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]
50PIM1_HUMAN110 100% 0.37 PF00069 C1_S1126 - (8)20 - / 58 / 51 100
51ACVR1_HUMAN27 99% 0.28 PF08515 C1_S132 - (0)20 - / 27 / - 12
52TGFR1_HUMAN23 100% 0.35 PF08515 C1_S124 - (0)20 3 / 14 / 5 20
53DDR1_HUMAN18 100% 0.21 PF07714 C2_S121 - (0)20 14 / 4 / - 13
54PDPK1_HUMAN47 100% 0.28 PF00069 C1_S163 - (19)20 5 / 25 / 16 29
55GSK3B_HUMAN95 100% 0.67 PF00069 C1_S198 - (9)20 3 / 50 / 40 47
56CDK8_HUMAN23 100% 0.43 PF00069 C1_S137 - (0)20 3 / 14 / 4 21
57FAK1_HUMAN41 100% 0.31 PF07714 C1_S143 - (4)20 5 / 20 / 14 27
58TTK_HUMAN35 100% 0.18 -C1_S145 - (0)20 9 / 20 / 5 31
59CDK2_HUMAN424 100% 0.80 PF00069 C1_S1464 - (31)20 4 / 233 / 183 289
60BTK_HUMAN69 100% 0.28 PF00018 C1_S175 - (0)20 35 / 28 / 6 60
61FGFR1_HUMAN86 100% 0.22 PF07714 C1_S1110 - (0)20 22 / 46 / 18 38
62KCC2B_HUMAN12 99% 0.22 PF00069 C1_S112 - (0)20 - / 9 / 3 6
63LCK_HUMAN33 100% 0.42 PF00018 C1_S135 - (1)20 7 / 17 / 9 31
64NTRK1_HUMAN24 100% 0.21 PF18613 C2_S126 - (0)20 13 / 11 / - 21
65CDKL1_HUMAN3 98% 0.42 PF00069 C1_S13 - (0)19 - / 3 / - 1
66NEK2_HUMAN19 100% 0.30 PF00069 C1_S122 - (0)19 1 / 17 / 1 19
67PTK6_HUMAN10 99% 0.32 PF00018 C1_S113 - (0)19 1 / 6 / - 4
68KC1E_HUMAN42 100% 0.56 PF00069 C1_S154 - (0)19 3 / 37 / 2 16
69PAK4_HUMAN23 99% 0.29 PF00069 C1_S134 - (0)19 1 / 15 / 6 17
70KKCC2_HUMAN17 100% 0.26 PF00069 C1_S118 - (0)19 4 / 13 / - 16
71EPHB4_HUMAN15 100% 0.17 PF00536 C1_S115 - (0)19 2 / 12 / 1 13
72KAPCB_HUMAN85 93% 0.82 PF00069 C1_S194 - (22)19 8 / 40 / 37 61
73MRCKB_HUMAN8 100% 0.13 PF00069 C1_S115 - (0)19 - / 3 / 5 6
74KC1D_HUMAN42 100% 0.55 PF00069 C1_S154 - (0)19 3 / 36 / 2 16
75KAPCA_HUMAN54 99% 0.87 PF00069 C1_S159 - (0)19 7 / 26 / 20 43
76SRC_HUMAN45 100% 0.14 PF00018 C2_S145 - (3)19 3 / 9 / 25 24
77FYN_HUMAN1 99% 0.30 PF00018 C1_S11 - (0)19 - / 1 / - 1
78STK26_HUMAN5 100% 0.36 PF00069 C1_S16 - (0)19 - / 2 / 1 2
79M4K4_HUMAN22 100% 0.12 PF00069 C1_S122 - (0)19 1 / 19 / 2 16
80CLK3_HUMAN8 100% 0.26 PF00069 C1_S19 - (0)19 - / 6 / 1 6
81RAF1_HUMAN2 100% 0.17 PF02196 C1_S12 - (0)19 - / 1 / 1 1
82TNIK_HUMAN22 100% 0.12 PF00069 C1_S122 - (0)19 1 / 19 / 2 16
83KKCC1_HUMAN6 99% 0.31 PF00069 C1_S16 - (0)19 4 / 2 / - 2
84MELK_HUMAN19 100% 0.26 PF00069 C1_S121 - (0)19 4 / 14 / 1 17
85KSR2_HUMAN2 100% 0.13 -C1_S12 - (0)19 1 / - / 1 2
86TYRO3_HUMAN3 97% 0.14 -C1_S13 - (0)18 - / 2 / 1 3
87UFO_HUMAN4 100% 0.17 PF07714 C1_S14 - (0)18 - / 4 / - 1
88AVR2A_HUMAN6 100% 0.30 PF00069 C2_S110 - (0)18 - / 4 / 2 3
89AURKB_HUMAN1 99% 0.40 PF00069 C1_S11 - (0)18 - / 1 / - 1
90DAPK3_HUMAN6 100% 0.34 PF00069 C1_S17 - (0)18 - / 5 / 1 3
91MK03_HUMAN6 100% 0.69 PF00069 C1_S18 - (0)18 1 / 1 / 3 3
92VGFR1_HUMAN1 100% 0.12 -C1_S11 - (0)18 - / 1 / - 1
93NTRK3_HUMAN3 95% 0.20 PF16920 C1_S17 - (0)18 1 / 1 / 1 2
94PMYT1_HUMAN5 100% 0.33 PF00069 C1_S16 - (0)18 - / 4 / - 3
95M3K7_HUMAN18 92% 0.22 PF07714 C1_S118 - (1)18 5 / 9 / 4 18
96CSK21_HUMAN113 100% 0.67 PF00069 C1_S1156 - (0)18 14 / 48 / 42 54
97ARBK1_HUMAN18 100% 0.49 PF00615 C1_S118 - (0)18 2 / 15 / 1 16
98KCC2D_HUMAN13 100% 0.31 PF00069 C1_S115 - (0)18 3 / 10 / - 7
99ULK1_HUMAN8 99% 0.15 PF00069 C1_S114 - (0)18 - / 7 / 1 4
100KPCI_HUMAN7 99% 0.34 PF00433 C1_S19 - (5)18 - / 6 / 1 5

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