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]
100ROS1_HUMAN68 50% 0.569 PF07714 C2_S178 - (29)20 3 / 19 / 41 20
101DMPK_HUMAN53 100% 0.538 PF08912 C2_S170 - (9)20 - / 18 / 36 26
102PIM3_HUMAN95 75% 0.541 PF00069 C1_S1122 - (16)20 - / 55 / 40 58
103SNRK_HUMAN49 44% 0.485 PF00069 C2_S197 - (19)20 2 / 24 / 21 28
104PAK4_HUMAN83 99% 0.590 PF00069 C3_S195 - (17)20 7 / 42 / 33 33
105MP2K7_HUMAN65 100% 0.544 PF00069 C1_S1128 - (47)20 4 / 47 / 42 21
106RYK_HUMAN18 40% 0.474 PF07714 C2_S1126 - (5)20 - / 9 / 9 14
107LTK_HUMAN79 77% 0.495 PF07714 C1_S196 - (11)20 7 / 49 / 24 36
108CDKL3_HUMAN102 99% 0.569 PF00069 C3_S1124 - (11)20 1 / 20 / 82 56
109CDK7_HUMAN99 100% 0.524 PF00069 C1_S1123 - (11)20 2 / 36 / 59 54
110SIK2_HUMAN30 54% 0.500 PF00069 C2_S176 - (0)20 2 / 13 / 12 12
111NEK1_HUMAN32 99% 0.579 PF00069 C1_S168 - (7)20 3 / 21 / 8 20
112FER_HUMAN110 66% 0.566 PF00018 C2_S1131 - (15)20 39 / 50 / 20 35
113M3K3_HUMAN92 40% 0.495 PF00069 C1_S1119 - (10)20 7 / 38 / 50 23
114MK11_HUMAN87 99% 0.524 PF00069 C1_S1101 - (7)20 27 / 44 / 17 64
115IGF1R_HUMAN69 100% 0.813 PF01030 C1_S187 - (10)20 6 / 45 / 17 39
116INSRR_HUMAN69 78% 0.592 PF01030 C1_S185 - (10)20 6 / 45 / 18 35
117ABL2_HUMAN96 100% 0.861 PF00018 C4_S1101 - (11)20 52 / 35 / 9 29
118CDK2_HUMAN98 100% 0.809 PF00069 C1_S1121 - (8)20 2 / 36 / 50 61
119PRKY_HUMAN101 52% 0.442 PF00069 C1_S1118 - (29)20 6 / 50 / 42 56
120MP2K2_HUMAN54 86% 0.641 PF00069 C1_S1124 - (46)20 8 / 49 / 25 22
121MARK3_HUMAN30 99% 0.534 PF00069 C2_S1101 - (12)20 - / 15 / 12 13
122INSR_HUMAN72 100% 0.775 PF01030 C1_S190 - (10)20 7 / 46 / 19 41
123PHKG1_HUMAN69 95% 0.761 PF00069 C1_S1119 - (47)20 - / 18 / 47 19
124AURKC_HUMAN100 84% 0.576 PF00069 C1_S1113 - (17)20 10 / 63 / 26 62
125CDK10_HUMAN107 45% 0.598 PF00069 C1_S1136 - (6)20 1 / 16 / 94 85
126NEK4_HUMAN38 50% 0.586 PF00069 C1_S1130 - (20)20 1 / 24 / 16 21
127BMPR2_HUMAN33 43% 0.580 PF08515 C1_S163 - (3)20 3 / 21 / 15 14
128KIT_HUMAN87 96% 0.563 PF07714 C2_S192 - (25)20 24 / 29 / 33 34
129KPCD3_HUMAN49 39% 0.497 PF00069 C1_S1125 - (37)20 - / 15 / 32 12
130PLK3_HUMAN94 100% 0.530 PF00069 C1_S1135 - (16)20 10 / 32 / 49 48
131ROCK2_HUMAN38 100% 0.614 PF08912 C2_S147 - (0)20 - / 12 / 28 18
132M4K1_HUMAN81 44% 0.480 PF00069 C1_S1105 - (20)20 8 / 50 / 31 31
133KS6B1_HUMAN58 100% 0.585 PF00433 C1_S178 - (11)20 2 / 44 / 14 32
134AAPK1_HUMAN83 99% 0.428 PF00069 C4_S1102 - (13)20 2 / 17 / 6 9
135NEK10_HUMAN20 35% 0.484 PF00069 C2_S1101 - (18)20 - / 3 / 18 15
136ARBK2_HUMAN69 84% 0.511 PF00615 C1_S184 - (27)20 - / 37 / 31 30
137CLK2_HUMAN20 99% 0.513 PF00069 C1_S135 - (13)20 - / 14 / 8 10
138M3K1_HUMAN20 37% 0.528 PF00069 C2_S1100 - (10)20 - / 6 / 14 11
139FGR_HUMAN66 79% 0.624 PF00018 C2_S174 - (4)20 20 / 34 / 13 28
140SBK1_HUMAN20 35% 0.445 PF00069 C2_S1120 - (6)20 - / 14 / 6 11
141KS6A5_HUMAN47 100% 0.534 PF00433 C1_S148 - (6)20 3 / 36 / 8 28
142ACVL1_HUMAN35 99% 0.547 PF08515 C1_S153 - (2)20 2 / 22 / 13 16
143FAK1_HUMAN90 100% 0.541 PF00018 C2_S195 - (17)20 21 / 38 / 30 40
144CDK20_HUMAN97 46% 0.608 PF00069 C1_S1125 - (9)20 1 / 44 / 48 45
145CDK1_HUMAN101 100% 0.544 PF00069 C1_S1124 - (9)20 2 / 42 / 55 56
146EPHA1_HUMAN77 61% 0.668 PF07714 C1_S183 - (18)20 5 / 32 / 37 33
147LMTK3_HUMAN82 38% 0.535 PF00018 C1_S1112 - (5)20 - / 34 / 46 41
148STK38_HUMAN82 48% 0.469 PF00069 C1_S1100 - (17)20 - / 34 / 50 40
149LIMK2_HUMAN21 100% 0.586 PF07714 C3_S144 - (8)20 4 / 9 / 11 11
150KS6A4_HUMAN92 69% 0.513 PF00069 C1_S1101 - (21)20 7 / 59 / 27 57

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