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]
1FAK1_HUMAN90 100% 0.541 PF00018 C2_S195 - (17)20 21 / 38 / 30 40
2GRK6_HUMAN71 100% 0.572 PF00615 C1_S191 - (30)20 1 / 42 / 25 1
3KCC1G_HUMAN56 100% 0.553 PF00069 C3_S1121 - (19)20 1 / 24 / 29 26
4MK09_HUMAN95 97% 0.494 PF00069 C1_S1121 - (11)20 20 / 48 / 29 56
5CDK6_HUMAN96 100% 0.765 PF00069 C1_S1112 - (5)20 1 / 42 / 47 61
6KPCD_HUMAN45 72% 0.454 PF00433 C3_S148 - (5)20 2 / 39 / 5 26
7AKT2_HUMAN106 100% 0.512 PF00433 C1_S1130 - (25)20 7 / 74 / 24 44
8M3K2_HUMAN92 40% 0.509 PF00069 C1_S1114 - (18)20 7 / 37 / 51 27
9KKCC1_HUMAN33 70% 0.554 PF00069 C1_S199 - (10)20 - / 12 / 19 17
10TYK2_HUMAN94 100% 0.525 PF00017 C1_S1101 - (0)20 7 / 63 / 25 41
11CDK7_HUMAN99 100% 0.524 PF00069 C1_S1123 - (11)20 2 / 36 / 59 54
12WEE1_HUMAN9 100% 0.561 PF00069 C1_S139 - (8)20 6 / 6 / 7 11
13MK11_HUMAN87 99% 0.524 PF00069 C1_S1101 - (7)20 27 / 44 / 17 64
14TEC_HUMAN114 67% 0.455 PF00018 C3_S1131 - (3)20 27 / 67 / 24 59
15ACV1B_HUMAN35 90% 0.551 PF08515 C1_S163 - (2)20 1 / 22 / 13 16
16NEK1_HUMAN32 99% 0.579 PF00069 C1_S168 - (7)20 3 / 21 / 8 20
17LYN_HUMAN100 100% 0.547 PF00018 C2_S1111 - (6)20 32 / 52 / 17 30
18MYLK2_HUMAN58 61% 0.488 PF00069 C2_S1100 - (34)20 - / 23 / 31 15
19PKN1_HUMAN48 99% 0.682 PF00433 C2_S159 - (9)20 1 / 41 / 8 31
20KS6C1_HUMAN55 42% 0.521 PF08912 C1_S1100 - (20)20 - / 1 / 53 0
21LMTK3_HUMAN82 38% 0.535 PF00018 C1_S1112 - (5)20 - / 34 / 46 41
22KC1G1_HUMAN54 88% 0.525 PF00069 C1_S184 - (8)20 - / 18 / 40 22
23DAPK3_HUMAN56 99% 0.588 PF00069 C1_S190 - (34)20 1 / 16 / 34 16
24M3K1_HUMAN20 37% 0.528 PF00069 C2_S1100 - (10)20 - / 6 / 14 11
25AMHR2_HUMAN32 35% 0.524 PF08515 C2_S157 - (4)20 - / 18 / 14 12
26DCLK3_HUMAN85 44% 0.530 PF00069 C1_S1125 - (42)20 - / 16 / 59 15
27WNK1_HUMAN65 99% 0.500 PF02196 C1_S176 - (3)20 5 / 51 / 8 28
28KPSH2_HUMAN50 45% 0.556 PF00069 C1_S1110 - (32)20 - / 10 / 39 18
29NEK6_HUMAN56 81% 0.520 PF00069 C1_S1125 - (9)20 - / 16 / 42 25
30PAK2_HUMAN96 91% 0.599 PF00069 C1_S1122 - (21)20 8 / 52 / 38 36
31RAF1_HUMAN86 100% 0.421 PF02196 C2_S1125 - (10)20 28 / 43 / 14 32
32MK04_HUMAN54 73% 0.483 PF00069 C3_S1112 - (23)20 - / 27 / 28 26
33ACK1_HUMAN50 100% 0.495 PF01030 C3_S198 - (26)20 10 / 19 / 22 20
34TIE1_HUMAN101 81% 0.521 PF07714 C2_S1125 - (21)20 12 / 28 / 59 46
35KS6B1_HUMAN58 100% 0.585 PF00433 C1_S178 - (11)20 2 / 44 / 14 32
36TGFR2_HUMAN35 47% 0.488 PF08515 C1_S153 - (5)20 3 / 21 / 12 11
37ICK_HUMAN89 41% 0.540 PF00069 C2_S1109 - (2)20 - / 17 / 76 52
38GRK7_HUMAN39 48% 0.515 PF00615 C1_S147 - (19)20 1 / 15 / 19 19
39MK07_HUMAN75 100% 0.603 PF00069 C1_S187 - (18)20 4 / 35 / 35 37
40DAPK1_HUMAN54 100% 0.538 PF00069 C1_S183 - (33)20 1 / 14 / 35 15
41KPCT_HUMAN61 100% 0.586 PF00433 C1_S176 - (13)20 3 / 51 / 8 32
42EPHA6_HUMAN80 73% 0.591 PF07714 C3_S186 - (22)20 6 / 33 / 37 31
43MRCKB_HUMAN72 100% 0.552 PF08912 C2_S183 - (9)20 - / 29 / 46 34
44CLK1_HUMAN35 99% 0.505 PF00069 C1_S143 - (14)20 - / 18 / 16 15
45CDK2_HUMAN98 100% 0.809 PF00069 C1_S1121 - (8)20 2 / 36 / 50 61
46SGK1_HUMAN62 99% 0.559 PF00433 C1_S178 - (11)20 2 / 48 / 10 37
47AVR2A_HUMAN37 100% 0.529 PF08515 C2_S197 - (0)20 1 / 27 / 10 17
48EGFR_HUMAN68 100% 0.507 PF01030 C2_S172 - (19)20 18 / 27 / 22 29
49ST32C_HUMAN36 67% 0.548 PF00433 C1_S167 - (12)20 - / 32 / 7 24
50CLK2_HUMAN20 99% 0.513 PF00069 C1_S135 - (13)20 - / 14 / 8 10

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