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]
50ACVR1_HUMAN27 99% 0.28 PF08515 C1_S132 - (0)20 - / 27 / - 12
51STK10_HUMAN21 100% 0.17 PF12474 C1_S129 - (0)20 7 / 9 / 5 12
52NTRK1_HUMAN24 100% 0.21 PF18613 C2_S126 - (0)20 13 / 11 / - 21
53STK24_HUMAN26 99% 0.34 PF00069 C1_S126 - (0)20 1 / 15 / 10 22
54ROCK1_HUMAN24 100% 0.17 PF08912 C1_S124 - (0)20 2 / 11 / 11 13
55TGFR1_HUMAN23 100% 0.35 PF08515 C1_S124 - (0)20 3 / 14 / 5 20
56NEK2_HUMAN19 100% 0.30 PF00069 C1_S122 - (0)19 1 / 17 / 1 19
57M4K4_HUMAN22 100% 0.12 PF00069 C1_S122 - (0)19 1 / 19 / 2 16
58TNIK_HUMAN22 100% 0.12 PF00069 C1_S122 - (0)19 1 / 19 / 2 16
59MERTK_HUMAN21 100% 0.17 PF07714 C1_S121 - (3)20 - / 15 / 6 12
60WEE1_HUMAN16 100% 0.20 -C1_S121 - (0)17 10 / 6 / - 16
61CSK22_HUMAN16 100% 0.73 PF00069 C1_S121 - (0)20 1 / 10 / 5 8
62MELK_HUMAN19 100% 0.26 PF00069 C1_S121 - (0)19 4 / 14 / 1 17
63ULK2_HUMAN11 99% 0.14 -C1_S121 - (0)17 - / 11 / - 3
64DDR1_HUMAN18 100% 0.21 PF07714 C2_S121 - (0)20 14 / 4 / - 13
65TYK2_HUMAN21 100% 0.24 PF07714 C2_S121 - (0)20 2 / 17 / 2 20
66IGF1R_HUMAN20 100% 0.18 PF01030 C2_S120 - (2)16 - / 17 / 3 14
67RIPK2_HUMAN19 100% 0.29 PF07714 C2_S119 - (0)20 6 / 13 / - 11
68KKCC2_HUMAN17 100% 0.26 PF00069 C1_S118 - (0)19 4 / 13 / - 16
69M3K7_HUMAN18 92% 0.22 PF07714 C1_S118 - (1)18 5 / 9 / 4 18
70MINK1_HUMAN18 91% 0.12 PF00069 C1_S118 - (0)17 1 / 15 / 2 16
71ARBK1_HUMAN18 100% 0.49 PF00615 C1_S118 - (0)18 2 / 15 / 1 16
72KS6B1_HUMAN17 100% 0.35 PF00433 C1_S118 - (0)12 2 / 14 / 1 7
73HASP_HUMAN17 100% 0.24 -C1_S118 - (13)13 - / 9 / 8 12
74WNK1_HUMAN11 99% 0.06 PF00069 C1_S117 - (0)8 1 / 3 / 6 3
75RET_HUMAN11 99% 0.16 PF07714 C2_S117 - (4)15 - / 7 / 4 7
76AKT1_HUMAN15 99% 0.36 PF00433 C1_S117 - (0)15 3 / 11 / 1 12
77WNK3_HUMAN10 100% 0.10 PF00069 C1_S116 - (0)12 - / 4 / 4 3
78PLK1_HUMAN11 100% 0.27 PF00659 C1_S116 - (1)15 7 / 3 / 1 11
79CDK12_HUMAN11 99% 0.12 PF00069 C1_S116 - (0)13 1 / 10 / - 5
80PDK2_HUMAN14 100% 0.53 PF02518 C1_S116 - (6)15 - / 6 / 8 11
81CDK19_HUMAN8 93% 0.38 PF00069 C1_S116 - (0)20 - / 8 / - 8
82RIPK1_HUMAN15 100% 0.23 PF12721 C1_S115 - (0)20 9 / 6 / - 8
83FGFR4_HUMAN15 100% 0.22 PF07714 C1_S115 - (0)15 7 / 5 / 3 8
84EPHB4_HUMAN15 100% 0.17 PF00536 C1_S115 - (0)19 2 / 12 / 1 13
85KCC2D_HUMAN13 100% 0.31 PF00069 C1_S115 - (0)18 3 / 10 / - 7
86MRCKB_HUMAN8 100% 0.13 PF00069 C1_S115 - (0)19 - / 3 / 5 6
87MAPK2_HUMAN14 100% 0.32 PF00069 C1_S114 - (1)14 - / 12 / 2 11
88KCC2A_HUMAN12 93% 0.40 PF00069 C1_S114 - (0)18 3 / 8 / 1 7
89TBK1_HUMAN13 100% 0.45 PF00069 C1_S114 - (0)7 1 / 11 / 1 6
90ULK1_HUMAN8 99% 0.15 PF00069 C1_S114 - (0)18 - / 7 / 1 4
91MK07_HUMAN11 100% 0.26 PF00069 C1_S114 - (0)17 1 / 7 / 3 10
92PTK6_HUMAN10 99% 0.32 PF00018 C1_S113 - (0)19 1 / 6 / - 4
93ACK1_HUMAN13 100% 0.15 PF14604 C1_S113 - (2)15 6 / 3 / 4 7
94AKT2_HUMAN12 99% 0.37 PF00433 C1_S113 - (2)20 2 / 10 / - 10
95CDK13_HUMAN9 99% 0.12 PF00069 C1_S113 - (0)13 1 / 8 / - 5
96DYR1A_HUMAN10 99% 0.23 PF00069 C1_S112 - (0)9 - / 8 / 1 5
97KC1G3_HUMAN10 100% 0.34 PF00069 C1_S112 - (0)15 - / 10 / - 10
98KCC2B_HUMAN12 99% 0.22 PF00069 C1_S112 - (0)20 - / 9 / 3 6
99KCC2G_HUMAN12 99% 0.26 PF00069 C1_S112 - (0)18 3 / 9 / - 6
100EPHA3_HUMAN11 99% 0.18 -C1_S111 - (5)8 3 / 2 / 6 7

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