Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
PK_HUMAN_I30_2020M9 (2020 - Homo sapiens - Protein Kinase family)

Download : Data.csv | 3D Common Core | 3D Models | DB.fasta


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]
50CDK12_HUMAN510 100% 0.12 PF00069 C3_S1549 - (45)20 7 / 262 / 228 172
51CDK13_HUMAN509 100% 0.12 PF00069 C4_S1549 - (47)20 9 / 264 / 223 164
52CDK14_HUMAN508 61% 0.34 PF00069 C1_S1557 - (46)20 6 / 241 / 252 311
53CDK15_HUMAN508 56% 0.35 PF00069 C1_S1559 - (43)20 6 / 239 / 253 304
54CDK16_HUMAN510 99% 0.30 PF00069 C1_S1567 - (47)20 8 / 245 / 250 318
55CDK17_HUMAN513 81% 0.33 PF00069 C1_S1569 - (47)20 8 / 245 / 249 312
56CDK18_HUMAN509 78% 0.32 PF00069 C1_S1567 - (47)20 8 / 243 / 252 315
57CDK19_HUMAN504 93% 0.39 PF00069 C3_S1557 - (39)20 8 / 228 / 256 281
58CDK1_HUMAN524 100% 0.51 PF00069 C1_S1584 - (47)20 11 / 283 / 217 333
59CDK20_HUMAN509 46% 0.47 PF00069 C1_S1569 - (46)20 5 / 249 / 242 315
60CDK2_HUMAN517 100% 0.81 PF00069 C1_S1576 - (47)20 11 / 281 / 215 331
61CDK3_HUMAN518 78% 0.57 PF00069 C1_S1573 - (46)20 9 / 281 / 217 330
62CDK4_HUMAN508 100% 0.45 PF00069 C1_S1548 - (40)20 8 / 250 / 232 319
63CDK5_HUMAN521 100% 0.52 PF00069 C1_S1569 - (44)20 9 / 280 / 215 324
64CDK6_HUMAN512 100% 0.72 PF00069 C1_S1545 - (41)20 8 / 256 / 233 324
65CDK7_HUMAN514 100% 0.44 PF00069 C1_S1566 - (45)20 5 / 238 / 260 320
66CDK8_HUMAN503 100% 0.43 PF00069 C2_S1565 - (39)20 8 / 226 / 259 278
67CDK9_HUMAN515 100% 0.45 PF00069 C1_S1569 - (42)20 8 / 259 / 226 297
68CDKL1_HUMAN509 99% 0.42 PF00069 C1_S1569 - (43)20 7 / 235 / 259 310
69CDKL2_HUMAN492 99% 0.33 PF00069 C3_S1554 - (42)20 3 / 224 / 254 256
70CDKL3_HUMAN509 99% 0.28 PF00069 C3_S1562 - (38)20 3 / 224 / 269 190
71CDKL4_HUMAN507 71% 0.42 PF00069 C1_S1562 - (36)19 3 / 192 / 302 307
72CDKL5_HUMAN513 99% 0.14 PF00069 C1_S1576 - (48)20 3 / 222 / 276 141
73CHK1_HUMAN411 100% 0.31 PF00069 C3_S1477 - (64)20 14 / 197 / 177 201
74CHK2_HUMAN373 100% 0.40 PF00069 C1_S1447 - (77)20 11 / 149 / 195 150
75CLK1_HUMAN95 100% 0.38 PF00069 C1_S1115 - (8)20 7 / 64 / 19 35
76CLK2_HUMAN106 100% 0.37 PF00069 C1_S1148 - (6)20 6 / 74 / 16 32
77CLK3_HUMAN107 100% 0.26 PF00069 C1_S1142 - (8)20 1 / 70 / 30 30
78CLK4_HUMAN79 100% 0.38 PF00069 C2_S198 - (4)20 5 / 56 / 12 31
79CSF1R_HUMAN470 88% 0.16 PF00018 C7_S1554 - (64)20 77 / 167 / 196 83
80CSK21_HUMAN238 100% 0.65 PF00069 C1_S1329 - (52)18 16 / 93 / 100 78
81CSK22_HUMAN200 100% 0.73 PF00069 C1_S1238 - (46)20 6 / 89 / 84 25
82CSK23_HUMAN236 99% 0.65 PF00069 C1_S1320 - (53)20 16 / 93 / 99 74
83CSK_HUMAN513 100% 0.59 PF00018 C2_S1608 - (32)20 133 / 220 / 145 200
84CSKP_HUMAN50 100% 0.20 PF00069 C4_S147 - (18)20 - / 14 / 24 10
85CTRO_HUMAN350 45% 0.10 PF00069 C4_S1435 - (89)20 9 / 119 / 146 52
86DAPK1_HUMAN225 100% 0.11 PF00069 C5_S1246 - (50)20 2 / 80 / 121 40
87DAPK2_HUMAN243 100% 0.43 PF00069 C1_S1282 - (52)19 7 / 85 / 119 95
88DAPK3_HUMAN184 100% 0.34 PF00069 C3_S1220 - (36)20 4 / 74 / 86 63
89DCLK1_HUMAN341 100% 0.19 PF00069 C1_S1429 - (65)20 6 / 107 / 206 84
90DCLK2_HUMAN247 76% 0.16 PF00069 C1_S1290 - (60)20 3 / 63 / 156 47
91DCLK3_HUMAN265 56% 0.21 PF00069 C1_S1328 - (80)20 3 / 88 / 150 73
92DDR1_HUMAN491 100% 0.20 PF00018 C1_S1594 - (75)20 151 / 207 / 128 107
93DDR2_HUMAN494 100% 0.17 PF00018 C1_S1548 - (80)20 140 / 204 / 133 108
94DMPK_HUMAN243 100% 0.34 PF00069 C4_S1332 - (46)20 6 / 83 / 121 85
95DUSTY_HUMAN35 45% 0.14 PF00433 C5_S147 - (2)17 - / 12 / 15 0
96DYR1A_HUMAN98 100% 0.24 PF00069 C2_S1104 - (11)20 - / 56 / 21 21
97DYR1B_HUMAN362 83% 0.29 PF00069 C1_S1415 - (53)20 2 / 195 / 141 75
98DYRK2_HUMAN144 100% 0.35 PF00069 C1_S1199 - (12)19 - / 78 / 51 47
99DYRK3_HUMAN124 100% 0.37 PF00069 C1_S1172 - (10)20 - / 67 / 48 39
100DYRK4_HUMAN112 61% 0.40 PF00069 C1_S1144 - (12)20 - / 74 / 32 43

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