Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
PK_HUMAN_I30_2020BIS (2020 - Homo sapiens - Protein Kinase family)

Download : Data.csv | 3D Common Core | 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]
1STK39_HUMAN237 100% 0.32 PF00069 C4_S1349 - (53)20 4 / 97 / 109 45
2ZAP70_HUMAN360 100% 0.55 PF00018 C2_S1420 - (63)20 77 / 182 / 94 136
3CLK3_HUMAN107 100% 0.26 PF00069 C1_S1142 - (8)20 1 / 70 / 30 30
4ROR2_HUMAN299 100% 0.17 PF07714 C2_S1348 - (53)20 12 / 111 / 159 96
5M3K7_HUMAN211 100% 0.23 PF07714 C3_S1280 - (29)20 26 / 89 / 83 62
6DDR2_HUMAN494 100% 0.17 PF00018 C1_S1548 - (80)20 140 / 204 / 133 108
7SRC_HUMAN320 100% 0.72 PF00018 C2_S1353 - (19)20 124 / 119 / 57 132
8OXSR1_HUMAN164 100% 0.27 PF00069 C2_S1239 - (46)20 - / 80 / 79 34
9FLT3_HUMAN490 100% 0.16 PF00018 C3_S1577 - (54)20 45 / 139 / 275 93
10RAF1_HUMAN187 100% 0.24 PF02196 C4_S1231 - (10)20 81 / 65 / 24 63
11PLK1_HUMAN296 100% 0.27 PF00069 C1_S10 - (0)? 17 / 109 / 160 181
12M3K12_HUMAN119 100% 0.16 PF07714 C1_S1155 - (7)20 28 / 46 / 29 27
13TRIO_HUMAN10 100% 0.06 PF00621 C4_S10 - (0)? - / - / - 0
14TNIK_HUMAN172 100% 0.12 PF00069 C2_S1243 - (24)20 5 / 96 / 59 38
15KCC1D_HUMAN354 100% 0.42 PF00069 C1_S1414 - (51)19 19 / 158 / 158 198
16DDR1_HUMAN491 100% 0.20 PF00018 C1_S1594 - (75)20 151 / 207 / 128 107
17ST17B_HUMAN190 100% 0.41 PF00069 C1_S1241 - (46)20 4 / 80 / 82 64
18MK14_HUMAN453 100% 0.78 PF00069 C1_S1541 - (40)20 110 / 210 / 110 307
19M4K3_HUMAN206 100% 0.17 PF00069 C2_S1239 - (48)20 12 / 101 / 84 52
20ROS1_HUMAN473 100% 0.07 PF00018 C4_S1529 - (74)20 42 / 238 / 190 55
21WEE1_HUMAN27 100% 0.22 PF00069 C1_S122 - (0)4 2 / 3 / 5 3
22KKCC2_HUMAN318 100% 0.26 PF00069 C1_S1375 - (93)20 14 / 121 / 146 77
23MK06_HUMAN311 100% 0.25 PF00069 C1_S1390 - (44)20 11 / 78 / 177 140
24EPHB4_HUMAN489 100% 0.18 PF00018 C2_S1519 - (45)20 139 / 199 / 138 155
25ABL2_HUMAN504 100% 0.33 PF00018 C5_S1582 - (32)20 157 / 225 / 120 130
26PDPK1_HUMAN364 100% 0.28 PF00069 C3_S1446 - (108)20 17 / 155 / 173 125
27MP2K6_HUMAN88 100% 0.38 PF00069 C1_S1130 - (56)20 4 / 37 / 42 24
28TAF1_HUMAN30 100% 0.11 PF00439 C7_S126 - (0)19 2 / 15 / 3 6
29WNK1_HUMAN143 100% 0.08 PF02196 C2_S1179 - (14)20 23 / 90 / 22 11
30CDK12_HUMAN510 100% 0.12 PF00069 C3_S1549 - (45)20 7 / 262 / 228 172
31TTK_HUMAN69 100% 0.18 PF00069 C1_S1132 - (1)20 16 / 30 / 15 33
32MARK4_HUMAN415 100% 0.28 PF00069 C3_S1494 - (40)20 11 / 151 / 224 161
33PDK1_HUMAN59 100% 0.49 PF02518 C7_S156 - (37)20 2 / 21 / 30 14
34PLK4_HUMAN285 100% 0.12 PF00069 C2_S1364 - (63)20 9 / 125 / 136 58
35PAK6_HUMAN31 100% 0.24 PF00069 C2_S118 - (3)7 1 / 14 / 11 7
36PAK4_HUMAN64 100% 0.28 PF00069 C3_S161 - (6)20 - / 24 / 22 14
37CDK1_HUMAN524 100% 0.51 PF00069 C1_S1584 - (47)20 11 / 283 / 217 333
38ARBK1_HUMAN152 100% 0.49 PF00615 C2_S1206 - (45)20 4 / 63 / 70 45
39FGFR2_HUMAN261 100% 0.21 PF07714 C6_S1326 - (50)20 67 / 107 / 77 107
40ALK_HUMAN391 100% 0.10 PF00018 C2_S1459 - (57)20 98 / 176 / 99 94
41BTK_HUMAN502 100% 0.36 PF00018 C3_S1546 - (31)20 181 / 209 / 106 213
42HASP_HUMAN21 100% 0.23 -C3_S121 - (14)13 - / 10 / 9 17
43CDK9_HUMAN515 100% 0.45 PF00069 C1_S1569 - (42)20 8 / 259 / 226 297
44WNK3_HUMAN102 100% 0.10 PF02196 C4_S1132 - (12)20 25 / 55 / 20 10
45CLK2_HUMAN106 100% 0.37 PF00069 C1_S1148 - (6)20 6 / 74 / 16 32
46BMPR2_HUMAN129 100% 0.17 PF08515 C4_S1171 - (7)20 18 / 78 / 29 30
47KCC1A_HUMAN335 100% 0.41 PF00069 C1_S1414 - (57)19 14 / 159 / 145 165
48INSR_HUMAN32 100% 0.27 PF01030 C2_S116 - (0)2 - / - / - 0
49PDPK2_HUMAN373 100% 0.39 PF00069 C3_S1456 - (111)20 17 / 163 / 174 151
50M3K5_HUMAN226 100% 0.09 PF00069 C4_S1380 - (24)17 12 / 88 / 85 30

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