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]
50CLK4_HUMAN1 100% 0.38 PF00069 C1_S11 - (0)20 - / 1 / - 1
51DYRK3_HUMAN1 99% 0.37 PF00069 C1_S11 - (0)6 - / 1 / - 1
52VRK2_HUMAN2 99% 0.36 PF00069 C1_S12 - (0)10 - / 1 / 1 2
53WNK3_HUMAN10 100% 0.10 PF00069 C1_S116 - (0)12 - / 4 / 4 3
54CLK2_HUMAN10 100% 0.35 PF00069 C1_S110 - (0)20 - / 9 / 1 5
55DYR1A_HUMAN10 99% 0.23 PF00069 C1_S112 - (0)9 - / 8 / 1 5
56KC1G3_HUMAN10 100% 0.34 PF00069 C1_S112 - (0)15 - / 10 / - 10
57WNK1_HUMAN11 99% 0.06 PF00069 C1_S117 - (0)8 1 / 3 / 6 3
58CHK1_HUMAN103 100% 0.27 PF00069 C2_S1105 - (0)20 3 / 62 / 38 94
59PIM1_HUMAN110 100% 0.37 PF00069 C1_S1126 - (8)20 - / 58 / 51 100
60CSK23_HUMAN110 99% 0.66 PF00069 C1_S1152 - (0)20 14 / 48 / 41 54
61CSK21_HUMAN113 100% 0.67 PF00069 C1_S1156 - (0)18 14 / 48 / 42 54
62MK01_HUMAN135 100% 0.78 PF00069 C1_S1173 - (1)20 18 / 63 / 50 108
63KCC2G_HUMAN12 99% 0.26 PF00069 C1_S112 - (0)18 3 / 9 / - 6
64KCC2A_HUMAN12 93% 0.40 PF00069 C1_S114 - (0)18 3 / 8 / 1 7
65KCC2B_HUMAN12 99% 0.22 PF00069 C1_S112 - (0)20 - / 9 / 3 6
66CSK22_HUMAN16 100% 0.73 PF00069 C1_S121 - (0)20 1 / 10 / 5 8
67CLK1_HUMAN24 99% 0.38 PF00069 C1_S137 - (0)20 5 / 15 / 4 13
68KCC2D_HUMAN13 100% 0.31 PF00069 C1_S115 - (0)18 3 / 10 / - 7
69TBK1_HUMAN13 100% 0.45 PF00069 C1_S114 - (0)7 1 / 11 / 1 6
70PAK4_HUMAN23 99% 0.29 PF00069 C1_S134 - (0)19 1 / 15 / 6 17
71MAPK2_HUMAN14 100% 0.32 PF00069 C1_S114 - (1)14 - / 12 / 2 11
72AURKA_HUMAN162 100% 0.35 PF00069 C1_S1190 - (54)20 18 / 115 / 29 87
73KKCC2_HUMAN17 100% 0.26 PF00069 C1_S118 - (0)19 4 / 13 / - 16
74M3K5_HUMAN27 100% 0.09 PF00069 C2_S141 - (0)17 5 / 13 / 4 12
75MINK1_HUMAN18 91% 0.12 PF00069 C1_S118 - (0)17 1 / 15 / 2 16
76MK14_HUMAN185 100% 0.78 PF00069 C1_S1203 - (0)20 76 / 88 / 21 161
77MELK_HUMAN19 100% 0.26 PF00069 C1_S121 - (0)19 4 / 14 / 1 17
78NEK2_HUMAN19 100% 0.30 PF00069 C1_S122 - (0)19 1 / 17 / 1 19
79M3K14_HUMAN2 99% 0.18 PF00069 C1_S14 - (0)10 - / - / 2 1
80MK13_HUMAN2 100% 0.52 PF00069 C1_S12 - (0)10 - / 2 / - 2
81MP2K6_HUMAN2 100% 0.38 PF00069 C1_S12 - (0)15 1 / - / 1 2
82MYLK4_HUMAN2 99% 0.35 PF00069 C1_S12 - (0)8 - / 2 / - 1
83NEK1_HUMAN2 99% 0.13 PF00069 C1_S12 - (0)20 - / 1 / 1 1
84ST17B_HUMAN2 100% 0.40 PF00069 C1_S12 - (0)15 - / 1 / 1 2
85STK25_HUMAN2 99% 0.36 PF00069 C1_S12 - (0)17 - / 2 / - 1
86ULK3_HUMAN2 100% 0.32 PF00069 C1_S12 - (0)11 - / 2 / - 2
87CDK16_HUMAN2 99% 0.30 PF00069 C1_S13 - (0)15 2 / - / - 1
88E2AK2_HUMAN2 94% 0.22 PF00069 C2_S12 - (2)13 - / - / 2 1
89IRAK1_HUMAN2 99% 0.22 PF00069 C1_S12 - (0)17 - / 2 / - 1
90KCC1G_HUMAN2 100% 0.33 PF00069 C1_S14 - (0)17 - / 2 / - 1
91MP2K7_HUMAN4 100% 0.40 PF00069 C1_S14 - (0)12 - / 1 / 3 3
92DCLK1_HUMAN4 99% 0.19 PF00069 C2_S14 - (0)15 - / 4 / - 2
93M4K4_HUMAN22 100% 0.12 PF00069 C1_S122 - (0)19 1 / 19 / 2 16
94TNIK_HUMAN22 100% 0.12 PF00069 C1_S122 - (0)19 1 / 19 / 2 16
95CDK8_HUMAN23 100% 0.43 PF00069 C1_S137 - (0)20 3 / 14 / 4 21
96STK24_HUMAN26 99% 0.34 PF00069 C1_S126 - (0)20 1 / 15 / 10 22
97PAK2_HUMAN30 91% 0.32 PF00069 C1_S133 - (0)20 7 / 15 / 8 19
98PAK3_HUMAN30 95% 0.29 PF00069 C1_S134 - (0)20 7 / 18 / 5 20
99PAK1_HUMAN31 100% 0.30 PF00069 C1_S136 - (0)20 7 / 19 / 5 21
100VRK1_HUMAN33 97% 0.42 PF00069 C1_S133 - (0)20 - / 27 / 6 14

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