Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000001570 (Bacillus subtilis - May 2016)

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]
1bsu0127020 100% 0.554 PF00467 0 - (0)? - / - / - 0
2bsu179003 100% 0.514 PF10747 4 - (0)2 - / - / - 0
3bsu126604 100% 0.522 PF09393 0 - (0)? - / - / - 0
4bsu1841048 100% 0.612 PF01019 C3_S143 - (24)7 - / - / 22 5
5bsu072006 100% 0.472 PF01027 0 - (0)? - / - / - 0
6bsu1849018 100% 0.695 PF02334 C3_S119 - (0)2 - / 2 / 6 0
7bsu121506 100% 0.518 PF14172 C3_S17 - (0)1 - / - / 1 1
8bsu246503 100% 0.347 PF13028 2 - (0)? - / - / - 0
9bsu2235016 100% 0.790 PF07261 0 - (0)? - / - / - 0
10bsu1413018 100% 0.535 PF00571 9 - (0)? - / - / - 0
11bsu3593029 100% 0.571 PF05025 C3_S128 - (0)6 - / - / 12 1
12bsu0209027 100% 0.517 PF00905 C3_S162 - (0)7 - / - / 7 3
13bsu0705013 100% 0.675 PF08441 C6_S117 - (0)6 - / 1 / 4 2
14bsu2208020 100% 0.595 PF02074 3 - (0)? - / - / - 0
15bsu3109031 100% 0.548 PF02254 C3_S150 - (0)3 - / 11 / 2 3
16bsu2556019 100% 0.611 PF06144 8 - (0)? - / - / - 0
17bsu0305051 100% 0.625 PF00056 C5_S161 - (53)6 14 / 16 / 2 2
18bsu2347017 100% 0.643 PF01740 5 - (0)? - / - / - 0
19bsu0386015 100% 0.596 PF00881 C4_S162 - (40)2 - / 6 / - 1
20bsu0644020 100% 0.581 PF00206 C3_S117 - (6)3 - / - / 4 1
21bsu0910019 100% 0.850 PF00313 C4_S139 - (0)4 2 / 2 / - 0
22bsu3830020 100% 0.804 PF02110 C5_S126 - (17)4 - / - / 5 2
23bsu2287021 100% 0.554 PF01070 C3_S139 - (14)2 1 / 1 / - 2
24bsu1317023 100% 0.464 PF00383 C7_S144 - (8)4 - / - / 6 1
25bsu0118020 100% 0.410 PF00276 1 - (0)? - / - / - 0
26bsu064609 100% 0.555 PF02700 6 - (0)? - / - / - 0
27bsu342106 100% 0.725 PF09628 1 - (0)? - / - / - 0
28bsu1816016 100% 0.624 PF04616 C1_S129 - (0)5 - / - / 5 2
29bsu3631019 100% 0.470 PF00436 C2_S123 - (0)2 - / 2 / 1 0
30bsu0117020 100% 0.449 PF00573 0 - (0)? - / - / - 0
31bsu3574014 100% 0.592 PF01467 C3_S128 - (20)4 - / 8 / 1 2
32bsu1739021 100% 0.574 PF00268 C7_S12 - (0)2 - / - / 1 1
33bsu1355022 100% 0.573 PF01008 C6_S16 - (4)2 - / - / 2 1
34bsu0300019 100% 0.584 PF04069 C2_S120 - (0)6 - / - / 8 3
35bsu222705 100% 0.806 PF00790 21 - (0)? - / - / - 0
36bsu1152014 100% 0.834 PF05389 1 - (0)? - / - / - 0
37bsu1615019 100% 0.582 PF00227 0 - (0)? - / - / - 0
38bsu3324020 100% 0.807 PF06560 19 - (17)? - / - / - 0
39bsu0465016 100% 0.470 PF01402 2 - (0)? - / - / - 0
40bsu0660025 100% 0.692 PF01884 C2_S127 - (0)7 - / 2 / 6 3
41bsu0782011 100% 0.465 PF07702 4 - (0)? - / - / - 0
42bsu3970019 100% 0.605 PF02894 C1_S139 - (0)9 - / 10 / 3 3
43bsu1605013 100% 0.589 PF01926 C11_S114 - (0)5 - / 7 / 1 4
44bsu1719020 100% 0.559 PF14765 C2_S12 - (0)? - / - / 1 0
45bsu4100020 100% 0.555 PF02527 C1_S19 - (0)? - / 1 / - 0
46bsu1773018 100% 0.414 PF08327 1 - (0)? - / - / - 0
47bsu313213 100% 0.376 PF11458 0 - (0)? - / - / - 0
48bsu1448016 100% 0.370 PF04014 C3_S17 - (7)? - / - / 3 0
49bsu1920014 100% 0.607 PF00072 10 - (0)1 - / - / - 0
50bsu3252034 100% 0.589 PF00266 C1_S140 - (26)13 - / 1 / 11 2

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