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]
1CDK3_HUMAN446 78% 0.57 PF00069 63.80 - (0)? 4 / 245 / 191 292
2CDK1_HUMAN442 100% 0.51 PF00069 65.30 - (0)? 4 / 242 / 191 289
3CDK2_HUMAN439 100% 0.81 PF00069 70.40 - (0)? 4 / 244 / 185 289
4MK12_HUMAN196 99% 0.49 PF00069 49.60 - (0)? 59 / 103 / 38 164
5MK14_HUMAN195 100% 0.78 PF00069 63.90 - (0)? 81 / 92 / 22 163
6MK11_HUMAN194 99% 0.48 PF00069 64.80 - (0)? 80 / 92 / 21 162
7MK13_HUMAN187 100% 0.52 PF00069 66.40 - (0)? 55 / 96 / 37 160
8PIM3_HUMAN141 76% 0.44 PF00069 67.70 - (0)? - / 80 / 62 120
9MK01_HUMAN143 100% 0.78 PF00069 63.40 - (0)? 19 / 65 / 54 110
10HCK_HUMAN195 100% 0.68 PF00018 57.60 - (0)? 56 / 87 / 50 107
11MK03_HUMAN134 100% 0.69 PF00069 61.10 - (0)? 18 / 62 / 53 104
12LYN_HUMAN189 100% 0.48 PF00018 54.90 - (0)? 54 / 86 / 47 103
13LCK_HUMAN189 100% 0.56 PF00018 68.40 - (0)? 56 / 85 / 46 103
14PIM1_HUMAN116 100% 0.37 PF00069 70.30 - (0)? - / 63 / 52 101
15AURKB_HUMAN186 99% 0.43 PF00069 69.50 - (0)? 17 / 124 / 45 96
16AURKC_HUMAN185 84% 0.52 PF00069 69.20 - (0)? 16 / 123 / 46 95
17CSK21_HUMAN178 100% 0.67 PF00069 50.00 - (0)? 15 / 73 / 80 94
18CHK1_HUMAN103 100% 0.31 PF00069 75.70 - (0)? 3 / 62 / 38 94
19CSK23_HUMAN175 99% 0.66 PF00069 49.90 - (0)? 15 / 73 / 79 94
20TEC_HUMAN126 67% 0.21 PF00018 50.70 - (0)? 36 / 68 / 22 92
21AURKA_HUMAN168 100% 0.36 PF00069 71.00 - (0)? 19 / 119 / 30 89
22BLK_HUMAN152 75% 0.43 PF00018 60.80 - (0)? 45 / 69 / 36 87
23CSK22_HUMAN159 100% 0.68 PF00069 32.90 - (0)? 6 / 75 / 72 83
24JAK2_HUMAN118 99% 0.14 PF00017 69.50 - (0)? 6 / 88 / 24 79
25TXK_HUMAN108 66% 0.25 PF00018 64.00 - (0)? 25 / 63 / 22 77
26FGR_HUMAN133 80% 0.52 PF00018 65.10 - (0)? 34 / 65 / 34 76
27FYN_HUMAN132 85% 0.50 PF00018 65.80 - (0)? 33 / 64 / 34 76
28YES_HUMAN133 90% 0.68 PF00018 70.30 - (0)? 34 / 63 / 34 76
29SRC_HUMAN127 100% 0.69 PF00018 72.90 - (0)? 34 / 59 / 33 75
30BMX_HUMAN79 98% 0.23 PF00018 67.80 - (0)? 33 / 37 / 9 64
31KAPCB_HUMAN91 93% 0.82 PF00069 62.80 - (0)? 8 / 45 / 37 64
32BTK_HUMAN75 100% 0.28 PF00018 69.50 - (0)? 37 / 32 / 6 61
33KSYK_HUMAN71 100% 0.45 PF00017 74.70 - (0)? 6 / 60 / 5 58
34MET_HUMAN77 100% 0.13 PF01833 68.70 - (0)? 54 / 19 / 2 58
35EPHB1_HUMAN83 98% 0.17 PF00536 72.10 - (0)? 10 / 49 / 23 55
36EPHA7_HUMAN81 100% 0.18 PF00536 72.60 - (0)? 8 / 21 / 51 54
37EPHB3_HUMAN83 99% 0.17 PF00536 71.70 - (0)? 11 / 46 / 24 54
38EPHB4_HUMAN81 100% 0.18 PF00536 73.70 - (0)? 9 / 48 / 22 54
39EPHA2_HUMAN82 100% 0.18 PF00536 68.00 - (0)? 10 / 47 / 24 54
40EPHA8_HUMAN77 100% 0.15 PF00536 70.80 - (0)? 10 / 44 / 22 54
41EPHB2_HUMAN80 99% 0.17 PF00536 72.00 - (0)? 9 / 47 / 21 53
42EPHA4_HUMAN82 99% 0.21 PF00536 73.40 - (0)? 10 / 47 / 23 53
43EPHA6_HUMAN81 77% 0.17 PF00536 74.40 - (0)? 10 / 44 / 25 53
44EPHA3_HUMAN80 100% 0.18 PF00536 72.30 - (0)? 10 / 45 / 23 52
45EPHA5_HUMAN81 88% 0.17 PF00536 68.70 - (0)? 10 / 45 / 24 52
46ZAP70_HUMAN61 100% 0.23 PF00017 68.30 - (0)? 5 / 52 / 4 52
47GSK3A_HUMAN97 89% 0.56 PF00069 69.50 - (0)? 3 / 49 / 44 48
48FGFR4_HUMAN144 100% 0.22 PF07714 73.10 - (0)? 22 / 63 / 58 48
49GSK3B_HUMAN98 100% 0.72 PF00069 63.90 - (0)? 3 / 51 / 42 47
50FGFR2_HUMAN146 100% 0.21 PF07714 79.50 - (0)? 28 / 62 / 52 47

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