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]
1TEC_HUMAN114 67% 0.455 PF00018 C3_S1131 - (3)20 27 / 67 / 24 59
2TXK_HUMAN113 66% 0.433 PF00018 C1_S1130 - (4)20 20 / 69 / 28 60
3BMX_HUMAN112 98% 0.572 PF00018 C1_S1129 - (7)20 22 / 60 / 33 47
4ITK_HUMAN111 100% 0.545 PF00018 C4_S1127 - (5)20 14 / 58 / 43 57
5PTK6_HUMAN111 56% 0.447 PF00018 C2_S1125 - (10)20 31 / 61 / 20 40
6SRMS_HUMAN111 53% 0.502 PF00018 C2_S1122 - (9)20 34 / 55 / 22 30
7FER_HUMAN110 66% 0.566 PF00018 C2_S1131 - (15)20 39 / 50 / 20 35
8FRK_HUMAN110 61% 0.486 PF00018 C1_S1120 - (9)20 29 / 61 / 21 30
9MERTK_HUMAN110 100% 0.587 PF00018 C1_S1131 - (7)20 51 / 45 / 15 68
10CSK_HUMAN109 100% 0.571 PF00018 C1_S1125 - (13)20 40 / 53 / 16 25
11BLK_HUMAN109 74% 0.493 PF00018 C3_S1120 - (9)20 34 / 52 / 23 39
12AKT1_HUMAN107 100% 0.511 PF00433 C1_S1133 - (20)20 6 / 79 / 21 53
13FES_HUMAN107 99% 0.560 PF00018 C1_S1136 - (17)20 34 / 47 / 28 30
14KSYK_HUMAN107 100% 0.528 PF07714 C3_S1126 - (19)20 10 / 57 / 40 44
15UFO_HUMAN107 69% 0.556 PF00018 C3_S1126 - (9)20 42 / 44 / 21 69
16CDK10_HUMAN107 45% 0.598 PF00069 C1_S1136 - (6)20 1 / 16 / 94 85
17MATK_HUMAN106 59% 0.500 PF00018 C2_S1120 - (16)16 26 / 55 / 25 24
18CDK16_HUMAN106 99% 0.511 PF00069 C1_S1120 - (10)20 1 / 30 / 74 81
19AKT2_HUMAN106 100% 0.512 PF00433 C1_S1130 - (25)20 7 / 74 / 24 44
20DDR1_HUMAN106 100% 0.631 PF00018 C1_S1116 - (12)20 54 / 39 / 14 33
21M3K7_HUMAN105 98% 0.474 PF00018 C3_S1131 - (15)20 12 / 47 / 43 35
22CDK19_HUMAN105 88% 0.566 PF00069 C1_S1147 - (8)20 4 / 18 / 90 88
23DDR2_HUMAN104 68% 0.610 PF00018 C2_S1119 - (8)20 48 / 44 / 14 39
24CDK8_HUMAN104 100% 0.559 PF00069 C1_S1142 - (6)20 3 / 20 / 88 85
25ZAP70_HUMAN104 100% 0.621 PF07714 C1_S1127 - (19)20 11 / 59 / 35 41
26CDKL2_HUMAN102 99% 0.577 PF00069 C2_S1130 - (9)20 2 / 37 / 55 56
27CDKL3_HUMAN102 99% 0.569 PF00069 C3_S1124 - (11)20 1 / 20 / 82 56
28CDK17_HUMAN102 81% 0.535 PF00069 C1_S1117 - (9)20 1 / 23 / 77 91
29MK01_HUMAN101 100% 0.770 PF00069 C1_S1130 - (25)20 6 / 34 / 60 57
30TIE1_HUMAN101 81% 0.521 PF07714 C2_S1125 - (21)20 12 / 28 / 59 46
31CDK1_HUMAN101 100% 0.544 PF00069 C1_S1124 - (9)20 2 / 42 / 55 56
32TIE2_HUMAN101 100% 0.504 PF07714 C1_S1139 - (20)20 13 / 28 / 60 46
33LCK_HUMAN101 100% 0.692 PF00018 C3_S1112 - (6)20 32 / 53 / 17 53
34KAPCA_HUMAN101 99% 0.843 PF00069 C1_S1123 - (25)20 12 / 53 / 38 63
35CDKL1_HUMAN101 98% 0.560 PF00069 C1_S1128 - (8)20 1 / 42 / 54 53
36PRKY_HUMAN101 52% 0.442 PF00069 C1_S1118 - (29)20 6 / 50 / 42 56
37LYN_HUMAN100 100% 0.547 PF00018 C2_S1111 - (6)20 32 / 52 / 17 30
38PRKX_HUMAN100 53% 0.509 PF00069 C1_S1117 - (27)20 8 / 56 / 35 57
39STK25_HUMAN100 99% 0.514 PF00069 C1_S1130 - (32)20 5 / 52 / 54 43
40AURKC_HUMAN100 84% 0.576 PF00069 C1_S1113 - (17)20 10 / 63 / 26 62
41BTK_HUMAN100 100% 0.672 PF00018 C1_S1117 - (3)20 24 / 48 / 31 58
42KAPCG_HUMAN100 84% 0.819 PF00069 C1_S1121 - (22)20 11 / 53 / 39 67
43ULK3_HUMAN99 39% 0.589 PF00069 C2_S1118 - (16)20 3 / 74 / 22 57
44CDK18_HUMAN99 77% 0.456 PF00069 C1_S1126 - (9)20 2 / 38 / 50 53
45CDK14_HUMAN99 60% 0.504 PF00069 C1_S1117 - (12)20 1 / 20 / 79 87
46KAPCB_HUMAN99 92% 0.828 PF00069 C1_S1121 - (26)20 11 / 52 / 38 63
47CDK7_HUMAN99 100% 0.524 PF00069 C1_S1123 - (11)20 2 / 36 / 59 54
48HCK_HUMAN99 100% 0.808 PF00018 C3_S1110 - (6)20 32 / 51 / 17 32
49CDK3_HUMAN98 77% 0.565 PF00069 C1_S1119 - (8)20 2 / 36 / 51 59
50CDK5_HUMAN98 100% 0.520 PF00069 C1_S1115 - (7)20 2 / 41 / 50 53

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