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]
100ARAF_HUMAN84 76% 0.541 PF02196 C1_S1116 - (9)20 28 / 41 / 15 31
101HIPK4_HUMAN10 39% 0.434 PF00069 C1_S1115 - (7)16 - / 8 / 10 7
102CDK5_HUMAN98 100% 0.520 PF00069 C1_S1115 - (7)20 2 / 41 / 50 53
103CDK15_HUMAN92 55% 0.480 PF00069 C1_S1115 - (13)20 2 / 39 / 37 46
104TNK1_HUMAN84 48% 0.559 PF07714 C2_S1115 - (11)20 14 / 38 / 28 33
105M3K8_HUMAN35 100% 0.517 PF00069 C1_S1114 - (13)20 1 / 18 / 20 12
106ULK2_HUMAN72 77% 0.434 PF00069 C3_S1114 - (25)15 - / 27 / 40 23
107MK06_HUMAN81 100% 0.628 PF00069 C1_S1114 - (18)20 - / 30 / 50 36
108MAK_HUMAN97 39% 0.548 PF00069 C2_S1114 - (1)20 - / 20 / 81 70
109M3K2_HUMAN92 40% 0.509 PF00069 C1_S1114 - (18)20 7 / 37 / 51 27
110AURKC_HUMAN100 84% 0.576 PF00069 C1_S1113 - (17)20 10 / 63 / 26 62
111OXSR1_HUMAN83 100% 0.520 PF00069 C2_S1113 - (23)20 2 / 33 / 49 32
112KS6B2_HUMAN90 81% 0.549 PF00069 C1_S1113 - (16)20 1 / 63 / 30 54
113KPCL_HUMAN95 100% 0.466 PF00069 C1_S1113 - (48)20 1 / 79 / 17 33
114RET_HUMAN76 99% 0.602 PF07714 C2_S1113 - (27)18 6 / 28 / 36 23
115CSKP_HUMAN46 100% 0.591 PF00069 C2_S1112 - (31)15 - / 5 / 40 15
116PAK6_HUMAN76 99% 0.537 PF00069 C1_S1112 - (19)20 7 / 32 / 38 27
117AURKB_HUMAN95 99% 0.504 PF00069 C1_S1112 - (19)20 8 / 60 / 27 62
118TAF1_HUMAN4 100% 0.798 PF00439 112 - (0)2 - / - / - 0
119LCK_HUMAN101 100% 0.692 PF00018 C3_S1112 - (6)20 32 / 53 / 17 53
120MK04_HUMAN54 73% 0.483 PF00069 C3_S1112 - (23)20 - / 27 / 28 26
121GSK3A_HUMAN87 86% 0.814 PF00069 C1_S1112 - (18)20 3 / 31 / 51 45
122CDKL5_HUMAN95 99% 0.514 PF00069 C2_S1112 - (1)20 - / 18 / 76 71
123CDK6_HUMAN96 100% 0.765 PF00069 C1_S1112 - (5)20 1 / 42 / 47 61
124LMTK3_HUMAN82 38% 0.535 PF00018 C1_S1112 - (5)20 - / 34 / 46 41
125MK15_HUMAN86 51% 0.544 PF00069 C3_S1111 - (27)20 5 / 36 / 38 35
126KPCD2_HUMAN64 37% 0.479 PF00069 C1_S1111 - (44)20 1 / 22 / 40 15
127KPSH1_HUMAN55 48% 0.495 PF00069 C1_S1111 - (39)20 - / 13 / 41 20
128MOK_HUMAN85 36% 0.411 PF00069 C1_S1111 - (6)20 - / 8 / 75 52
129M3K14_HUMAN22 100% 0.550 PF00069 C1_S1111 - (26)20 3 / 19 / 9 11
130LYN_HUMAN100 100% 0.547 PF00018 C2_S1111 - (6)20 32 / 52 / 17 30
131LMTK1_HUMAN74 36% 0.431 PF01030 C1_S1111 - (15)20 - / 22 / 52 25
132M4K5_HUMAN92 48% 0.524 PF00069 C2_S1111 - (25)20 2 / 46 / 46 33
133HUNK_HUMAN38 42% 0.529 PF00069 C1_S1111 - (16)20 1 / 12 / 22 16
134TNI3K_HUMAN92 36% 0.493 PF00018 C2_S1111 - (9)18 9 / 48 / 30 35
135KGP2_HUMAN89 46% 0.474 PF00069 C3_S1111 - (28)20 8 / 47 / 33 56
136AURKA_HUMAN95 100% 0.576 PF00069 C1_S1110 - (20)20 10 / 68 / 16 64
137IRAK4_HUMAN95 100% 0.488 PF07714 C2_S1110 - (0)20 4 / 42 / 48 25
138KPSH2_HUMAN50 45% 0.556 PF00069 C1_S1110 - (32)20 - / 10 / 39 18
139GRK4_HUMAN82 99% 0.514 PF00433 C1_S1110 - (30)20 1 / 48 / 28 30
140HCK_HUMAN99 100% 0.808 PF00018 C3_S1110 - (6)20 32 / 51 / 17 32
141GSK3B_HUMAN82 100% 0.848 PF00069 C1_S1109 - (17)20 3 / 29 / 47 36
142ICK_HUMAN89 41% 0.540 PF00069 C2_S1109 - (2)20 - / 17 / 76 52
143LMTK2_HUMAN70 34% 0.469 PF00018 C1_S1109 - (7)15 1 / 28 / 36 27
144NUAK1_HUMAN32 49% 0.497 PF00069 C2_S1109 - (10)20 - / 5 / 27 10
145M3K9_HUMAN94 38% 0.508 PF00018 C2_S1109 - (4)20 5 / 67 / 21 19
146CHK1_HUMAN83 100% 0.518 PF00069 C1_S1109 - (5)20 3 / 57 / 23 70
147M3K10_HUMAN83 38% 0.538 PF00018 C1_S1108 - (10)20 - / 48 / 35 31
148JAK3_HUMAN91 100% 0.515 PF07714 C2_S1108 - (4)20 2 / 65 / 26 44
149NRK_HUMAN91 57% 0.533 PF00069 C2_S1108 - (15)20 3 / 40 / 50 37
150PIM1_HUMAN84 100% 0.555 PF00069 C1_S1108 - (15)20 - / 45 / 38 60

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