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]
50spr119117 36% 0.33 PF00005 8 - (0)1 - / - / - 0
51spr155920 33% 0.54 PF00005 C1_S116 - (0)7 - / 2 / 3 0
52spr129323 34% 0.41 PF00005 C2_S121 - (0)6 - / 2 / 4 2
53spr066320 57% 0.58 PF00005 C1_S130 - (0)3 - / - / 2 1
54spr128113 36% 0.52 PF00005 C1_S124 - (0)1 - / - / 1 0
55spr097721 34% 0.52 PF00005 C1_S118 - (0)6 - / - / 6 1
56spr066221 36% 0.63 PF00005 C1_S142 - (0)8 - / 8 / 3 1
57spr173612 30% 0.38 PF00005 10 - (0)? - / - / - 0
58spr093820 34% 0.50 PF00005 C1_S117 - (0)5 - / 3 / 2 0
59spr077120 64% 0.66 PF00005 C1_S122 - (0)4 - / - / 4 1
60spr08597 34% ? PF00005 24 - (0)? - / - / - 0
61spr125423 34% 0.47 PF00005 C1_S129 - (0)12 - / 7 / 7 5
62spr149223 34% 0.55 PF00005 C1_S122 - (0)8 - / 3 / 6 2
63spr120245 42% 0.52 PF00005 C1_S164 - (0)14 - / 6 / 30 6
64spr014921 46% 0.51 PF00005 C1_S158 - (0)9 - / 3 / 8 1
65spr18311 41% 0.50 PF00005 38 - (0)? - / - / - 0
66spr177321 34% 0.50 PF00005 C1_S139 - (0)15 - / 4 / 13 5
67spr010028 37% 0.51 PF00005 C1_S143 - (0)13 - / 1 / 18 5
68spr072838 63% 0.60 PF00005 C1_S157 - (0)15 - / 17 / 20 6
69spr197720 33% 0.60 PF00005 12 - (0)? - / - / - 0
70spr170445 39% 0.47 PF00005 C1_S160 - (0)14 - / - / 29 6
71spr066620 41% 0.57 PF00005 C1_S159 - (0)12 - / 2 / 11 1
72spr168622 33% 0.49 PF00005 C1_S119 - (0)6 - / 1 / 6 2
73spr138010 36% ? PF00005 12 - (0)? - / - / - 0
74spr060219 37% 0.55 PF00005 C1_S144 - (0)11 - / 2 / 10 1
75spr069434 53% 0.55 PF00005 C1_S157 - (0)12 - / 9 / 12 5
76spr040835 56% 0.60 PF00005 C1_S161 - (0)14 - / 16 / 17 5
77spr13782 59% 0.55 PF00005 26 - (0)0 - / - / - 0
78spr121620 39% ? PF00005 C1_S148 - (48)7 - / 2 / 3 0
79spr188714 39% ? PF00005 C2_S152 - (50)5 - / 3 / 2 0
80spr149719 42% 0.54 PF00005 C1_S157 - (53)10 - / 4 / 6 2
81spr053528 61% 0.50 PF00005 C1_S141 - (0)6 - / - / 7 2
82spr12807 16% 0.25 PF00005 1 - (0)? - / - / - 0
83spr05596 14% ? PF00005 2 - (0)? - / - / - 0
84spr06117 30% 0.24 PF00005 1 - (0)? - / - / - 0
85spr06166 22% 0.32 PF00005 14 - (0)? - / - / - 0
86spr086010 34% ? PF00005 1 - (0)? - / - / - 0
87spr124647 50% 0.55 PF00005 C2_S152 - (0)14 - / 8 / 11 6
88spr112134 64% 0.63 PF00005 C1_S157 - (0)14 - / 13 / 10 5
89spr053628 48% 0.41 PF00005 C1_S160 - (0)10 - / 9 / 8 5
90spr061019 41% 0.49 PF00005 50 - (0)? - / - / - 0
91spr062235 52% 0.62 PF00005 C1_S151 - (0)13 - / 10 / 22 6
92spr180130 37% 0.48 PF00005 C1_S165 - (0)14 - / 4 / 11 4
93spr135436 44% 0.65 PF00005 C1_S160 - (56)15 - / 13 / 12 5
94spr202630 55% ? PF00005 C1_S153 - (0)10 - / 9 / 4 4
95spr004330 65% ? PF00005 C2_S158 - (58)11 - / 14 / 1 3
96spr046821 69% ? PF00005 C1_S161 - (61)8 - / 3 / 2 2
97spr202543 56% 0.59 PF00005 C1_S155 - (0)14 - / 1 / 23 5
98spr052526 40% 0.59 PF00005 C1_S152 - (0)13 - / 2 / 17 4
99spr165630 45% 0.44 PF00005 C2_S158 - (56)12 - / 11 / 3 1
100spr081235 43% 0.60 PF00005 C1_S146 - (0)14 - / 14 / 12 3

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