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]
1bsu1962024 100% 0.525 PF01079 C8_S115 - (0)6 - / - / 6 3
2bsu3034059 100% 0.669 PF13426 C2_S177 - (0)3 20 / 18 / 7 2
3bsu3063014 100% 0.524 PF00293 C3_S116 - (0)2 - / 1 / 2 2
4bsu3524017 100% 0.589 PF00595 C2_S125 - (0)? - / 3 / 3 0
5bsu2163020 100% 0.557 PF02522 C2_S114 - (0)3 3 / 9 / 1 1
6bsu1919019 100% 0.513 PF07730 C2_S116 - (14)5 - / 7 / 3 3
7bsu3988011 100% 0.595 PF08007 38 - (0)? - / - / - 0
8bsu2207012 100% 0.606 PF00156 C1_S124 - (10)3 - / 2 / 2 2
9bsu2881021 100% 0.619 PF04616 C1_S122 - (0)4 - / 1 / 2 1
10bsu1038016 100% 0.774 PF00015 C5_S119 - (0)2 6 / - / - 1
11bsu0128020 100% 0.561 PF00673 0 - (0)? - / - / - 0
12bsu0706012 100% 0.680 PF01839 C7_S116 - (0)7 - / - / 6 1
13bsu0630020 100% 0.583 PF07732 C3_S119 - (8)5 - / - / 5 0
14bsu1081020 100% 0.661 PF00494 30 - (0)1 - / - / - 0
15bsu3615018 100% 0.594 PF03358 53 - (36)? - / - / - 0
16bsu3629019 100% 0.524 PF08282 36 - (11)1 - / - / - 0
17bsu2913043 100% 0.868 PF00180 C7_S156 - (52)17 - / 13 / 23 5
18bsu0282019 100% 0.557 PF07719 C2_S119 - (0)? - / 2 / - 0
19bsu1734072 100% 0.514 PF01423 C5_S187 - (0)15 - / - / 48 4
20bsu1719020 100% 0.559 PF14765 C2_S12 - (0)? - / - / 1 0
21bsu0209027 100% 0.517 PF00905 C3_S162 - (0)7 - / - / 7 3
22bsu2231011 100% 0.428 PF03838 4 - (0)? - / - / - 0
23bsu2820020 100% 0.521 PF02190 0 - (0)? - / - / - 0
24bsu3324020 100% 0.807 PF06560 19 - (17)? - / - / - 0
25bsu0474020 100% 0.601 PF07228 4 - (0)? - / - / - 0
26bsu128304 100% 0.626 PF01464 4 - (0)? - / - / - 0
27bsu1660020 100% 0.460 PF00575 0 - (0)? - / - / - 0
28bsu3503021 100% 0.612 PF07702 C1_S131 - (0)3 - / - / 3 1
29bsu178807 100% 0.691 PF05979 10 - (0)? - / - / - 0
30bsu0166025 100% 0.558 PF01915 C1_S134 - (15)16 - / - / 14 4
31bsu3652049 100% 0.536 PF00543 C4_S173 - (0)7 - / 16 / 20 3
32bsu3766017 100% 0.663 PF01515 C3_S127 - (9)5 - / - / 7 1
33bsu2168021 100% 0.538 PF01641 C2_S115 - (0)5 - / - / 7 2
34bsu0999016 100% 0.373 PF01047 53 - (0)? - / - / - 0
35bsu4029018 100% 0.839 PF00583 10 - (0)? - / - / - 0
36bsu2028016 100% 0.648 PF01202 17 - (11)? - / - / - 0
37bsu2919027 100% 0.813 PF00365 C3_S117 - (4)6 - / - / 11 3
38bsu1298024 100% 0.791 PF02746 C1_S111 - (0)4 - / - / 1 1
39bsu2905091 100% 0.634 PF00248 C5_S1151 - (87)15 31 / 6 / 25 4
40bsu0782011 100% 0.465 PF07702 4 - (0)? - / - / - 0
41bsu1360017 100% 0.607 PF05822 C1_S111 - (9)? - / - / 1 0
42bsu1003032 100% 0.468 PF01230 C3_S182 - (0)9 - / 4 / 7 3
43bsu3207011 100% 0.530 PF06725 C3_S18 - (0)5 - / - / 6 2
44bsu026307 100% 0.534 PF02416 3 - (0)? - / - / - 0
45bsu305709 100% 0.553 PF10763 0 - (0)? - / - / - 0
46bsu2525011 100% 0.601 PF00571 C1_S137 - (0)4 - / 1 / 3 2
47bsu3754011 100% 0.751 PF01361 C2_S119 - (0)1 - / - / 2 1
48bsu3094013 100% 0.898 PF02333 C2_S13 - (0)2 - / - / 3 1
49bsu1356018 100% 0.542 PF01636 C1_S146 - (30)4 - / 10 / 4 2
50bsu0352019 100% 0.562 PF00975 16 - (2)? - / - / - 0

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