Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000000534 (WOLTR: Wolbachia sp. subsp. Brugia malayi - Nov 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]
1Wbm011291 66% 0.519 PF00557 C1_S185 - (1)20 - / 9 / 64 37
2Wbm059349 43% 0.552 PF01702 C7_S151 - (23)20 - / 13 / 25 28
3Wbm017975 43% 0.575 PF13288 C4_S1120 - (57)20 27 / 18 / 34 20
4Wbm004660 48% 0.610 PF02401 C10_S1117 - (0)20 - / 2 / 78 15
5Wbm076453 65% 0.586 PF01751 C2_S162 - (0)20 6 / 20 / 12 15
6Wbm071773 63% 0.441 PF00334 C8_S165 - (57)20 - / 22 / 38 14
7Wbm080447 42% 0.524 PF01255 C10_S1102 - (28)20 1 / 18 / 24 14
8Wbm054831 45% 0.437 PF03119 C2_S150 - (32)19 - / 17 / 12 14
9Wbm072588 46% 0.502 PF09281 C4_S1307 - (199)20 46 / 28 / 11 13
10Wbm049585 65% 0.597 PF00012 C3_S1105 - (0)20 14 / 48 / 12 9
11Wbm068452 43% 0.600 PF00162 C10_S185 - (75)19 - / 20 / 26 9
12Wbm011476 49% 0.507 PF01327 C7_S1111 - (30)20 - / 9 / 52 9
13Wbm073953 57% 0.510 PF02801 C3_S153 - (5)20 - / 7 / 19 9
14Wbm008729 48% 0.370 PF01409 C4_S123 - (16)10 2 / 3 / 7 9
15Wbm075989 42% 0.589 PF00012 C2_S1106 - (0)20 4 / 54 / 17 9
16Wbm047226 54% 0.547 PF07973 C1_S128 - (11)14 1 / 15 / 2 8
17Wbm004235 47% 0.590 PF02774 C1_S163 - (35)20 12 / 11 / 14 8
18Wbm040861 40% 0.487 PF00121 C5_S163 - (50)20 - / - / 43 8
19Wbm047078 65% 0.531 PF00106 C1_S1151 - (84)20 29 / 40 / 10 8
20Wbm080155 50% 0.507 PF01467 C3_S1101 - (83)14 2 / 15 / 32 8
21Wbm027344 48% 0.562 PF00709 C3_S173 - (54)18 - / 32 / 10 7
22Wbm048020 38% 0.548 PF00408 C2_S113 - (12)12 - / 3 / 8 7
23Wbm007328 50% 0.620 PF02882 C7_S149 - (38)14 10 / 13 / 8 6
24Wbm017830 39% 0.519 PF00005 C1_S138 - (0)12 - / 8 / 13 6
25Wbm024470 69% 0.642 PF00056 C4_S1111 - (83)19 47 / 12 / 6 6
26Wbm011958 61% 0.496 PF03952 C1_S142 - (33)9 - / 3 / 30 6
27Wbm008841 41% 0.457 PF12804 C3_S141 - (27)12 2 / 25 / 2 6
28Wbm074151 45% 0.488 PF02511 C12_S1323 - (285)13 - / 16 / 34 6
29Wbm042039 59% 0.577 PF00551 C4_S1125 - (15)14 1 / 17 / 9 6
30Wbm036124 54% 0.550 PF07973 C1_S124 - (22)14 2 / 4 / 7 6
31Wbm017723 47% 0.531 PF01113 C6_S141 - (24)10 7 / 8 / 2 5
32Wbm070842 45% 0.614 PF00271 C3_S1117 - (0)9 - / 7 / 14 5
33Wbm019524 45% 0.623 PF02502 C3_S149 - (36)12 - / - / 9 5
34Wbm004127 41% 0.486 PF02222 C1_S148 - (34)9 - / 7 / 13 5
35Wbm060252 51% 0.508 PF00091 C3_S156 - (0)10 - / 15 / 27 5
36Wbm045533 50% 0.424 PF02786 C3_S159 - (26)9 - / 11 / 7 5
37Wbm058032 45% 0.641 PF00625 C5_S151 - (38)14 5 / 13 / 6 5
38Wbm042734 66% 0.502 PF00154 C2_S131 - (0)11 - / 15 / 9 5
39Wbm036741 40% 0.478 PF00180 C5_S161 - (50)16 - / 7 / 18 5
40Wbm024035 47% 0.632 PF01230 C6_S177 - (0)11 - / 3 / 13 5
41Wbm067738 45% 0.549 PF08402 C1_S129 - (0)10 - / - / 18 5
42Wbm002333 47% 0.565 PF00005 C1_S138 - (0)10 - / 8 / 16 5
43Wbm021720 39% 0.528 PF00814 C2_S124 - (22)7 - / 10 / 2 5
44Wbm022830 55% 0.428 PF01746 C4_S129 - (18)12 - / 21 / 2 5
45Wbm022732 59% 0.437 PF01259 C2_S164 - (47)8 - / 24 / 7 5
46Wbm022327 44% 0.571 PF01380 C2_S117 - (16)9 - / - / 11 5
47Wbm025220 51% 0.471 PF05496 C2_S123 - (0)7 4 / 5 / 6 4
48Wbm046423 47% 0.448 PF00587 C1_S126 - (26)3 - / 5 / 3 4
49Wbm071949 35% 0.583 PF00762 C7_S1151 - (0)10 18 / 3 / 23 4
50Wbm039726 59% 0.679 PF00731 C5_S134 - (24)12 - / 1 / 17 4

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