Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
PK_HUMAN_I60_2019M5 (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]
1KAPCA_HUMAN45 99% 0.84 PF00069 C1_S147 - (10)20 1 / 19 / 24 30
2KAPCB_HUMAN91 93% 0.82 PF00069 C1_S1100 - (23)19 8 / 45 / 37 64
3KAPCG_HUMAN56 84% 0.82 PF00069 C1_S162 - (22)20 7 / 35 / 14 38
4CDK2_HUMAN439 100% 0.81 PF00069 C1_S1479 - (33)20 4 / 244 / 185 289
5MK01_HUMAN143 100% 0.78 PF00069 C1_S1183 - (24)20 19 / 65 / 54 110
6MK14_HUMAN195 100% 0.78 PF00069 C1_S1215 - (0)20 81 / 92 / 22 163
7GSK3B_HUMAN98 100% 0.72 PF00069 C1_S1101 - (11)20 3 / 51 / 42 47
8SRC_HUMAN127 100% 0.69 PF00018 C3_S1134 - (11)20 34 / 59 / 33 75
9MK03_HUMAN134 100% 0.69 PF00069 C1_S1175 - (21)20 18 / 62 / 53 104
10HCK_HUMAN195 100% 0.68 PF00018 C4_S1207 - (19)20 56 / 87 / 50 107
11YES_HUMAN133 90% 0.68 PF00018 C3_S1140 - (11)20 34 / 63 / 34 76
12CSK22_HUMAN159 100% 0.68 PF00069 C1_S1200 - (32)20 6 / 75 / 72 83
13CSK21_HUMAN178 100% 0.67 PF00069 C1_S1255 - (37)18 15 / 73 / 80 94
14CSK23_HUMAN175 99% 0.66 PF00069 C1_S1251 - (37)20 15 / 73 / 79 94
15CDK6_HUMAN8 100% 0.59 PF00069 C1_S18 - (0)19 1 / 6 / 1 8
16PDK3_HUMAN30 100% 0.57 PF02518 C9_S133 - (18)17 2 / 14 / 14 13
17CDK3_HUMAN446 78% 0.57 PF00069 C1_S1487 - (34)20 4 / 245 / 191 292
18STK16_HUMAN2 99% 0.57 PF00069 C1_S12 - (0)10 - / 2 / - 1
19LCK_HUMAN189 100% 0.56 PF00018 C3_S1201 - (16)20 56 / 85 / 46 103
20GSK3A_HUMAN97 89% 0.56 PF00069 C2_S1100 - (11)20 3 / 49 / 44 48
21KC1E_HUMAN44 100% 0.56 PF00069 C1_S156 - (4)18 3 / 38 / 2 16
22PHKG1_HUMAN9 95% 0.55 PF00069 C1_S19 - (5)20 - / 5 / 4 2
23KC1D_HUMAN44 100% 0.55 PF00069 C1_S156 - (4)19 3 / 38 / 2 16
24GRK6_HUMAN14 100% 0.53 PF00615 C1_S114 - (13)20 1 / 1 / 12 5
25PDK2_HUMAN30 100% 0.53 PF02518 C8_S133 - (18)17 2 / 15 / 13 13
26MK13_HUMAN187 100% 0.52 PF00069 C1_S1204 - (1)20 55 / 96 / 37 160
27CDK5_HUMAN10 100% 0.52 PF00069 C1_S110 - (0)20 - / 5 / 5 7
28FGR_HUMAN133 80% 0.52 PF00018 C1_S1140 - (11)20 34 / 65 / 34 76
29AURKC_HUMAN185 84% 0.52 PF00069 C1_S1208 - (58)20 16 / 123 / 46 95
30CDK4_HUMAN8 71% 0.51 PF00069 C1_S18 - (0)17 1 / 5 / 2 8
31PDK4_HUMAN30 100% 0.51 PF02518 C7_S133 - (18)17 2 / 15 / 13 13
32CDK1_HUMAN442 100% 0.51 PF00069 C1_S1482 - (35)20 4 / 242 / 191 289
33NEK7_HUMAN5 100% 0.50 PF00069 C1_S15 - (1)6 - / 3 / 2 2
34FYN_HUMAN132 85% 0.50 PF00018 C3_S1139 - (11)20 33 / 64 / 34 76
35MK12_HUMAN196 99% 0.49 PF00069 C1_S1214 - (1)20 59 / 103 / 38 164
36ARBK1_HUMAN18 100% 0.49 PF00615 C2_S118 - (0)20 2 / 15 / 1 16
37MK11_HUMAN194 99% 0.48 PF00069 C1_S1214 - (0)20 80 / 92 / 21 162
38ARBK2_HUMAN18 85% 0.48 PF00615 C1_S118 - (0)20 2 / 15 / 1 16
39PDK1_HUMAN30 71% 0.48 PF02518 C5_S132 - (18)17 2 / 14 / 14 13
40RK_HUMAN7 84% 0.48 PF00615 C1_S17 - (7)16 - / - / 7 2
41LYN_HUMAN189 100% 0.48 PF00018 C4_S1201 - (16)20 54 / 86 / 47 103
42MP2K1_HUMAN51 100% 0.48 PF00069 C1_S184 - (43)20 6 / 34 / 11 22
43TOPK_HUMAN2 100% 0.47 PF00069 C1_S12 - (0)5 - / - / 2 1
44MP2K2_HUMAN51 87% 0.47 PF00069 C1_S184 - (43)20 7 / 39 / 11 22
45CDK9_HUMAN9 99% 0.47 PF00069 C1_S19 - (2)20 - / 5 / 4 9
46KC1A_HUMAN44 76% 0.46 PF00069 C1_S156 - (4)18 3 / 39 / 1 16
47PK3CD_HUMAN5 100% 0.45 PF00613 C8_S15 - (0)2 - / 1 / - 1
48GRK4_HUMAN14 99% 0.45 PF00615 C1_S114 - (13)20 1 / 1 / 12 5
49GRK5_HUMAN14 99% 0.45 PF00615 C1_S114 - (13)20 1 / 1 / 12 5
50AKT2_HUMAN35 99% 0.45 PF00433 C1_S139 - (4)20 11 / 22 / 2 29

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