Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
CASP11 (Apr 2014)

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)		 Modeller
(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]
 [Best Score]
 Main Code
 [Name]
 [Number]
 [Number]
 Distribution of CDocking pKd
 [Number]
1T085820 26% 0.432 0.468 PF02055 C7_S122 - (11)1 - / - / 1 -
2T08570 37% 0.372 0.313 PF01833 2 - (0)0 - / - / - -
3T085612 27% 0.288 0.485 PF00622 6 - (0)0 - / - / - -
4T08550 16% 0.302 0.224PF05963 0 - (0)0 - / - / - -
5T085416 35% 0.456 0.574 PF00702 13 - (9)0 - / - / - -
6T08531 38% 0.252 0.367 PF02887 5 - (2)0 - / - / - -
7T085218 23% 0.345 0.321 PF00756 16 - (0)0 - / - / - -
8T085120 31% 0.488 0.558 PF03721 C1_S133 - (16)2 - / 1 / 1 -
9T08500 47% 0.173 0.317 PF00397 1 - (0)0 - / - / - -
10T08499 27% 0.433 0.556 PF02798 17 - (6)0 - / - / - -
11T08480 21% 0.178 0.205PF04379 10 - (3)0 - / - / - -
12T084714 30% 0.373 0.491 PF14676 3 - (0)0 - / - / - -
13T08460 30% 0.346 0.485 PF06133 2 - (0)0 - / - / - -
14T084516 23% 0.205 0.345 PF00058 7 - (0)0 - / - / - -
15T08440 40% 0.267 0.290PF06133 1 - (0)0 - / - / - -
16T084320 32% 0.479 0.531 PF01041 48 - (24)0 - / - / - -
17T08420 33% 0.205 0.302 PF03852 3 - (1)0 - / - / - -
18T084120 100% 0.514 0.557 PF00089 15 - (0)0 - / - / - -
19T084020 100% 0.396 0.483 PF01833 8 - (0)1 - / - / - -
20T08398 26% 0.351 0.430 PF07651 4 - (0)0 - / - / - -
21T08382 24% 0.286 0.453 PF09032 3 - (1)0 - / - / - -
22T08370 41% 0.315 0.363 PF00072 1 - (0)0 - / - / - -
23T08360 53% -0.027 -PF00240 4 - (0)0 - / - / - -
24T083513 19% 0.327 0.415 PF00759 21 - (0)0 - / - / - -
25T08340 27% 0.167 0.250PF07654 1 - (0)0 - / - / - -
26T08334 45% 0.249 0.331 PF03388 6 - (0)0 - / - / - -
27T08320 32% 0.180 0.361 PF01213 5 - (2)0 - / - / - -
28T08314 26% 0.271 0.324 PF13176 3 - (0)0 - / - / - -
29T08302 34% 0.173 0.250PF02516 4 - (0)0 - / - / - -
30T08290 23% 0.362 0.424 PF01491 1 - (0)0 - / - / - -
31T082810 31% 0.207 0.210PF14852 3 - (0)0 - / - / - -
32T08270 20% 0.240 0.342 PF01381 2 - (0)0 - / - / - -
33T082615 18% 0.169 0.240PF01663 4 - (0)0 - / - / - -
34T082520 99% 0.593 0.632 PF00400 0 - (0)0 - / - / - -
35T08240 19% 0.093 0.281PF05963 0 - (0)0 - / - / - -
36T082320 30% 0.403 0.437 PF00248 27 - (18)0 - / - / - -
37T08222 37% 0.264 0.241PF05963 2 - (0)0 - / - / - -
38T082119 38% 0.364 0.471 PF00515 C1_S17 - (0)2 - / - / 1 -
39T08200 43% 0.262 0.401 PF05198 2 - (0)0 - / - / - -
40T081920 30% 0.504 0.619 PF00155 C1_S119 - (15)3 - / - / 3 -
41T08180 28% 0.353 0.377 PF00400 22 - (1)0 - / - / - -
42T081720 29% 0.439 0.515 PF00496 41 - (0)0 - / - / - -
43T08160 42% 0.789 0.710 PF01806 2 - (0)0 - / - / - -
44T081519 50% 0.460 0.601 PF02136 18 - (2)0 - / - / - -
45T08144 27% 0.132 0.205PF01833 4 - (0)0 - / - / - -
46T081320 35% 0.483 0.536 PF03446 23 - (17)0 - / - / - -
47T08090 36% 0.062 0.172PF00268 0 - (0)0 - / - / - -
48T08083 20% 0.157 0.241PF01494 13 - (4)0 - / - / - -
49T080720 33% 0.561 0.584 PF00248 C3_S132 - (21)8 2 / - / 2 -
50T08060 39% 0.219 0.286PF00790 8 - (0)0 - / - / - -

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