Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
PK_HUMAN_I90_2019M4 (2019 - Homo sapiens - Protein Kinase family)

Download : Data.csv | 3D Common Core | 3D Models | DB.fasta


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]
1CDK2_HUMAN424 100% 0.80 PF00069 C1_S1464 - (31)20 4 / 233 / 183 289
2MK14_HUMAN185 100% 0.78 PF00069 C1_S1203 - (0)20 76 / 88 / 21 161
3AURKA_HUMAN162 100% 0.35 PF00069 C1_S1190 - (54)20 18 / 115 / 29 87
4MK01_HUMAN135 100% 0.78 PF00069 C1_S1173 - (1)20 18 / 63 / 50 108
5CSK21_HUMAN113 100% 0.67 PF00069 C1_S1156 - (0)18 14 / 48 / 42 54
6CSK23_HUMAN110 99% 0.66 PF00069 C1_S1152 - (0)20 14 / 48 / 41 54
7EGFR_HUMAN135 100% 0.14 PF01030 C2_S1136 - (26)138 16 / 83 / 38 67
8PIM1_HUMAN110 100% 0.37 PF00069 C1_S1126 - (8)20 - / 58 / 51 100
9FGFR1_HUMAN86 100% 0.22 PF07714 C1_S1110 - (0)20 22 / 46 / 18 38
10CHK1_HUMAN103 100% 0.27 PF00069 C2_S1105 - (0)20 3 / 62 / 38 94
11ABL1_HUMAN95 100% 0.33 PF00018 C1_S1103 - (8)20 59 / 30 / 6 29
12BRAF_HUMAN96 100% 0.21 PF02196 C1_S199 - (0)20 53 / 39 / 4 45
13GSK3B_HUMAN95 100% 0.67 PF00069 C1_S198 - (9)20 3 / 50 / 40 47
14ABL2_HUMAN85 100% 0.19 PF00018 C1_S196 - (8)20 49 / 29 / 7 27
15KAPCB_HUMAN85 93% 0.82 PF00069 C1_S194 - (22)19 8 / 40 / 37 61
16JAK2_HUMAN89 99% 0.14 PF00017 C1_S191 - (0)20 6 / 67 / 16 56
17MET_HUMAN70 100% 0.13 PF01833 C2_S179 - (0)20 51 / 18 / - 57
18KSYK_HUMAN69 100% 0.45 PF00017 C1_S176 - (3)20 5 / 59 / 5 58
19BTK_HUMAN69 100% 0.28 PF00018 C1_S175 - (0)20 35 / 28 / 6 60
20PDPK2_HUMAN47 99% 0.39 PF00069 C1_S163 - (19)20 5 / 25 / 16 29
21PDPK1_HUMAN47 100% 0.28 PF00069 C1_S163 - (19)20 5 / 25 / 16 29
22KAPCA_HUMAN54 99% 0.87 PF00069 C1_S159 - (0)19 7 / 26 / 20 43
23ITK_HUMAN49 100% 0.24 PF00018 C2_S157 - (0)20 6 / 31 / 10 31
24MP2K1_HUMAN36 100% 0.48 PF00069 C1_S156 - (28)20 3 / 22 / 11 19
25KC1E_HUMAN42 100% 0.56 PF00069 C1_S154 - (0)19 3 / 37 / 2 16
26KC1D_HUMAN42 100% 0.55 PF00069 C1_S154 - (0)19 3 / 36 / 2 16
27JAK3_HUMAN44 99% 0.14 PF07714 C1_S153 - (0)20 - / 35 / 11 31
28MK10_HUMAN45 100% 0.39 PF00069 C1_S149 - (3)20 12 / 22 / 10 38
29ALK_HUMAN47 100% 0.10 PF07714 C1_S149 - (0)20 12 / 31 / 2 35
30HCK_HUMAN42 100% 0.68 PF00018 C1_S147 - (2)20 23 / 13 / 6 23
31MK08_HUMAN45 100% 0.39 PF00069 C1_S147 - (3)20 7 / 27 / 10 38
32SRC_HUMAN45 100% 0.14 PF00018 C2_S145 - (3)19 3 / 9 / 25 24
33EPHA2_HUMAN39 100% 0.18 PF00536 C2_S145 - (4)20 4 / 28 / 7 32
34TTK_HUMAN35 100% 0.18 -C1_S145 - (0)20 9 / 20 / 5 31
35DAPK1_HUMAN42 100% 0.12 PF00069 C1_S143 - (20)20 1 / 12 / 24 19
36FAK1_HUMAN41 100% 0.31 PF07714 C1_S143 - (4)20 5 / 20 / 14 27
37M3K5_HUMAN27 100% 0.09 PF00069 C2_S141 - (0)17 5 / 13 / 4 12
38FGFR2_HUMAN41 100% 0.21 PF07714 C1_S141 - (34)12 - / 6 / 33 6
39JAK1_HUMAN32 99% 0.15 PF07714 C1_S137 - (0)20 - / 23 / 9 17
40CDK8_HUMAN23 100% 0.43 PF00069 C1_S137 - (0)20 3 / 14 / 4 21
41CLK1_HUMAN24 99% 0.38 PF00069 C1_S137 - (0)20 5 / 15 / 4 13
42PAK1_HUMAN31 100% 0.30 PF00069 C1_S136 - (0)20 7 / 19 / 5 21
43CHK2_HUMAN30 100% 0.28 PF00069 C1_S136 - (1)20 1 / 16 / 13 30
44LCK_HUMAN33 100% 0.42 PF00018 C1_S135 - (1)20 7 / 17 / 9 31
45PAK4_HUMAN23 99% 0.29 PF00069 C1_S134 - (0)19 1 / 15 / 6 17
46PAK3_HUMAN30 95% 0.29 PF00069 C1_S134 - (0)20 7 / 18 / 5 20
47PAK2_HUMAN30 91% 0.32 PF00069 C1_S133 - (0)20 7 / 15 / 8 19
48VRK1_HUMAN33 97% 0.42 PF00069 C1_S133 - (0)20 - / 27 / 6 14
49IRAK4_HUMAN33 100% 0.30 PF07714 C1_S133 - (0)20 6 / 25 / 2 19
50ACVR1_HUMAN27 99% 0.28 PF08515 C1_S132 - (0)20 - / 27 / - 12

<< Page / 5 >> - Show