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]
1STK10_HUMAN83 100% 0.588 PF00069 C1_S1107 - (24)20 3 / 34 / 56 35
2SRPK1_HUMAN4 100% 0.582 PF00069 C2_S119 - (5)6 - / 5 / 4 3
3EPHA7_HUMAN79 100% 0.648 PF00018 C2_S191 - (18)20 6 / 35 / 38 37
4FLT3_HUMAN45 100% 0.527 PF07714 C2_S182 - (4)19 1 / 27 / 11 17
5KS6A1_HUMAN49 100% 0.587 PF00433 C3_S157 - (11)20 2 / 39 / 8 26
6ACK1_HUMAN50 100% 0.495 PF01030 C3_S198 - (26)20 10 / 19 / 22 20
7RAF1_HUMAN86 100% 0.421 PF02196 C2_S1125 - (10)20 28 / 43 / 14 32
8M3K14_HUMAN22 100% 0.550 PF00069 C1_S1111 - (26)20 3 / 19 / 9 11
9WEE1_HUMAN9 100% 0.561 PF00069 C1_S139 - (8)20 6 / 6 / 7 11
10MP2K6_HUMAN79 100% 0.474 PF00069 C1_S1149 - (49)20 7 / 57 / 41 9
11NTRK1_HUMAN92 100% 0.582 PF01030 C3_S1124 - (10)20 12 / 55 / 26 43
12EPHA8_HUMAN69 100% 0.563 PF07714 C3_S173 - (18)20 4 / 27 / 36 26
13NEK2_HUMAN70 100% 0.590 PF00069 C2_S1132 - (18)18 1 / 27 / 42 32
14EGFR_HUMAN68 100% 0.507 PF01030 C2_S172 - (19)20 18 / 27 / 22 29
15KSR2_HUMAN66 100% 0.467 PF02196 C3_S170 - (0)20 2 / 39 / 22 25
16NTRK2_HUMAN92 100% 0.557 PF01030 C2_S1127 - (12)20 12 / 56 / 25 41
17TAF1_HUMAN4 100% 0.798 PF00439 112 - (0)2 - / - / - 0
18MARK1_HUMAN38 100% 0.559 PF00069 C2_S199 - (12)19 - / 12 / 23 15
19EPHA2_HUMAN88 100% 0.608 PF00018 C2_S195 - (21)20 16 / 44 / 28 37
20M4K4_HUMAN87 100% 0.550 PF00069 C2_S1103 - (20)20 1 / 46 / 41 36
21KCC1G_HUMAN56 100% 0.553 PF00069 C3_S1121 - (19)20 1 / 24 / 29 26
22ABL1_HUMAN34 100% 0.827 PF00018 C3_S134 - (4)20 23 / 11 / - 12
23KSYK_HUMAN107 100% 0.528 PF07714 C3_S1126 - (19)20 10 / 57 / 40 44
24PDPK1_HUMAN50 100% 0.520 PF00069 C2_S181 - (11)20 5 / 34 / 10 36
25ABL2_HUMAN96 100% 0.861 PF00018 C4_S1101 - (11)20 52 / 35 / 9 29
26AURKA_HUMAN95 100% 0.576 PF00069 C1_S1110 - (20)20 10 / 68 / 16 64
27KS6B1_HUMAN58 100% 0.585 PF00433 C1_S178 - (11)20 2 / 44 / 14 32
28CSK_HUMAN109 100% 0.571 PF00018 C1_S1125 - (13)20 40 / 53 / 16 25
29IGF1R_HUMAN69 100% 0.813 PF01030 C1_S187 - (10)20 6 / 45 / 17 39
30HCK_HUMAN99 100% 0.808 PF00018 C3_S1110 - (6)20 32 / 51 / 17 32
31MP2K1_HUMAN68 100% 0.585 PF00069 C1_S1142 - (44)20 13 / 57 / 25 10
32AKT2_HUMAN106 100% 0.512 PF00433 C1_S1130 - (25)20 7 / 74 / 24 44
33PLK1_HUMAN71 100% 0.540 PF00069 C2_S1101 - (14)20 7 / 28 / 37 33
34LYN_HUMAN100 100% 0.547 PF00018 C2_S1111 - (6)20 32 / 52 / 17 30
35PAK1_HUMAN96 100% 0.556 PF00069 C1_S1121 - (27)20 5 / 49 / 44 31
36BMR1B_HUMAN45 100% 0.486 PF08515 C1_S161 - (2)20 3 / 31 / 12 19
37CDK8_HUMAN104 100% 0.559 PF00069 C1_S1142 - (6)20 3 / 20 / 88 85
38CSKP_HUMAN46 100% 0.591 PF00069 C2_S1112 - (31)15 - / 5 / 40 15
39MK01_HUMAN101 100% 0.770 PF00069 C1_S1130 - (25)20 6 / 34 / 60 57
40ROCK1_HUMAN48 100% 0.573 PF08912 C3_S156 - (5)20 - / 24 / 26 26
41MK10_HUMAN83 100% 0.523 PF00069 C2_S1100 - (10)20 26 / 37 / 20 49
42KCC4_HUMAN78 100% 0.471 PF00069 C2_S1123 - (27)20 1 / 31 / 43 27
43DDR1_HUMAN106 100% 0.631 PF00018 C1_S1116 - (12)20 54 / 39 / 14 33
44RIPK1_HUMAN75 100% 0.521 PF00018 C1_S194 - (6)20 12 / 30 / 30 17
45LIMK2_HUMAN21 100% 0.586 PF07714 C3_S144 - (8)20 4 / 9 / 11 11
46CHK1_HUMAN83 100% 0.518 PF00069 C1_S1109 - (5)20 3 / 57 / 23 70
47TGFR1_HUMAN35 100% 0.534 PF08515 C1_S162 - (0)20 1 / 22 / 13 16
48INSR_HUMAN72 100% 0.775 PF01030 C1_S190 - (10)20 7 / 46 / 19 41
49STK26_HUMAN97 100% 0.552 PF00069 C1_S1125 - (31)20 5 / 47 / 53 39
50MKNK2_HUMAN30 100% 0.518 PF00069 C1_S180 - (16)20 - / 9 / 19 10

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