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]
100MOK_HUMAN85 36% 0.411 PF00069 C1_S1111 - (6)20 - / 8 / 75 52
101KS6A5_HUMAN47 100% 0.534 PF00433 C1_S148 - (6)20 3 / 36 / 8 28
102M4K3_HUMAN91 50% 0.526 PF00069 C1_S1107 - (24)20 6 / 42 / 43 33
103PAK4_HUMAN83 99% 0.590 PF00069 C3_S195 - (17)20 7 / 42 / 33 33
104FER_HUMAN110 66% 0.566 PF00018 C2_S1131 - (15)20 39 / 50 / 20 35
105LIMK2_HUMAN21 100% 0.586 PF07714 C3_S144 - (8)20 4 / 9 / 11 11
106VGFR1_HUMAN88 100% 0.562 PF07714 C6_S193 - (22)20 31 / 31 / 26 37
107CDK9_HUMAN97 99% 0.497 PF00069 C1_S1117 - (11)20 1 / 29 / 67 72
108KGP1_HUMAN75 100% 0.495 PF00069 C3_S186 - (25)20 7 / 42 / 29 46
109UFO_HUMAN107 69% 0.556 PF00018 C3_S1126 - (9)20 42 / 44 / 21 69
110SGK3_HUMAN62 73% 0.560 PF00433 C2_S179 - (10)20 1 / 47 / 13 38
111UHMK1_HUMAN20 41% 0.396 PF00069 C1_S141 - (7)20 - / 2 / 17 9
112TGFR1_HUMAN35 100% 0.534 PF08515 C1_S162 - (0)20 1 / 22 / 13 16
113CDK15_HUMAN92 55% 0.480 PF00069 C1_S1115 - (13)20 2 / 39 / 37 46
114AVR2A_HUMAN37 100% 0.529 PF08515 C2_S197 - (0)20 1 / 27 / 10 17
115SGK2_HUMAN65 72% 0.566 PF00433 C1_S190 - (10)20 1 / 48 / 19 38
116MP2K5_HUMAN73 47% 0.542 PF00069 C1_S1124 - (46)20 9 / 64 / 28 22
117ITK_HUMAN111 100% 0.545 PF00018 C4_S1127 - (5)20 14 / 58 / 43 57
118KS6A1_HUMAN49 100% 0.587 PF00433 C3_S157 - (11)20 2 / 39 / 8 26
119AURKB_HUMAN95 99% 0.504 PF00069 C1_S1112 - (19)20 8 / 60 / 27 62
120TGFR2_HUMAN35 47% 0.488 PF08515 C1_S153 - (5)20 3 / 21 / 12 11
121KCC1B_HUMAN59 70% 0.551 PF00069 C1_S1104 - (40)20 - / 17 / 39 18
122PLK3_HUMAN94 100% 0.530 PF00069 C1_S1135 - (16)20 10 / 32 / 49 48
123KC1G2_HUMAN54 88% 0.499 PF00069 C1_S182 - (8)20 - / 18 / 40 22
124MP2K4_HUMAN86 100% 0.503 PF00069 C1_S1143 - (56)20 4 / 58 / 50 18
125ST32C_HUMAN36 67% 0.548 PF00433 C1_S167 - (12)20 - / 32 / 7 24
126RIPK2_HUMAN11 99% 0.489 PF07714 C1_S136 - (7)20 6 / 3 / 12 9
127PDPK2_HUMAN51 99% 0.544 PF00069 C1_S182 - (11)20 5 / 35 / 10 37
128MK14_HUMAN87 100% 0.795 PF00069 C1_S1104 - (7)20 20 / 43 / 27 58
129AAPK1_HUMAN83 99% 0.428 PF00069 C4_S1102 - (13)20 2 / 17 / 6 9
130NEK11_HUMAN68 38% 0.486 PF00069 C1_S1130 - (13)20 1 / 18 / 43 34
131KPCI_HUMAN62 99% 0.630 PF00433 C2_S173 - (13)20 - / 28 / 32 36
132RK_HUMAN61 84% 0.563 PF00615 C1_S178 - (25)20 1 / 33 / 25 1
133NEK3_HUMAN21 55% 0.523 PF00069 C2_S165 - (9)20 - / 13 / 9 16
134MARK2_HUMAN38 100% 0.542 PF00069 C1_S198 - (11)20 - / 12 / 22 16
135STK10_HUMAN83 100% 0.588 PF00069 C1_S1107 - (24)20 3 / 34 / 56 35
136MUSK_HUMAN78 97% 0.579 PF07714 C6_S196 - (5)20 15 / 22 / 38 33
137PAK1_HUMAN96 100% 0.556 PF00069 C1_S1121 - (27)20 5 / 49 / 44 31
138MK09_HUMAN95 97% 0.494 PF00069 C1_S1121 - (11)20 20 / 48 / 29 56
139CDK1_HUMAN101 100% 0.544 PF00069 C1_S1124 - (9)20 2 / 42 / 55 56
140CDK7_HUMAN99 100% 0.524 PF00069 C1_S1123 - (11)20 2 / 36 / 59 54
141M3KL4_HUMAN93 38% 0.570 PF00018 C2_S1103 - (12)20 7 / 52 / 29 24
142PLK2_HUMAN57 98% 0.544 PF00069 C1_S1132 - (17)20 1 / 26 / 29 24
143ERBB4_HUMAN66 100% 0.574 PF01030 C5_S170 - (19)20 14 / 28 / 22 28
144NTRK1_HUMAN92 100% 0.582 PF01030 C3_S1124 - (10)20 12 / 55 / 26 43
145HCK_HUMAN99 100% 0.808 PF00018 C3_S1110 - (6)20 32 / 51 / 17 32
146TAOK2_HUMAN84 99% 0.554 PF00069 C2_S193 - (16)20 3 / 32 / 47 28
147GSK3B_HUMAN82 100% 0.848 PF00069 C1_S1109 - (17)20 3 / 29 / 47 36
148MP2K7_HUMAN65 100% 0.544 PF00069 C1_S1128 - (47)20 4 / 47 / 42 21
149ROS1_HUMAN68 50% 0.569 PF07714 C2_S178 - (29)20 3 / 19 / 41 20
150TEC_HUMAN114 67% 0.455 PF00018 C3_S1131 - (3)20 27 / 67 / 24 59

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