Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000000823 (STRA3: Streptococcus agalactiae serotype III - 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]
1gbs049420 100% 0.544 PF01408 31 - (9)? - / - / - 0
2gbs091415 100% 0.579 PF09711 9 - (1)2 - / - / - 0
3gbs15297 100% 0.340 PF04650 10 - (0)? - / - / - 0
4gbs063220 100% 0.436 PF00092 0 - (0)? - / - / - 0
5gbs063120 100% 0.482 -0 - (0)? - / - / - 0
6gbs116720 100% 0.723 PF06971 C6_S133 - (0)2 4 / 1 / - 1
7gbs14134 100% 0.353 PF01230 17 - (0)? - / - / - 0
8gbs090920 100% 0.757 PF13344 C1_S115 - (3)2 - / - / 2 0
9gbs181128 100% 0.507 PF00044 C1_S118 - (10)3 6 / 2 / - 2
10gbs188921 100% 0.521 PF07470 C1_S115 - (0)7 - / 1 / 4 2
11gbs062816 100% 0.444 PF00746 0 - (0)? - / - / - 0
12gbs062915 100% 0.637 PF05737 0 - (0)? - / - / - 0
13gbs107416 100% 0.631 PF06013 1 - (0)? - / - / - 0
14gbs030620 100% 0.537 PF00481 C1_S15 - (0)2 - / - / 1 0
15gbs141219 100% 0.668 PF02645 C6_S128 - (0)3 - / 3 / 1 2
16gbs186220 100% 0.466 PF01820 46 - (25)? - / - / - 0
17gbs189012 100% 0.510 PF03830 C2_S15 - (0)2 - / - / 3 0
18gbs202620 99% 0.571 PF01048 89 - (0)? - / - / - 0
19gbs189212 99% 0.624 PF02502 C4_S119 - (0)1 - / - / 1 1
20gbs146721 99% 0.576 PF02833 C2_S117 - (0)4 - / - / 7 1
21gbs189124 99% 0.528 PF00106 C1_S161 - (46)5 1 / - / 3 1
22gbs066112 99% 0.442 PF01223 5 - (0)? - / - / - 0
23gbs094919 99% 0.592 PF02038 0 - (0)? - / - / - 0
24gbs128820 99% 0.553 PF02922 C1_S134 - (0)5 - / - / 2 2
25gbs199118 99% 0.577 PF00583 C1_S135 - (0)2 - / - / 2 1
26gbs063022 99% 0.440 PF02038 C4_S111 - (0)2 - / - / 3 0
27gbs162019 99% 0.499 PF00583 40 - (10)? - / - / - 0
28gbs127023 98% 0.777 PF08124 C1_S129 - (0)10 1 / 1 / 9 3
29gbs046818 98% 0.708 PF00440 C1_S118 - (0)2 - / - / 6 1
30gbs170518 98% 0.642 PF01966 C6_S15 - (0)2 - / 2 / 2 2
31gbs162219 98% 0.592 PF03932 10 - (2)? - / - / - 0
32gbs052210 97% 0.644 PF08245 C1_S139 - (19)1 - / - / 1 0
33gbs147620 97% 0.469 -0 - (0)? - / - / - 0
34gbs20576 97% 0.470 PF08951 2 - (0)? - / - / - 0
35gbs060857 96% 0.608 PF03952 C1_S142 - (34)11 - / 3 / 31 7
36gbs109613 96% 0.197 PF03099 13 - (4)? - / - / - 0
37gbs035519 96% 0.455 PF03816 15 - (0)? - / - / - 0
38gbs132963 94% 0.817 PF00232 C3_S188 - (66)20 - / - / 44 23
39gbs127122 94% 0.772 PF01370 C1_S175 - (68)4 23 / - / - 2
40gbs125157 94% 0.550 PF01048 C1_S166 - (46)20 - / - / 45 15
41gbs008014 94% 0.621 PF01176 1 - (0)? - / - / - 0
42gbs157225 93% 0.644 PF00696 C1_S128 - (19)7 - / 3 / 4 3
43gbs061616 92% 0.522 PF05163 13 - (0)? - / - / - 0
44gbs110912 92% 0.376 PF00472 2 - (0)? - / - / - 0
45gbs212222 91% 0.584 PF02274 C3_S112 - (7)4 - / - / 3 2
46gbs185513 91% 0.524 PF02302 2 - (0)? - / - / - 0
47gbs185334 90% 0.634 PF00215 C1_S142 - (37)11 - / - / 27 6
48gbs029418 89% 0.689 PF02664 C4_S15 - (4)? - / - / 2 0
49gbs202327 88% 0.597 PF01676 C7_S117 - (4)7 - / - / 8 3
50gbs086420 88% 0.473 PF00557 C3_S152 - (1)2 - / - / 3 1

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