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]
50AVR2A_HUMAN37 100% 0.529 PF08515 C2_S197 - (0)20 1 / 27 / 10 17
51MP2K4_HUMAN86 100% 0.503 PF00069 C1_S1143 - (56)20 4 / 58 / 50 18
52EPHB4_HUMAN79 100% 0.636 PF07714 C1_S188 - (18)20 6 / 32 / 39 36
53PDK4_HUMAN21 100% 0.585 PF02518 C2_S136 - (26)13 2 / 13 / 9 5
54AAPK2_HUMAN82 100% 0.453 PF00069 C4_S1105 - (14)20 2 / 10 / 8 5
55KS6A3_HUMAN9 100% 0.562 PF00433 C3_S111 - (0)9 - / 4 / 5 7
56CSK_HUMAN109 100% 0.571 PF00018 C1_S1125 - (13)20 40 / 53 / 16 25
57STK39_HUMAN90 100% 0.504 PF00069 C2_S1117 - (25)17 2 / 42 / 47 32
58BMR1B_HUMAN45 100% 0.486 PF08515 C1_S161 - (2)20 3 / 31 / 12 19
59CDK4_HUMAN74 100% 0.527 PF00069 C1_S192 - (6)20 - / 23 / 46 38
60TTBK1_HUMAN49 100% 0.583 PF00069 C2_S165 - (5)19 - / 31 / 21 16
61IGF1R_HUMAN69 100% 0.813 PF01030 C1_S187 - (10)20 6 / 45 / 17 39
62PLK4_HUMAN80 100% 0.501 PF00069 C2_S1116 - (17)20 5 / 38 / 36 51
63MTOR_HUMAN10 100% 0.547 PF08771 C1_S110 - (0)6 1 / 9 / - 3
64DMPK_HUMAN53 100% 0.538 PF08912 C2_S170 - (9)20 - / 18 / 36 26
65CSK22_HUMAN94 100% 0.734 PF00069 C1_S1122 - (22)20 2 / 41 / 47 39
66ST32A_HUMAN24 100% 0.531 PF00069 C1_S145 - (9)20 - / 20 / 7 14
67INSR_HUMAN72 100% 0.775 PF01030 C1_S190 - (10)20 7 / 46 / 19 41
68MK13_HUMAN83 100% 0.572 PF00069 C1_S198 - (9)19 15 / 45 / 23 24
69MARK1_HUMAN38 100% 0.559 PF00069 C2_S199 - (12)19 - / 12 / 23 15
70EPHB1_HUMAN72 100% 0.572 PF00018 C1_S178 - (18)20 14 / 27 / 29 30
71KS6A5_HUMAN47 100% 0.534 PF00433 C1_S148 - (6)20 3 / 36 / 8 28
72MP2K1_HUMAN68 100% 0.585 PF00069 C1_S1142 - (44)20 13 / 57 / 25 10
73PLK1_HUMAN71 100% 0.540 PF00069 C2_S1101 - (14)20 7 / 28 / 37 33
74AAK1_HUMAN6 100% 0.518 PF00069 C1_S126 - (7)17 2 / 2 / 12 6
75ALK_HUMAN77 100% 0.522 PF07714 C1_S190 - (6)20 10 / 50 / 17 34
76MET_HUMAN88 100% 0.598 PF01833 C2_S1106 - (8)20 41 / 21 / 27 51
77CSK21_HUMAN89 100% 0.785 PF00069 C1_S1124 - (21)20 3 / 39 / 44 38
78ITK_HUMAN111 100% 0.545 PF00018 C4_S1127 - (5)20 14 / 58 / 43 57
79ERN1_HUMAN6 100% 0.512 PF06479 C1_S118 - (5)7 1 / 3 / 4 4
80ROR2_HUMAN81 100% 0.544 PF07714 C2_S196 - (20)20 4 / 26 / 51 37
81CHK1_HUMAN83 100% 0.518 PF00069 C1_S1109 - (5)20 3 / 57 / 23 70
82HASP_HUMAN8 100% 0.518 PF00069 C4_S112 - (6)7 - / 4 / 4 6
83ROCK2_HUMAN38 100% 0.614 PF08912 C2_S147 - (0)20 - / 12 / 28 18
84ABL1_HUMAN34 100% 0.827 PF00018 C3_S134 - (4)20 23 / 11 / - 12
85MK03_HUMAN93 100% 0.756 PF00069 C1_S1123 - (26)20 6 / 36 / 51 47
86VGFR1_HUMAN88 100% 0.562 PF07714 C6_S193 - (22)20 31 / 31 / 26 37
87CDK6_HUMAN96 100% 0.765 PF00069 C1_S1112 - (5)20 1 / 42 / 47 61
88KCC1A_HUMAN63 100% 0.537 PF00069 C1_S1131 - (22)20 - / 31 / 30 27
89MRCKB_HUMAN72 100% 0.552 PF08912 C2_S183 - (9)20 - / 29 / 46 34
90KKCC2_HUMAN52 100% 0.454 PF00069 C1_S191 - (17)20 - / 16 / 35 23
91DAPK1_HUMAN54 100% 0.538 PF00069 C1_S183 - (33)20 1 / 14 / 35 15
92HCK_HUMAN99 100% 0.808 PF00018 C3_S1110 - (6)20 32 / 51 / 17 32
93ZAP70_HUMAN104 100% 0.621 PF07714 C1_S1127 - (19)20 11 / 59 / 35 41
94MAPK3_HUMAN33 100% 0.550 PF00069 C1_S172 - (17)18 - / 23 / 11 15
95KPCL_HUMAN95 100% 0.466 PF00069 C1_S1113 - (48)20 1 / 79 / 17 33
96ROCK1_HUMAN48 100% 0.573 PF08912 C3_S156 - (5)20 - / 24 / 26 26
97FGFR4_HUMAN72 100% 0.619 PF07714 C3_S180 - (28)20 10 / 21 / 38 19
98MP2K6_HUMAN79 100% 0.474 PF00069 C1_S1149 - (49)20 7 / 57 / 41 9
99KC1E_HUMAN56 100% 0.794 PF00069 C1_S178 - (6)20 - / 40 / 19 21
100AKT2_HUMAN106 100% 0.512 PF00433 C1_S1130 - (25)20 7 / 74 / 24 44

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