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]
1MP2K6_HUMAN79 100% 0.474 PF00069 C1_S1149 - (49)20 7 / 57 / 41 9
2CDK19_HUMAN105 88% 0.566 PF00069 C1_S1147 - (8)20 4 / 18 / 90 88
3MP2K4_HUMAN86 100% 0.503 PF00069 C1_S1143 - (56)20 4 / 58 / 50 18
4MP2K1_HUMAN68 100% 0.585 PF00069 C1_S1142 - (44)20 13 / 57 / 25 10
5CDK8_HUMAN104 100% 0.559 PF00069 C1_S1142 - (6)20 3 / 20 / 88 85
6TIE2_HUMAN101 100% 0.504 PF07714 C1_S1139 - (20)20 13 / 28 / 60 46
7CDK10_HUMAN107 45% 0.598 PF00069 C1_S1136 - (6)20 1 / 16 / 94 85
8FES_HUMAN107 99% 0.560 PF00018 C1_S1136 - (17)20 34 / 47 / 28 30
9PLK3_HUMAN94 100% 0.530 PF00069 C1_S1135 - (16)20 10 / 32 / 49 48
10TLK2_HUMAN70 34% 0.379 PF00069 C1_S1135 - (29)20 - / 26 / 51 17
11AKT1_HUMAN107 100% 0.511 PF00433 C1_S1133 - (20)20 6 / 79 / 21 53
12PLK2_HUMAN57 98% 0.544 PF00069 C1_S1132 - (17)20 1 / 26 / 29 24
13NEK2_HUMAN70 100% 0.590 PF00069 C2_S1132 - (18)18 1 / 27 / 42 32
14TEC_HUMAN114 67% 0.455 PF00018 C3_S1131 - (3)20 27 / 67 / 24 59
15MERTK_HUMAN110 100% 0.587 PF00018 C1_S1131 - (7)20 51 / 45 / 15 68
16FER_HUMAN110 66% 0.566 PF00018 C2_S1131 - (15)20 39 / 50 / 20 35
17KCC1A_HUMAN63 100% 0.537 PF00069 C1_S1131 - (22)20 - / 31 / 30 27
18M3K7_HUMAN105 98% 0.474 PF00018 C3_S1131 - (15)20 12 / 47 / 43 35
19MK01_HUMAN101 100% 0.770 PF00069 C1_S1130 - (25)20 6 / 34 / 60 57
20STK25_HUMAN100 99% 0.514 PF00069 C1_S1130 - (32)20 5 / 52 / 54 43
21TXK_HUMAN113 66% 0.433 PF00018 C1_S1130 - (4)20 20 / 69 / 28 60
22AKT2_HUMAN106 100% 0.512 PF00433 C1_S1130 - (25)20 7 / 74 / 24 44
23NEK11_HUMAN68 38% 0.486 PF00069 C1_S1130 - (13)20 1 / 18 / 43 34
24NEK4_HUMAN38 50% 0.586 PF00069 C1_S1130 - (20)20 1 / 24 / 16 21
25CDKL2_HUMAN102 99% 0.577 PF00069 C2_S1130 - (9)20 2 / 37 / 55 56
26BMX_HUMAN112 98% 0.572 PF00018 C1_S1129 - (7)20 22 / 60 / 33 47
27CDKL1_HUMAN101 98% 0.560 PF00069 C1_S1128 - (8)20 1 / 42 / 54 53
28PIM2_HUMAN96 100% 0.549 PF00069 C1_S1128 - (14)20 - / 55 / 41 44
29MP2K7_HUMAN65 100% 0.544 PF00069 C1_S1128 - (47)20 4 / 47 / 42 21
30ZAP70_HUMAN104 100% 0.621 PF07714 C1_S1127 - (19)20 11 / 59 / 35 41
31ITK_HUMAN111 100% 0.545 PF00018 C4_S1127 - (5)20 14 / 58 / 43 57
32NTRK2_HUMAN92 100% 0.557 PF01030 C2_S1127 - (12)20 12 / 56 / 25 41
33RYK_HUMAN18 40% 0.474 PF07714 C2_S1126 - (5)20 - / 9 / 9 14
34UFO_HUMAN107 69% 0.556 PF00018 C3_S1126 - (9)20 42 / 44 / 21 69
35KSYK_HUMAN107 100% 0.528 PF07714 C3_S1126 - (19)20 10 / 57 / 40 44
36STK24_HUMAN98 99% 0.511 PF00069 C2_S1126 - (30)20 6 / 51 / 50 42
37CDK18_HUMAN99 77% 0.456 PF00069 C1_S1126 - (9)20 2 / 38 / 50 53
38STK26_HUMAN97 100% 0.552 PF00069 C1_S1125 - (31)20 5 / 47 / 53 39
39PTK6_HUMAN111 56% 0.447 PF00018 C2_S1125 - (10)20 31 / 61 / 20 40
40NEK6_HUMAN56 81% 0.520 PF00069 C1_S1125 - (9)20 - / 16 / 42 25
41RAF1_HUMAN86 100% 0.421 PF02196 C2_S1125 - (10)20 28 / 43 / 14 32
42TIE1_HUMAN101 81% 0.521 PF07714 C2_S1125 - (21)20 12 / 28 / 59 46
43CSK_HUMAN109 100% 0.571 PF00018 C1_S1125 - (13)20 40 / 53 / 16 25
44TLK1_HUMAN64 33% 0.363 PF00069 C1_S1125 - (28)20 - / 24 / 44 22
45KPCD3_HUMAN49 39% 0.497 PF00069 C1_S1125 - (37)20 - / 15 / 32 12
46CDK20_HUMAN97 46% 0.608 PF00069 C1_S1125 - (9)20 1 / 44 / 48 45
47DCLK3_HUMAN85 44% 0.530 PF00069 C1_S1125 - (42)20 - / 16 / 59 15
48CDKL3_HUMAN102 99% 0.569 PF00069 C3_S1124 - (11)20 1 / 20 / 82 56
49CDK1_HUMAN101 100% 0.544 PF00069 C1_S1124 - (9)20 2 / 42 / 55 56
50CSK21_HUMAN89 100% 0.785 PF00069 C1_S1124 - (21)20 3 / 39 / 44 38

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