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]
250ALK_HUMAN77 100% 0.522 PF07714 C1_S190 - (6)20 10 / 50 / 17 34
251KS6C1_HUMAN55 42% 0.521 PF08912 C1_S1100 - (20)20 - / 1 / 53 0
252TIE1_HUMAN101 81% 0.521 PF07714 C2_S1125 - (21)20 12 / 28 / 59 46
253RIPK1_HUMAN75 100% 0.521 PF00018 C1_S194 - (6)20 12 / 30 / 30 17
254NEK6_HUMAN56 81% 0.520 PF00069 C1_S1125 - (9)20 - / 16 / 42 25
255OXSR1_HUMAN83 100% 0.520 PF00069 C2_S1113 - (23)20 2 / 33 / 49 32
256CDK5_HUMAN98 100% 0.520 PF00069 C1_S1115 - (7)20 2 / 41 / 50 53
257PDPK1_HUMAN50 100% 0.520 PF00069 C2_S181 - (11)20 5 / 34 / 10 36
258DYRK2_HUMAN23 99% 0.519 PF00069 C1_S141 - (12)17 - / 14 / 11 9
259CD11A_HUMAN66 45% 0.519 PF00069 C1_S196 - (7)20 - / 16 / 36 35
260ST32B_HUMAN25 71% 0.519 PF00069 C1_S156 - (12)20 - / 21 / 8 17
261GRK5_HUMAN75 99% 0.519 PF00433 C1_S1102 - (31)20 1 / 44 / 25 32
262DYR1A_HUMAN11 99% 0.519 PF00069 C3_S121 - (4)9 - / 8 / 4 4
263FAK2_HUMAN93 100% 0.518 PF00018 C2_S199 - (15)20 31 / 36 / 27 39
264CHK1_HUMAN83 100% 0.518 PF00069 C1_S1109 - (5)20 3 / 57 / 23 70
265MKNK2_HUMAN30 100% 0.518 PF00069 C1_S180 - (16)20 - / 9 / 19 10
266AAK1_HUMAN6 100% 0.518 PF00069 C1_S126 - (7)17 2 / 2 / 12 6
267PHKG2_HUMAN46 99% 0.518 PF00069 C1_S1106 - (33)20 - / 9 / 37 13
268HASP_HUMAN8 100% 0.518 PF00069 C4_S112 - (6)7 - / 4 / 4 6
269M3K8_HUMAN35 100% 0.517 PF00069 C1_S1114 - (13)20 1 / 18 / 20 12
270TSSK4_HUMAN65 38% 0.517 PF00069 C1_S1105 - (0)16 - / 12 / 51 24
271TSSK6_HUMAN66 38% 0.517 PF00069 C1_S1106 - (9)19 - / 8 / 56 16
272TTBK2_HUMAN49 84% 0.517 PF00069 C3_S165 - (5)16 - / 31 / 21 15
273BMP2K_HUMAN16 99% 0.516 PF00069 C1_S134 - (0)20 2 / 4 / 14 6
274M3K13_HUMAN89 38% 0.515 PF02196 C2_S1103 - (5)20 16 / 50 / 22 27
275JAK3_HUMAN91 100% 0.515 PF07714 C2_S1108 - (4)20 2 / 65 / 26 44
276GRK7_HUMAN39 48% 0.515 PF00615 C1_S147 - (19)20 1 / 15 / 19 19
277M3K15_HUMAN80 83% 0.514 PF00069 C1_S1102 - (15)20 6 / 33 / 42 30
278STK25_HUMAN100 99% 0.514 PF00069 C1_S1130 - (32)20 5 / 52 / 54 43
279GRK4_HUMAN82 99% 0.514 PF00433 C1_S1110 - (30)20 1 / 48 / 28 30
280CDKL5_HUMAN95 99% 0.514 PF00069 C2_S1112 - (1)20 - / 18 / 76 71
281KS6A4_HUMAN92 69% 0.513 PF00069 C1_S1101 - (21)20 7 / 59 / 27 57
282CLK2_HUMAN20 99% 0.513 PF00069 C1_S135 - (13)20 - / 14 / 8 10
283WNK3_HUMAN67 90% 0.513 PF02196 C1_S182 - (4)20 4 / 53 / 12 28
284ERN1_HUMAN6 100% 0.512 PF06479 C1_S118 - (5)7 1 / 3 / 4 4
285SIK1_HUMAN29 53% 0.512 PF00069 C1_S182 - (14)20 3 / 10 / 15 11
286AKT2_HUMAN106 100% 0.512 PF00433 C1_S1130 - (25)20 7 / 74 / 24 44
287AKT3_HUMAN72 86% 0.512 PF00433 C1_S191 - (14)20 4 / 56 / 12 38
288AKT1_HUMAN107 100% 0.511 PF00433 C1_S1133 - (20)20 6 / 79 / 21 53
289M3K19_HUMAN78 42% 0.511 PF00069 C1_S192 - (16)20 4 / 33 / 42 26
290DYR1B_HUMAN24 83% 0.511 PF00069 C1_S166 - (11)19 - / 16 / 10 10
291CDK16_HUMAN106 99% 0.511 PF00069 C1_S1120 - (10)20 1 / 30 / 74 81
292ARBK2_HUMAN69 84% 0.511 PF00615 C1_S184 - (27)20 - / 37 / 31 30
293STK24_HUMAN98 99% 0.511 PF00069 C2_S1126 - (30)20 6 / 51 / 50 42
294PRKX_HUMAN100 53% 0.509 PF00069 C1_S1117 - (27)20 8 / 56 / 35 57
295M3K2_HUMAN92 40% 0.509 PF00069 C1_S1114 - (18)20 7 / 37 / 51 27
296M3K9_HUMAN94 38% 0.508 PF00018 C2_S1109 - (4)20 5 / 67 / 21 19
297TSSK1_HUMAN43 39% 0.508 PF00069 C1_S1100 - (16)20 - / 16 / 24 20
298DCLK2_HUMAN47 43% 0.507 PF00069 C1_S198 - (23)17 - / 7 / 34 11
299DUSTY_HUMAN20 44% 0.507 PF07714 C1_S143 - (5)20 2 / 9 / 9 11
300EGFR_HUMAN68 100% 0.507 PF01030 C2_S172 - (19)20 18 / 27 / 22 29

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