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]
200NEK1_HUMAN32 99% 0.579 PF00069 C1_S168 - (7)20 3 / 21 / 8 20
201KCC2B_HUMAN44 99% 0.396 PF00069 C1_S191 - (28)20 - / 5 / 38 12
202GRK5_HUMAN75 99% 0.519 PF00433 C1_S1102 - (31)20 1 / 44 / 25 32
203MARK3_HUMAN30 99% 0.534 PF00069 C2_S1101 - (12)20 - / 15 / 12 13
204EPHA4_HUMAN77 99% 0.688 PF00018 C2_S180 - (17)20 9 / 39 / 26 36
205JAK2_HUMAN95 99% 0.457 PF00017 C1_S197 - (0)20 5 / 71 / 20 56
206SGK1_HUMAN62 99% 0.559 PF00433 C1_S178 - (11)20 2 / 48 / 10 37
207PAK6_HUMAN76 99% 0.537 PF00069 C1_S1112 - (19)20 7 / 32 / 38 27
208FYN_HUMAN66 99% 0.600 PF00018 C2_S173 - (4)20 22 / 34 / 11 34
209KCC2A_HUMAN45 99% 0.432 PF00069 C1_S197 - (28)20 - / 13 / 31 12
210AAPK1_HUMAN83 99% 0.428 PF00069 C4_S1102 - (13)20 2 / 17 / 6 9
211BMX_HUMAN112 98% 0.572 PF00018 C1_S1129 - (7)20 22 / 60 / 33 47
212AVR2B_HUMAN36 98% 0.472 PF08515 C1_S159 - (4)20 1 / 26 / 10 15
213PLK2_HUMAN57 98% 0.544 PF00069 C1_S1132 - (17)20 1 / 26 / 29 24
214TRPM7_HUMAN6 98% 0.764 PF00520 C3_S115 - (14)9 - / 3 / 8 5
215CDKL1_HUMAN101 98% 0.560 PF00069 C1_S1128 - (8)20 1 / 42 / 54 53
216FGFR3_HUMAN44 98% 0.604 PF07714 C2_S173 - (0)18 10 / 21 / 9 21
217KPCA_HUMAN67 98% 0.479 PF00433 C1_S180 - (16)20 1 / 54 / 10 33
218TYRO3_HUMAN59 98% 0.496 PF07714 C3_S171 - (6)20 12 / 29 / 17 31
219M3K7_HUMAN105 98% 0.474 PF00018 C3_S1131 - (15)20 12 / 47 / 43 35
220E2AK3_HUMAN13 98% 0.341 PF00069 C2_S172 - (7)18 1 / 5 / 9 6
221PAK7_HUMAN70 98% 0.584 PF00069 C1_S199 - (22)20 6 / 34 / 32 24
222ULK1_HUMAN70 98% 0.443 PF00069 C3_S1106 - (15)20 2 / 31 / 37 40
223MK09_HUMAN95 97% 0.494 PF00069 C1_S1121 - (11)20 20 / 48 / 29 56
224MUSK_HUMAN78 97% 0.579 PF07714 C6_S196 - (5)20 15 / 22 / 38 33
225KIT_HUMAN87 96% 0.563 PF07714 C2_S192 - (25)20 24 / 29 / 33 34
226KPCB_HUMAN69 95% 0.473 PF00433 C1_S181 - (15)20 1 / 55 / 13 35
227PHKG1_HUMAN69 95% 0.761 PF00069 C1_S1119 - (47)20 - / 18 / 47 19
228NTRK3_HUMAN86 95% 0.575 PF07714 C5_S1121 - (9)20 12 / 52 / 23 32
229PAK3_HUMAN95 95% 0.551 PF00069 C1_S1121 - (20)20 7 / 52 / 38 30
230KAPCB_HUMAN99 92% 0.828 PF00069 C1_S1121 - (26)20 11 / 52 / 38 63
231PAK2_HUMAN96 91% 0.599 PF00069 C1_S1122 - (21)20 8 / 52 / 38 36
232CDK13_HUMAN82 91% 0.538 PF00069 C3_S1104 - (3)20 1 / 14 / 74 70
233ACV1B_HUMAN35 90% 0.551 PF08515 C1_S163 - (2)20 1 / 22 / 13 16
234MINK1_HUMAN86 90% 0.576 PF00069 C2_S1103 - (20)20 2 / 40 / 44 35
235KS6A2_HUMAN69 90% 0.609 PF00433 C2_S180 - (13)20 2 / 44 / 23 31
236WNK3_HUMAN67 90% 0.513 PF02196 C1_S182 - (4)20 4 / 53 / 12 28
237YES_HUMAN68 90% 0.841 PF00018 C2_S175 - (4)20 21 / 34 / 14 36
238KS6A6_HUMAN59 89% 0.547 PF00433 C3_S177 - (13)20 2 / 42 / 17 27
239WNK2_HUMAN63 89% 0.538 PF02196 C1_S176 - (3)20 4 / 52 / 9 28
240TAOK1_HUMAN91 88% 0.585 PF00069 C1_S1102 - (19)20 5 / 37 / 49 37
241KC1G1_HUMAN54 88% 0.525 PF00069 C1_S184 - (8)20 - / 18 / 40 22
242KC1G2_HUMAN54 88% 0.499 PF00069 C1_S182 - (8)20 - / 18 / 40 22
243CDK19_HUMAN105 88% 0.566 PF00069 C1_S1147 - (8)20 4 / 18 / 90 88
244CSF1R_HUMAN64 87% 0.541 PF07714 C7_S175 - (2)20 24 / 35 / 5 35
245CLK4_HUMAN20 87% 0.495 PF00069 C1_S133 - (9)20 1 / 14 / 11 12
246AKT3_HUMAN72 86% 0.512 PF00433 C1_S191 - (14)20 4 / 56 / 12 38
247MP2K2_HUMAN54 86% 0.641 PF00069 C1_S1124 - (46)20 8 / 49 / 25 22
248GSK3A_HUMAN87 86% 0.814 PF00069 C1_S1112 - (18)20 3 / 31 / 51 45
249BMR1A_HUMAN77 85% 0.528 PF08515 C1_S198 - (0)20 3 / 59 / 16 28
250MARK4_HUMAN29 85% 0.527 PF00069 C3_S185 - (9)20 1 / 16 / 9 14

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