Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000000804 (Helicobacter pylori - Dec 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]
1jhp_11640 38% 0.265 -1 - (0)? - / - / - 0
2jhp_12510 28% -0.252 -6 - (0)? - / - / - 0
3jhp_12789 33% 0.403 -3 - (0)? - / - / - 0
4jhp_13562 12% 0.461 -0 - (0)? - / - / - 0
5jhp_13620 30% 0.152 -23 - (0)? - / - / - 0
6jhp_02500 21% 0.340 -0 - (0)? - / - / - 0
7jhp_00354 28% 0.330 -2 - (0)? - / - / - 0
8jhp_03960 55% 0.117 -0 - (0)? - / - / - 0
9jhp_07720 23% 0.154 -0 - (0)? - / - / - 0
10jhp_08341 61% 0.245 -4 - (0)? - / - / - 0
11jhp_09160 42% 0.279 -2 - (0)? - / - / - 0
12jhp_09234 31% 0.344 -0 - (0)? - / - / - 0
13jhp_01646 45% 0.286 PF00004 9 - (0)? - / - / - 0
14jhp_114120 45% 0.620 PF00005 17 - (0)? - / - / - 0
15jhp_01182 33% 0.556 PF00005 15 - (0)? - / - / - 0
16jhp_078919 42% 0.459 PF00005 17 - (0)? - / - / - 0
17jhp_030010 34% 0.393 PF00005 7 - (0)? - / - / - 0
18jhp_054729 34% 0.317 PF00005 C2_S127 - (26)6 - / 11 / 2 4
19jhp_082120 38% 0.409 PF00005 11 - (0)? - / - / - 0
20jhp_016720 41% 0.436 PF00005 43 - (0)? - / - / - 0
21jhp_023522 37% 0.498 PF00005 C3_S138 - (0)5 - / - / 5 3
22jhp_135820 40% 0.519 PF00005 C1_S138 - (0)4 - / 7 / 1 2
23jhp_028633 38% 0.467 PF00005 C1_S183 - (0)10 - / 2 / 14 5
24jhp_01921 50% 0.270 PF00005 14 - (0)? - / - / - 0
25jhp_034332 39% 0.441 PF00005 C3_S176 - (76)7 - / 9 / 6 4
26jhp_065321 55% 0.593 PF00005 C1_S124 - (0)4 - / 4 / 3 2
27jhp_112939 44% 0.367 PF00005 C1_S168 - (67)5 - / 19 / - 3
28jhp_06709 25% 0.142 PF00005 5 - (0)? - / - / - 0
29jhp_09173 47% 0.207 PF00005 24 - (24)? - / - / - 0
30jhp_019118 20% 0.269 PF00005 5 - (5)? - / - / - 0
31jhp_064418 53% 0.495 PF00005 5 - (0)? - / - / - 0
32jhp_124114 18% 0.233 PF00005 3 - (0)? - / - / - 0
33jhp_12671 47% 0.415 PF00005 4 - (2)? - / - / - 0
34jhp_04910 36% 0.306 PF00010 2 - (0)? - / - / - 0
35jhp_02402 43% 0.620 PF00010 0 - (0)? - / - / - 0
36jhp_010188 66% 0.627 PF00012 C3_S1102 - (0)20 12 / 51 / 12 9
37jhp_128718 51% 0.599 PF00012 C1_S135 - (0)3 - / 3 / - 2
38jhp_07800 35% 0.340 PF00012 2 - (0)? - / - / - 0
39jhp_00547 34% 0.349 PF00012 7 - (0)? - / - / - 0
40jhp_091217 44% 0.528 PF00012 16 - (0)? - / - / - 0
41jhp_13445 97% 0.625 PF00013 5 - (0)? - / - / - 0
42jhp_03540 34% 0.224 PF00015 2 - (0)? - / - / - 0
43jhp_009110 47% 0.519 PF00015 1 - (0)? - / - / - 0
44jhp_00756 61% 0.458 PF00015 0 - (0)? - / - / - 0
45jhp_009517 97% 0.553 PF00015 C2_S112 - (0)8 - / - / 6 3
46jhp_09300 36% 0.123 PF00017 0 - (0)? - / - / - 0
47jhp_117110 40% 0.465 PF00018 4 - (0)? - / - / - 0
48jhp_10330 50% 0.100 PF00018 3 - (0)? - / - / - 0
49jhp_12683 42% 0.287 PF00018 1 - (0)? - / - / - 0
50jhp_09370 28% ? PF00018 4 - (2)? - / - / - 0

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