Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000000823 (STRA3: Streptococcus agalactiae serotype III - Nov 2015)

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]
200gbs19890 35% 0.141 PF00128 5 - (0)? - / - / - 0
201gbs10452 26% 0.306 PF00128 7 - (4)? - / - / - 0
202gbs104624 56% 0.636 PF00132 C2_S1121 - (53)8 - / - / 5 0
203gbs092420 50% 0.398 PF00132 100 - (50)? - / - / - 0
204gbs20180 29% 0.489 PF00135 19 - (0)? - / - / - 0
205gbs064015 23% 0.367 PF00144 40 - (0)? - / - / - 0
206gbs177416 28% 0.450 PF00144 38 - (0)? - / - / - 0
207gbs009412 41% 0.435 PF00144 13 - (0)? - / - / - 0
208gbs03720 37% 0.201 PF00146 0 - (0)? - / - / - 0
209gbs15050 44% 0.390 PF00148 8 - (0)? - / - / - 0
210gbs20740 48% 0.584 PF00148 1 - (0)? - / - / - 0
211gbs056118 24% 0.556 PF00149 2 - (0)? - / - / - 0
212gbs05037 25% 0.448 PF00149 24 - (8)? - / - / - 0
213gbs192911 48% 0.601 PF00149 27 - (9)2 - / - / - 0
214gbs140312 30% 0.471 PF00149 C1_S131 - (11)3 - / 1 / - 0
215gbs056212 31% 0.319 PF00149 3 - (0)? - / - / - 0
216gbs144113 25% 0.385 PF00149 14 - (0)? - / - / - 0
217gbs204739 63% 0.547 PF00154 C3_S139 - (0)11 - / 17 / 7 5
218gbs163619 58% 0.530 PF00155 C1_S141 - (25)2 - / - / 6 1
219gbs172020 59% 0.615 PF00155 C1_S130 - (26)3 - / 1 / 2 2
220gbs21161 40% 0.033 PF00155 2 - (0)? - / - / - 0
221gbs009818 33% 0.471 PF00155 44 - (23)? - / - / - 0
222gbs001831 38% 0.608 PF00155 C1_S145 - (34)9 - / 1 / 22 2
223gbs057130 40% 0.633 PF00155 C1_S138 - (33)7 - / 1 / 24 3
224gbs01623 46% 0.212 PF00155 5 - (0)? - / - / - 0
225gbs179915 41% 0.664 PF00155 19 - (16)? - / - / - 0
226gbs002520 58% 0.569 PF00156 C6_S124 - (2)3 - / 1 / 5 2
227gbs127818 53% 0.578 PF00156 C5_S130 - (24)5 - / 3 / 4 2
228gbs181517 51% 0.624 PF00156 C2_S143 - (35)1 - / - / 2 0
229gbs108120 76% 0.637 PF00156 C2_S132 - (19)3 - / - / 3 1
230gbs001490 62% 0.598 PF00156 C4_S1123 - (50)19 - / 31 / 42 12
231gbs11179 58% 0.673 PF00156 C2_S142 - (30)3 - / 2 / 2 2
232gbs143422 61% 0.661 PF00156 C3_S183 - (44)6 - / 7 / 6 2
233gbs163546 71% 0.583 PF00156 C2_S164 - (45)13 - / 10 / 21 4
234gbs02360 29% -0.128 PF00160 3 - (0)? - / - / - 0
235gbs127713 80% 0.774 PF00160 2 - (0)? - / - / - 0
236gbs031158 57% 0.623 PF00160 C1_S1128 - (5)14 - / 29 / 9 2
237gbs158687 49% 0.596 PF00160 C6_S1140 - (0)20 - / 23 / 28 8
238gbs180951 63% 0.603 PF00162 C8_S182 - (72)18 - / 25 / 20 8
239gbs181422 73% 0.536 PF00164 C2_S114 - (0)0 - / - / 2 0
240gbs20304 46% 0.644 PF00166 0 - (0)? - / - / - 0
241gbs03522 33% 0.307 PF00171 4 - (0)? - / - / - 0
242gbs027420 46% 0.573 PF00171 5 - (0)? - / - / - 0
243gbs084132 67% 0.533 PF00171 C4_S120 - (0)8 2 / 10 / 1 4
244gbs119220 73% 0.601 PF00171 C3_S134 - (0)8 - / 2 / 8 3
245gbs11353 50% 0.472 PF00171 9 - (9)? - / - / - 0
246gbs019616 30% 0.397 PF00175 63 - (35)1 - / - / - 0
247gbs10530 30% 0.316 PF00176 0 - (0)? - / - / - 0
248gbs07440 41% 0.009 PF00176 11 - (0)? - / - / - 0
249gbs135213 39% 0.429 PF00176 3 - (0)? - / - / - 0
250gbs18030 50% 0.430 PF00177 0 - (0)? - / - / - 0

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