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
51bsu0052010 49% 0.568 PF14693 11 - (0)? - / - / - 0
52bsu0053032 53% 0.622 PF01195 C6_S115 - (0)11 - / 1 / 6 4
53bsu005400 29% 0.445 PF01475 1 - (0)? - / - / - 0
54bsu0055020 44% 0.453 PF00271 33 - (0)? - / - / - 0
55bsu0056010 100% 0.611 PF04014 7 - (0)? - / - / - 0
56bsu005706 33% 0.313 PF00056 18 - (0)? - / - / - 0
57bsu0058016 29% 0.478 PF00590 19 - (17)? - / - / - 0
58bsu0059014 40% 0.647 PF01479 0 - (0)? - / - / - 0
59bsu006000 22% 0.472 PF10584 2 - (0)? - / - / - 0
60bsu006100 38% 0.223 -0 - (0)? - / - / - 0
61bsu006201 45% 0.459 PF01477 4 - (0)? - / - / - 0
62bsu006309 52% 0.678 PF00575 4 - (0)? - / - / - 0
63bsu0064018 100% 0.425 PF00481 2 - (0)? - / - / - 0
64bsu0065020 43% 0.536 PF00362 1 - (0)? - / - / - 0
65bsu006603 34% 0.353 PF00069 49 - (13)? - / - / - 0
66bsu0067019 49% 0.509 PF01171 9 - (3)? - / - / - 0
67bsu0068094 79% 0.560 PF00156 C3_S1122 - (55)20 2 / 30 / 45 11
68bsu0069036 72% 0.619 PF09336 C2_S121 - (21)5 - / 14 / 5 4
69bsu0070020 76% 0.557 PF03309 C8_S118 - (10)3 - / - / 2 0
70bsu0071011 99% 0.636 PF01430 C4_S13 - (0)2 - / - / 3 1
71bsu0072014 42% 0.569 PF09312 12 - (0)? - / - / - 0
72bsu0073076 84% 0.600 PF00291 C2_S183 - (53)20 - / 8 / 60 9
73bsu0074021 39% 0.521 PF00425 C1_S114 - (0)9 - / - / 7 2
74bsu0075015 49% 0.591 PF00117 6 - (1)? - / - / - 0
75bsu0076020 27% 0.536 PF01063 45 - (38)1 - / - / - 0
76bsu0077072 67% 0.658 PF00809 C3_S189 - (33)20 - / - / 61 26
77bsu0078040 63% 0.593 PF02152 C5_S137 - (25)12 - / - / 22 8
78bsu0079062 52% 0.626 PF01288 C6_S1102 - (43)20 2 / 27 / 30 9
79bsu008006 38% 0.676 PF00717 38 - (0)? - / - / - 0
80bsu0081020 37% 0.619 PF01207 C1_S182 - (44)2 5 / 3 / - 1
81bsu0082035 79% 0.534 PF01336 C5_S142 - (28)14 - / 11 / 6 6
82bsu008302 72% 0.592 PF02295 8 - (0)? - / - / - 0
83bsu008407 25% 0.268 PF13912 20 - (0)? - / - / - 0
84bsu0085020 33% 0.570 PF02807 C5_S126 - (25)8 - / - / 2 0
85bsu0086018 99% 0.444 PF10431 C1_S126 - (0)6 1 / 15 / - 3
86bsu0087010 37% 0.361 PF08423 6 - (0)? - / - / - 0
87bsu0088018 44% 0.644 PF00633 C5_S122 - (0)6 - / 10 / 7 3
88bsu0089018 44% 0.553 PF01850 2 - (0)? - / - / - 0
89bsu0090037 38% 0.512 PF01128 C1_S142 - (32)9 - / 19 / 5 3
90bsu0091089 63% 0.585 PF02542 C10_S193 - (67)20 - / - / 68 7
91bsu0092024 43% 0.577 PF00749 C5_S117 - (14)5 - / 5 / 3 3
92bsu0093030 50% 0.650 PF12464 C2_S1130 - (86)6 - / - / 16 1
93bsu0094020 47% 0.508 PF01406 C3_S130 - (3)7 - / - / 7 2
94bsu0095016 99% 0.590 PF00636 0 - (0)? - / - / - 0
95bsu0096017 52% 0.605 PF00588 C1_S133 - (0)2 - / - / 3 0
96bsu0097011 29% 0.332 PF03167 9 - (0)? - / - / - 0
97bsu0098015 38% 0.596 PF04545 10 - (0)? - / - / - 0
98bsu009900 33% 0.637 PF01780 0 - (0)? - / - / - 0
99bsu010008 60% 0.295 PF00584 4 - (0)? - / - / - 0
100bsu0101019 60% 0.543 PF02357 5 - (0)? - / - / - 0

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