Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
KINOME_2015 (Oct 2015)

Download : Data.csv | 3D Models


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]
50KS6A2_HUMAN69 90% 0.609 PF00433 C2_S180 - (13)20 2 / 44 / 23 31
51EPHA2_HUMAN88 100% 0.608 PF00018 C2_S195 - (21)20 16 / 44 / 28 37
52CDK20_HUMAN97 46% 0.608 PF00069 C1_S1125 - (9)20 1 / 44 / 48 45
53MRCKG_HUMAN69 69% 0.605 PF08912 C3_S181 - (8)20 - / 28 / 42 35
54FGFR3_HUMAN44 98% 0.604 PF07714 C2_S173 - (0)18 10 / 21 / 9 21
55MK07_HUMAN75 100% 0.603 PF00069 C1_S187 - (18)20 4 / 35 / 35 37
56RET_HUMAN76 99% 0.602 PF07714 C2_S1113 - (27)18 6 / 28 / 36 23
57EPHB3_HUMAN73 99% 0.601 PF00018 C2_S184 - (18)20 16 / 36 / 20 37
58PKN2_HUMAN45 79% 0.600 PF00433 C2_S156 - (8)20 2 / 39 / 6 30
59FYN_HUMAN66 99% 0.600 PF00018 C2_S173 - (4)20 22 / 34 / 11 34
60PAK2_HUMAN96 91% 0.599 PF00069 C1_S1122 - (21)20 8 / 52 / 38 36
61TTK_HUMAN18 100% 0.599 PF00069 C1_S152 - (7)18 1 / 13 / 7 14
62CDK10_HUMAN107 45% 0.598 PF00069 C1_S1136 - (6)20 1 / 16 / 94 85
63NEK7_HUMAN25 100% 0.598 PF00069 C1_S1103 - (13)20 - / 11 / 17 21
64MET_HUMAN88 100% 0.598 PF01833 C2_S1106 - (8)20 41 / 21 / 27 51
65INSRR_HUMAN69 78% 0.592 PF01030 C1_S185 - (10)20 6 / 45 / 18 35
66EPHA6_HUMAN80 73% 0.591 PF07714 C3_S186 - (22)20 6 / 33 / 37 31
67CSKP_HUMAN46 100% 0.591 PF00069 C2_S1112 - (31)15 - / 5 / 40 15
68FGFR2_HUMAN44 100% 0.591 PF07714 C3_S177 - (0)20 12 / 22 / 8 24
69NEK2_HUMAN70 100% 0.590 PF00069 C2_S1132 - (18)18 1 / 27 / 42 32
70PAK4_HUMAN83 99% 0.590 PF00069 C3_S195 - (17)20 7 / 42 / 33 33
71ULK3_HUMAN99 39% 0.589 PF00069 C2_S1118 - (16)20 3 / 74 / 22 57
72STK36_HUMAN72 36% 0.589 PF00069 C1_S1118 - (17)20 1 / 35 / 38 51
73DAPK3_HUMAN56 99% 0.588 PF00069 C1_S190 - (34)20 1 / 16 / 34 16
74STK10_HUMAN83 100% 0.588 PF00069 C1_S1107 - (24)20 3 / 34 / 56 35
75MERTK_HUMAN110 100% 0.587 PF00018 C1_S1131 - (7)20 51 / 45 / 15 68
76KS6A1_HUMAN49 100% 0.587 PF00433 C3_S157 - (11)20 2 / 39 / 8 26
77MELK_HUMAN44 99% 0.586 PF00069 C1_S1107 - (14)20 1 / 11 / 33 16
78NEK4_HUMAN38 50% 0.586 PF00069 C1_S1130 - (20)20 1 / 24 / 16 21
79STK16_HUMAN3 99% 0.586 PF00069 C1_S139 - (8)15 - / 6 / 9 8
80LIMK2_HUMAN21 100% 0.586 PF07714 C3_S144 - (8)20 4 / 9 / 11 11
81KPCT_HUMAN61 100% 0.586 PF00433 C1_S176 - (13)20 3 / 51 / 8 32
82MP2K1_HUMAN68 100% 0.585 PF00069 C1_S1142 - (44)20 13 / 57 / 25 10
83KS6B1_HUMAN58 100% 0.585 PF00433 C1_S178 - (11)20 2 / 44 / 14 32
84PDK4_HUMAN21 100% 0.585 PF02518 C2_S136 - (26)13 2 / 13 / 9 5
85TAOK1_HUMAN91 88% 0.585 PF00069 C1_S1102 - (19)20 5 / 37 / 49 37
86PAK7_HUMAN70 98% 0.584 PF00069 C1_S199 - (22)20 6 / 34 / 32 24
87FGFR1_HUMAN62 99% 0.583 PF07714 C4_S177 - (27)20 9 / 18 / 32 17
88TTBK1_HUMAN49 100% 0.583 PF00069 C2_S165 - (5)19 - / 31 / 21 16
89SRPK1_HUMAN4 100% 0.582 PF00069 C2_S119 - (5)6 - / 5 / 4 3
90NTRK1_HUMAN92 100% 0.582 PF01030 C3_S1124 - (10)20 12 / 55 / 26 43
91STK33_HUMAN7 39% 0.582 PF00069 C1_S147 - (0)7 - / 2 / 5 1
92BMPR2_HUMAN33 43% 0.580 PF08515 C1_S163 - (3)20 3 / 21 / 15 14
93MUSK_HUMAN78 97% 0.579 PF07714 C6_S196 - (5)20 15 / 22 / 38 33
94NEK1_HUMAN32 99% 0.579 PF00069 C1_S168 - (7)20 3 / 21 / 8 20
95KCC1D_HUMAN68 84% 0.577 PF00069 C1_S1118 - (36)19 - / 33 / 32 21
96CDKL2_HUMAN102 99% 0.577 PF00069 C2_S1130 - (9)20 2 / 37 / 55 56
97AURKC_HUMAN100 84% 0.576 PF00069 C1_S1113 - (17)20 10 / 63 / 26 62
98MINK1_HUMAN86 90% 0.576 PF00069 C2_S1103 - (20)20 2 / 40 / 44 35
99AURKA_HUMAN95 100% 0.576 PF00069 C1_S1110 - (20)20 10 / 68 / 16 64
100NTRK3_HUMAN86 95% 0.575 PF07714 C5_S1121 - (9)20 12 / 52 / 23 32

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