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]
50bsu246503 100% 0.347 PF13028 2 - (0)? - / - / - 0
51bsu2277066 100% 0.809 PF02081 C16_S192 - (0)2 - / 3 / 47 1
52bsu1768055 100% 0.716 PF00303 C8_S172 - (38)18 - / 9 / 30 7
53bsu3642014 100% 0.665 PF02863 3 - (0)? - / - / - 0
54bsu3501020 100% 0.546 PF01979 C1_S118 - (7)4 - / - / 5 2
55bsu2855017 100% 0.645 PF00440 C1_S145 - (0)4 5 / 1 / 3 2
56bsu2238010 100% 0.747 PF03413 0 - (0)? - / - / - 0
57bsu3034059 100% 0.669 PF13426 C2_S177 - (0)3 20 / 18 / 7 2
58bsu401309 100% 0.607 PF07702 26 - (0)? - / - / - 0
59bsu2447021 100% 0.691 PF01220 C8_S126 - (0)1 - / - / 1 0
60bsu1816016 100% 0.624 PF04616 C1_S129 - (0)5 - / - / 5 2
61bsu3988011 100% 0.595 PF08007 38 - (0)? - / - / - 0
62bsu284606 100% 0.445 PF04051 5 - (0)? - / - / - 0
63bsu1375014 100% 0.582 PF14489 C3_S120 - (0)4 - / - / 7 2
64bsu1920014 100% 0.607 PF00072 10 - (0)1 - / - / - 0
65bsu1055020 100% 0.608 PF01041 C1_S157 - (0)5 - / 3 / 5 2
66bsu2529020 100% 0.804 PF00398 C1_S112 - (8)4 - / 3 / 2 3
67bsu2793018 100% 0.493 PF14682 4 - (4)? - / - / - 0
68bsu3079019 100% 0.476 PF13193 25 - (8)? - / - / - 0
69bsu2706014 100% 0.576 PF03830 3 - (3)? - / - / - 0
70bsu3474020 100% 0.685 PF00381 0 - (0)? - / - / - 0
71bsu1281018 100% 0.594 PF01510 19 - (0)1 - / - / - 0
72bsu1549056 100% 0.625 PF02729 C8_S157 - (43)20 - / 20 / 13 8
73bsu1773018 100% 0.414 PF08327 1 - (0)? - / - / - 0
74bsu2796016 100% 0.438 PF00829 1 - (0)? - / - / - 0
75bsu1592035 100% 0.792 PF00550 C7_S138 - (0)11 - / - / 8 2
76bsu1423014 100% 0.737 PF00085 20 - (0)? - / - / - 0
77bsu2402018 100% 0.619 PF13411 C2_S127 - (0)2 - / 1 / 13 0
78bsu1617011 100% 0.590 PF00862 C2_S15 - (0)3 - / - / 3 2
79bsu3852016 100% 0.748 PF00550 3 - (0)? - / - / - 0
80bsu1038016 100% 0.774 PF00015 C5_S119 - (0)2 6 / - / - 1
81bsu0166025 100% 0.558 PF01915 C1_S134 - (15)16 - / - / 14 4
82bsu0134011 100% 0.634 PF00327 1 - (0)? - / - / - 0
83bsu1185011 100% 0.612 PF02834 1 - (0)? - / - / - 0
84bsu0012021 100% 0.614 PF01174 32 - (0)1 - / - / - 0
85bsu1172032 100% 0.614 PF00106 C5_S168 - (36)8 17 / 8 / 1 3
86bsu3454026 100% 0.636 PF00574 C7_S132 - (0)4 - / - / 10 1
87bsu1413018 100% 0.535 PF00571 9 - (0)? - / - / - 0
88bsu3027017 100% 0.586 PF01547 C2_S134 - (0)2 - / - / 2 1
89bsu2284025 100% 0.631 PF01926 C1_S133 - (0)4 4 / 11 / - 2
90bsu2002035 100% 0.501 PF00692 C7_S164 - (47)6 - / - / 22 3
91bsu246004 100% 0.832 PF08671 0 - (0)? - / - / - 0
92bsu4041012 100% 0.657 PF00486 C5_S115 - (0)1 - / - / 2 0
93bsu1919019 100% 0.513 PF07730 C2_S116 - (14)5 - / 7 / 3 3
94bsu3455027 100% 0.673 PF13419 C1_S122 - (11)13 - / 5 / 12 8
95bsu3936017 100% 0.693 PF01175 C4_S116 - (16)2 7 / - / - 1
96bsu4043019 100% 0.590 PF00903 6 - (0)? - / - / - 0
97bsu3023071 100% 0.552 PF00202 C1_S1136 - (79)20 - / - / 54 6
98bsu2208020 100% 0.595 PF02074 3 - (0)? - / - / - 0
99bsu214802 100% 0.407 PF00595 3 - (0)1 - / - / - 0
100bsu1166010 100% 0.633 PF02581 C1_S113 - (3)4 - / - / 3 1

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