21ALPK2_HUMAN0 0% - -0 - (0)? - / - / - 0
22ALPK3_HUMAN0 0% - -0 - (0)? - / - / - 0
23AMHR2_HUMAN32 35% 0.524 PF08515 C2_S157 - (4)20 - / 18 / 14 12
24ANKK1_HUMAN0 0% - -0 - (0)? - / - / - 6
25ARAF_HUMAN84 76% 0.541 PF02196 C1_S1116 - (9)20 28 / 41 / 15 31
26ARBK1_HUMAN67 100% 0.531 PF00615 C1_S180 - (27)20 - / 36 / 30 30
27ARBK2_HUMAN69 84% 0.511 PF00615 C1_S184 - (27)20 - / 37 / 31 30
28ATM_HUMAN0 0% - -0 - (0)? - / - / - 1
29ATR_HUMAN0 0% - -0 - (0)? - / - / - 0
30AURKA_HUMAN95 100% 0.576 PF00069 C1_S1110 - (20)20 10 / 68 / 16 64
31AURKB_HUMAN95 99% 0.504 PF00069 C1_S1112 - (19)20 8 / 60 / 27 62
32AURKC_HUMAN100 84% 0.576 PF00069 C1_S1113 - (17)20 10 / 63 / 26 62
33AVR2A_HUMAN37 100% 0.529 PF08515 C2_S197 - (0)20 1 / 27 / 10 17
34AVR2B_HUMAN36 98% 0.472 PF08515 C1_S159 - (4)20 1 / 26 / 10 15
35BAZ1B_HUMAN0 0% - -0 - (0)? - / - / - 0
36BCR_HUMAN0 0% - -0 - (0)? - / - / - 0
37BLK_HUMAN109 74% 0.493 PF00018 C3_S1120 - (9)20 34 / 52 / 23 39
38BMP2K_HUMAN16 99% 0.516 PF00069 C1_S134 - (0)20 2 / 4 / 14 6
39BMPR2_HUMAN33 43% 0.580 PF08515 C1_S163 - (3)20 3 / 21 / 15 14
40BMR1A_HUMAN77 85% 0.528 PF08515 C1_S198 - (0)20 3 / 59 / 16 28
41BMR1B_HUMAN45 100% 0.486 PF08515 C1_S161 - (2)20 3 / 31 / 12 19
42BMX_HUMAN112 98% 0.572 PF00018 C1_S1129 - (7)20 22 / 60 / 33 47
43BRAF_HUMAN79 100% 0.561 PF02196 C2_S1105 - (5)20 27 / 40 / 12 34
44BRSK1_HUMAN23 50% 0.569 PF00069 C3_S178 - (12)17 - / 4 / 18 8
45BRSK2_HUMAN24 50% 0.562 PF00069 C1_S176 - (12)16 1 / 2 / 23 7
46BTK_HUMAN100 100% 0.672 PF00018 C1_S1117 - (3)20 24 / 48 / 31 58
47BUB1_HUMAN0 23% 0.206 PF00069 0 - (0)? - / - / - 1
48BUB1B_HUMAN0 0% - -0 - (0)? - / - / - 0
49CD11A_HUMAN66 45% 0.519 PF00069 C1_S196 - (7)20 - / 16 / 36 35
50CD11B_HUMAN67 45% 0.530 PF00069 C1_S198 - (9)20 - / 16 / 37 36

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