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]
1spr000119 38% 0.56 PF08299 C4_S129 - (0)2 - / 7 / - 1
2spr000219 98% 0.56 PF02768 7 - (0)? - / - / - 0
3spr00030 33% 0.67 PF01475 0 - (0)? - / - / - 0
4spr000418 57% 0.53 PF07670 C5_S162 - (0)7 - / 5 / 2 3
5spr000529 64% 0.53 PF01195 C6_S120 - (0)11 - / 1 / 8 4
6spr000616 40% 0.45 PF00271 C1_S123 - (0)1 - / - / 1 0
7spr000715 34% 0.64 PF01479 0 - (0)? - / - / - 0
8spr00080 41% 0.46 PF07716 6 - (0)? - / - / - 0
9spr000914 32% 0.54 PF00768 25 - (0)? - / - / - 0
10spr001018 33% ? PF01171 6 - (3)? - / - / - 0
11spr001197 58% 0.56 PF00156 C3_S1132 - (72)20 - / 24 / 55 17
12spr001239 72% 0.49 PF09336 C2_S125 - (0)5 - / 15 / 7 3
13spr001314 55% 0.44 PF04545 4 - (0)? - / - / - 0
14spr00149 48% 0.66 PF03221 6 - (0)? - / - / - 0
15spr00150 42% 0.47 PF02097 0 - (0)? - / - / - 0
16spr001611 43% 0.41 PF01359 6 - (0)? - / - / - 0
17spr00170 43% ? PF08375 1 - (0)? - / - / - 0
18spr00180 23% ? PF00905 0 - (0)? - / - / - 0
19spr001914 34% 0.63 PF17048 11 - (0)? - / - / - 0
20spr00200 50% 0.56 PF02057 1 - (0)? - / - / - 0
21spr002149 75% 0.56 PF00709 C6_S195 - (69)20 - / 37 / 14 7
22spr002220 72% 0.58 PF14437 C6_S120 - (5)3 - / - / 2 0
23spr002311 79% 0.43 PF00692 C4_S1150 - (121)4 - / - / 3 1
24spr002412 34% 0.42 PF00300 15 - (10)? - / - / - 0
25spr002512 100% 0.57 PF01078 C1_S16 - (0)2 - / 2 / 3 1
26spr002621 77% 0.66 PF00484 10 - (0)3 - / - / - 0
27spr00272 31% 0.27 PF02517 2 - (0)? - / - / - 0
28spr002825 64% 0.56 PF13793 C5_S122 - (18)6 - / - / 10 2
29spr00290 31% 0.56 PF03992 14 - (0)? - / - / - 0
30spr00300 34% 0.18 PF00311 2 - (0)? - / - / - 0
31spr00310 40% 0.56 PF04075 3 - (0)? - / - / - 0
32spr003292 51% 0.59 PF00476 C3_S1235 - (173)9 68 / 8 / 10 1
33spr003319 41% 0.62 PF00549 14 - (13)? - / - / - 0
34spr00344 39% 0.34 PF00999 10 - (0)? - / - / - 0
35spr003526 77% 0.62 PF00155 C1_S149 - (34)14 - / - / 18 1
36spr00365 28% 0.43 PF01412 2 - (0)? - / - / - 0
37spr003710 37% 0.57 PF01515 15 - (3)0 - / - / - 0
38spr00380 51% 0.57 PF00550 C6_S130 - (0)1 - / - / 1 0
39spr00390 50% 0.77 PF14706 1 - (0)? - / - / - 0
40spr00400 31% 0.49 PF00899 2 - (0)? - / - / - 0
41spr00410 48% 0.11 PF00176 2 - (0)? - / - / - 0
42spr00424 59% 0.81 PF00239 7 - (0)? - / - / - 0
43spr004330 65% ? PF00005 C2_S158 - (58)11 - / 14 / 1 3
44spr004410 34% 0.31 PF16576 2 - (0)? - / - / - 0
45spr004535 99% 0.46 PF01259 C2_S162 - (48)13 - / 17 / 15 9
46spr004615 26% 0.33 PF02769 C5_S118 - (16)2 - / - / 2 0
47spr004715 60% 0.54 PF00156 C1_S125 - (1)3 - / 1 / 5 2
48spr004820 59% 0.49 PF02769 C3_S131 - (0)5 - / - / 3 1
49spr004920 99% 0.66 PF00551 C4_S1162 - (29)6 - / - / 3 0
50spr00500 29% 0.05 PF03911 3 - (3)? - / - / - 0

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