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]
1ABL2_HUMAN96 100% 0.861 PF00018 C4_S1101 - (11)20 52 / 35 / 9 29
2SRC_HUMAN61 100% 0.860 PF00018 C3_S168 - (4)20 20 / 34 / 8 33
3GSK3B_HUMAN82 100% 0.848 PF00069 C1_S1109 - (17)20 3 / 29 / 47 36
4KAPCA_HUMAN101 99% 0.843 PF00069 C1_S1123 - (25)20 12 / 53 / 38 63
5YES_HUMAN68 90% 0.841 PF00018 C2_S175 - (4)20 21 / 34 / 14 36
6KAPCB_HUMAN99 92% 0.828 PF00069 C1_S1121 - (26)20 11 / 52 / 38 63
7ABL1_HUMAN34 100% 0.827 PF00018 C3_S134 - (4)20 23 / 11 / - 12
8KAPCG_HUMAN100 84% 0.819 PF00069 C1_S1121 - (22)20 11 / 53 / 39 67
9GSK3A_HUMAN87 86% 0.814 PF00069 C1_S1112 - (18)20 3 / 31 / 51 45
10IGF1R_HUMAN69 100% 0.813 PF01030 C1_S187 - (10)20 6 / 45 / 17 39
11CDK2_HUMAN98 100% 0.809 PF00069 C1_S1121 - (8)20 2 / 36 / 50 61
12HCK_HUMAN99 100% 0.808 PF00018 C3_S1110 - (6)20 32 / 51 / 17 32
13KC1D_HUMAN56 100% 0.804 PF00069 C1_S178 - (5)20 - / 40 / 19 21
14TAF1_HUMAN4 100% 0.798 PF00439 112 - (0)2 - / - / - 0
15MK14_HUMAN87 100% 0.795 PF00069 C1_S1104 - (7)20 20 / 43 / 27 58
16KC1E_HUMAN56 100% 0.794 PF00069 C1_S178 - (6)20 - / 40 / 19 21
17CSK23_HUMAN89 99% 0.785 PF00069 C1_S1122 - (21)20 3 / 39 / 44 39
18CSK21_HUMAN89 100% 0.785 PF00069 C1_S1124 - (21)20 3 / 39 / 44 38
19INSR_HUMAN72 100% 0.775 PF01030 C1_S190 - (10)20 7 / 46 / 19 41
20MK01_HUMAN101 100% 0.770 PF00069 C1_S1130 - (25)20 6 / 34 / 60 57
21CDK6_HUMAN96 100% 0.765 PF00069 C1_S1112 - (5)20 1 / 42 / 47 61
22TRPM7_HUMAN6 98% 0.764 PF00520 C3_S115 - (14)9 - / 3 / 8 5
23PHKG1_HUMAN69 95% 0.761 PF00069 C1_S1119 - (47)20 - / 18 / 47 19
24MK03_HUMAN93 100% 0.756 PF00069 C1_S1123 - (26)20 6 / 36 / 51 47
25CSK22_HUMAN94 100% 0.734 PF00069 C1_S1122 - (22)20 2 / 41 / 47 39
26LCK_HUMAN101 100% 0.692 PF00018 C3_S1112 - (6)20 32 / 53 / 17 53
27EPHA4_HUMAN77 99% 0.688 PF00018 C2_S180 - (17)20 9 / 39 / 26 36
28PKN1_HUMAN48 99% 0.682 PF00433 C2_S159 - (9)20 1 / 41 / 8 31
29BTK_HUMAN100 100% 0.672 PF00018 C1_S1117 - (3)20 24 / 48 / 31 58
30EPHA1_HUMAN77 61% 0.668 PF07714 C1_S183 - (18)20 5 / 32 / 37 33
31EPHA7_HUMAN79 100% 0.648 PF00018 C2_S191 - (18)20 6 / 35 / 38 37
32EPHA5_HUMAN77 99% 0.645 PF00018 C3_S184 - (17)20 15 / 37 / 22 35
33MP2K2_HUMAN54 86% 0.641 PF00069 C1_S1124 - (46)20 8 / 49 / 25 22
34EPHB4_HUMAN79 100% 0.636 PF07714 C1_S188 - (18)20 6 / 32 / 39 36
35VGFR2_HUMAN89 100% 0.636 PF07714 C3_S194 - (25)20 31 / 30 / 29 34
36VRK2_HUMAN35 99% 0.634 PF00069 C1_S168 - (5)20 - / 33 / 7 12
37DDR1_HUMAN106 100% 0.631 PF00018 C1_S1116 - (12)20 54 / 39 / 14 33
38KPCI_HUMAN62 99% 0.630 PF00433 C2_S173 - (13)20 - / 28 / 32 36
39MK06_HUMAN81 100% 0.628 PF00069 C1_S1114 - (18)20 - / 30 / 50 36
40FGR_HUMAN66 79% 0.624 PF00018 C2_S174 - (4)20 20 / 34 / 13 28
41KPCZ_HUMAN80 85% 0.623 PF00433 C2_S192 - (15)20 - / 35 / 43 39
42EPHB2_HUMAN70 99% 0.622 PF00018 C3_S179 - (16)20 13 / 39 / 17 35
43ZAP70_HUMAN104 100% 0.621 PF07714 C1_S1127 - (19)20 11 / 59 / 35 41
44FGFR4_HUMAN72 100% 0.619 PF07714 C3_S180 - (28)20 10 / 21 / 38 19
45EPHAA_HUMAN68 58% 0.615 PF07714 C1_S172 - (18)20 3 / 20 / 41 32
46ROCK2_HUMAN38 100% 0.614 PF08912 C2_S147 - (0)20 - / 12 / 28 18
47PDK3_HUMAN22 100% 0.613 PF02518 C4_S134 - (25)12 2 / 12 / 10 9
48EPHA3_HUMAN80 99% 0.612 PF00018 C3_S188 - (19)20 15 / 41 / 22 38
49DDR2_HUMAN104 68% 0.610 PF00018 C2_S1119 - (8)20 48 / 44 / 14 39
50KS6A2_HUMAN69 90% 0.609 PF00433 C2_S180 - (13)20 2 / 44 / 23 31

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