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]
50bsu0051023 100% 0.595 PF13793 C7_S115 - (12)5 - / - / 8 3
51bsu232208 100% 0.548 PF00485 8 - (6)? - / - / - 0
52bsu1737020 100% 0.677 PF07972 C4_S125 - (24)2 10 / - / - 1
53bsu3629019 100% 0.524 PF08282 36 - (11)1 - / - / - 0
54bsu0683019 100% 0.616 PF07719 16 - (0)? - / - / - 0
55bsu3530023 100% 0.544 PF07516 C2_S113 - (0)2 - / 2 / 3 1
56bsu1013020 100% 0.865 PF00762 C2_S124 - (3)8 2 / 2 / 3 4
57bsu3464019 100% 0.586 PF03641 C3_S127 - (7)8 - / - / 6 3
58bsu3642014 100% 0.665 PF02863 3 - (0)? - / - / - 0
59bsu261303 100% 0.654 PF07944 1 - (0)? - / - / - 0
60bsu1773018 100% 0.414 PF08327 1 - (0)? - / - / - 0
61bsu2796016 100% 0.438 PF00829 1 - (0)? - / - / - 0
62bsu0389020 100% 0.597 PF00155 31 - (15)? - / - / - 0
63bsu3501020 100% 0.546 PF01979 C1_S118 - (7)4 - / - / 5 2
64bsu026307 100% 0.534 PF02416 3 - (0)? - / - / - 0
65bsu1134045 100% 0.544 PF02801 C3_S153 - (5)20 - / 5 / 18 9
66bsu0270021 100% 0.798 PF01674 C1_S119 - (6)7 - / - / 9 2
67bsu3094013 100% 0.898 PF02333 C2_S13 - (0)2 - / - / 3 1
68bsu305709 100% 0.553 PF10763 0 - (0)? - / - / - 0
69bsu246503 100% 0.347 PF13028 2 - (0)? - / - / - 0
70bsu358203 100% 0.459 PF05504 0 - (0)? - / - / - 0
71bsu076409 100% 0.603 PF00708 C5_S19 - (7)2 - / - / 1 0
72bsu0386015 100% 0.596 PF00881 C4_S162 - (40)2 - / 6 / - 1
73bsu254005 100% 0.709 PF02637 0 - (0)? - / - / - 0
74bsu261206 100% 0.483 PF11436 2 - (0)? - / - / - 0
75bsu3615018 100% 0.594 PF03358 53 - (36)? - / - / - 0
76bsu367702 100% 0.554 PF00005 0 - (0)? - / - / - 0
77bsu0118020 100% 0.410 PF00276 1 - (0)? - / - / - 0
78bsu1298024 100% 0.791 PF02746 C1_S111 - (0)4 - / - / 1 1
79bsu1221056 100% 0.569 PF00067 C6_S1117 - (0)8 41 / - / 5 1
80bsu1919019 100% 0.513 PF07730 C2_S116 - (14)5 - / 7 / 3 3
81bsu163909 100% 0.557 PF00771 0 - (0)? - / - / - 0
82bsu310403 100% 0.542 PF03473 0 - (0)? - / - / - 0
83bsu2284025 100% 0.631 PF01926 C1_S133 - (0)4 4 / 11 / - 2
84bsu277208 100% 0.539 PF02668 3 - (0)? - / - / - 0
85bsu1962024 100% 0.525 PF01079 C8_S115 - (0)6 - / - / 6 3
86bsu3754011 100% 0.751 PF01361 C2_S119 - (0)1 - / - / 2 1
87bsu2163020 100% 0.557 PF02522 C2_S114 - (0)3 3 / 9 / 1 1
88bsu3797056 100% 0.634 PF03167 C7_S193 - (0)20 - / 9 / 32 12
89bsu0131020 100% 0.598 PF00347 0 - (0)? - / - / - 0
90bsu1360017 100% 0.607 PF05822 C1_S111 - (9)? - / - / 1 0
91bsu0756023 100% 0.838 PF00544 C6_S118 - (0)3 - / - / 8 1
92bsu3970019 100% 0.605 PF02894 C1_S139 - (0)9 - / 10 / 3 3
93bsu3027017 100% 0.586 PF01547 C2_S134 - (0)2 - / - / 2 1
94bsu3332020 100% 0.638 PF01497 35 - (0)? - / - / - 0
95bsu0420016 100% 0.492 PF00908 16 - (0)1 - / - / - 0
96bsu179003 100% 0.514 PF10747 4 - (0)2 - / - / - 0
97bsu1539010 100% 0.733 PF04472 0 - (0)? - / - / - 0
98bsu0210022 100% 0.807 PF00067 C4_S196 - (1)2 11 / - / - 1
99bsu2328022 100% 0.587 PF00383 C3_S149 - (0)3 2 / - / 1 1
100bsu3746017 100% 0.572 PF02188 8 - (0)? - / - / - 0

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