Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000000586 (2017 - Streptococcus pneumoniae - STRR6: Streptococcus pneumoniae (strain ATCC BAA-255 / R6))

Download : Data.csv | 3D Common Core | 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]
50spr062235 52% 0.62 PF00005 C1_S151 - (0)13 - / 10 / 22 6
51spr074427 59% 0.54 PF07831 C5_S129 - (4)12 - / - / 14 6
52spr120245 42% 0.52 PF00005 C1_S164 - (0)14 - / 6 / 30 6
53spr123539 68% 0.60 PF01487 C5_S142 - (16)20 - / - / 26 6
54spr184635 88% 0.60 PF00215 C4_S143 - (36)12 - / - / 27 6
55spr169861 51% 0.49 PF16657 C1_S1108 - (0)20 - / - / 40 6
56spr131430 49% 0.50 PF08402 C1_S158 - (0)13 - / 18 / 7 6
57spr005347 67% 0.63 PF00731 C4_S147 - (29)15 - / 1 / 30 6
58spr072838 63% 0.60 PF00005 C1_S157 - (0)15 - / 17 / 20 6
59spr062633 62% 0.55 PF01336 C6_S139 - (23)12 - / 8 / 7 5
60spr203346 91% 0.59 PF00478 C2_S163 - (44)19 - / 12 / 29 5
61spr124021 48% 0.35 PF07973 C2_S121 - (0)8 3 / 6 / 4 5
62spr005426 50% 0.53 PF02222 C2_S148 - (35)8 - / 7 / 13 5
63spr175746 65% 0.53 PF00154 C2_S144 - (0)11 - / 22 / 6 5
64spr010028 37% 0.51 PF00005 C1_S143 - (0)13 - / 1 / 18 5
65spr125423 34% 0.47 PF00005 C1_S129 - (0)12 - / 7 / 7 5
66spr177321 34% 0.50 PF00005 C1_S139 - (0)15 - / 4 / 13 5
67spr072931 52% 0.69 PF02882 C5_S154 - (43)16 7 / 11 / 12 5
68spr189840 39% 0.52 PF00005 C1_S173 - (0)13 - / 9 / 14 5
69spr067138 66% 0.57 PF00438 C3_S123 - (12)13 - / - / 12 5
70spr153630 100% 0.58 PF04650 C5_S161 - (27)15 - / 4 / 18 5
71spr073830 82% 0.54 PF01048 C1_S176 - (54)20 - / - / 24 5
72spr116648 52% 0.57 PF02978 C7_S188 - (0)15 4 / 18 / 16 5
73spr202543 56% 0.59 PF00005 C1_S155 - (0)14 - / 1 / 23 5
74spr195744 73% 0.71 PF02729 C7_S152 - (42)16 - / 7 / 23 5
75spr144062 62% 0.57 PF00271 C1_S173 - (0)18 8 / 18 / 26 5
76spr159233 47% 0.66 PF01467 C2_S183 - (54)18 10 / 9 / 7 5
77spr109024 51% 0.58 PF00485 C1_S149 - (36)14 5 / 8 / 7 5
78spr135436 44% 0.65 PF00005 C1_S160 - (56)15 - / 13 / 12 5
79spr139725 44% 0.46 PF01336 C8_S187 - (49)9 - / 12 / - 5
80spr074632 55% 0.65 PF00383 C3_S143 - (30)14 - / - / 26 5
81spr024531 59% 0.53 PF01380 C2_S116 - (14)10 - / - / 12 5
82spr151065 67% 0.66 PF00091 C3_S168 - (0)10 - / 17 / 36 5
83spr118831 48% 0.54 PF00383 C5_S139 - (28)16 - / - / 28 5
84spr158332 62% 0.54 PF00625 C4_S143 - (34)14 6 / 11 / 8 5
85spr069434 53% 0.55 PF00005 C1_S157 - (0)12 - / 9 / 12 5
86spr040835 56% 0.60 PF00005 C1_S161 - (0)14 - / 16 / 17 5
87spr053628 48% 0.41 PF00005 C1_S160 - (0)10 - / 9 / 8 5
88spr112134 64% 0.63 PF00005 C1_S157 - (0)14 - / 13 / 10 5
89spr142924 94% 0.63 PF00186 C6_S1149 - (93)20 5 / 10 / 10 4
90spr147224 63% 0.54 PF07973 C2_S130 - (9)15 1 / 8 / 8 4
91spr173438 53% 0.46 PF00005 C1_S161 - (61)12 - / 12 / 7 4
92spr110627 69% ? PF00512 C2_S142 - (37)10 6 / 13 / - 4
93spr005724 99% 0.61 PF04650 C3_S140 - (8)11 - / 3 / 7 4
94spr028622 100% 0.77 PF08124 C1_S133 - (0)9 1 / 1 / 11 4
95spr195220 99% 0.59 PF01204 C3_S132 - (0)10 - / 1 / 8 4
96spr113547 59% 0.59 PF00180 C6_S163 - (52)17 - / 6 / 26 4
97spr122833 40% 0.60 PF01202 C2_S177 - (64)13 - / 2 / 18 4
98spr191035 59% 0.58 PF00579 C3_S136 - (26)9 - / 12 / 8 4
99spr000529 64% 0.53 PF01195 C6_S120 - (0)11 - / 1 / 8 4
100spr051425 47% 0.53 PF01717 C4_S121 - (15)6 - / 2 / 6 4

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