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]
200gbs078817 69% 0.539 PF08245 C1_S142 - (19)5 2 / 2 / - 4
201gbs108920 59% 0.569 PF01268 C1_S117 - (0)5 - / 4 / 6 2
202gbs191620 57% 0.561 PF00294 C1_S143 - (34)5 - / 5 / 2 3
203gbs181925 83% 0.728 PF00834 C3_S116 - (10)5 - / - / 4 2
204gbs050729 43% 0.355 PF00005 C1_S184 - (75)5 - / 6 / 1 2
205gbs115428 75% 0.558 PF00478 C2_S156 - (41)5 - / 4 / 6 3
206gbs076412 82% 0.377 PF03830 C6_S18 - (0)5 2 / - / 2 2
207gbs212724 56% 0.530 PF00579 C3_S136 - (28)5 - / - / 7 3
208gbs189124 99% 0.528 PF00106 C1_S161 - (46)5 1 / - / 3 1
209gbs117520 67% 0.595 PF02793 C1_S147 - (0)5 - / - / 7 3
210gbs128820 99% 0.553 PF02922 C1_S134 - (0)5 - / - / 2 2
211gbs078248 75% 0.637 PF03143 C3_S165 - (0)5 13 / 25 / 2 3
212gbs089920 64% 0.581 PF03099 C3_S123 - (16)5 - / 1 / 3 3
213gbs074820 45% 0.582 PF08282 C2_S122 - (3)5 - / - / 1 0
214gbs138522 34% 0.517 PF00303 C2_S132 - (17)5 - / - / 5 2
215gbs051821 68% 0.604 PF00480 C2_S132 - (25)5 - / - / 4 2
216gbs164219 37% 0.558 PF01479 C2_S117 - (0)5 - / - / 1 1
217gbs156714 66% 0.557 PF01593 C2_S130 - (17)5 - / - / 1 0
218gbs154120 38% 0.441 PF01479 C3_S120 - (0)4 - / - / 1 1
219gbs195620 47% 0.574 PF02475 C1_S155 - (39)4 - / 2 / 6 1
220gbs211925 44% 0.581 PF02863 C9_S1128 - (0)4 - / - / 9 0
221gbs044120 46% 0.534 PF00483 C1_S138 - (30)4 - / 9 / 1 2
222gbs175126 42% 0.575 PF00557 C1_S120 - (1)4 - / 1 / 4 0
223gbs060523 45% 0.603 PF00702 C2_S115 - (13)4 - / - / 4 3
224gbs001722 64% 0.632 PF13793 C5_S120 - (13)4 - / - / 7 3
225gbs110820 36% 0.547 PF05175 C1_S133 - (0)4 - / 9 / 1 0
226gbs184723 39% 0.571 PF02826 C1_S179 - (62)4 - / - / 4 0
227gbs117220 43% 0.549 PF08282 C1_S133 - (4)4 - / - / 2 0
228gbs104713 49% 0.428 PF01351 C2_S130 - (0)4 - / 1 / 4 1
229gbs212222 91% 0.584 PF02274 C3_S112 - (7)4 - / - / 3 2
230gbs085919 42% 0.577 PF02110 C2_S131 - (20)4 - / - / 5 1
231gbs052013 55% 0.449 PF03143 C2_S132 - (0)4 - / - / 4 2
232gbs027927 52% 0.547 PF00271 C5_S142 - (0)4 1 / 4 / 4 3
233gbs067328 47% 0.617 PF01081 C2_S130 - (26)4 - / - / 10 1
234gbs094620 79% 0.545 PF02852 C1_S1111 - (100)4 4 / - / - 1
235gbs180420 61% 0.552 PF00753 C1_S117 - (0)4 5 / 1 / 3 3
236gbs151719 54% 0.561 PF00534 C1_S133 - (21)4 - / 3 / 2 2
237gbs208219 36% 0.461 PF00512 C1_S129 - (25)4 2 / 1 / 1 2
238gbs186715 34% 0.574 PF01712 C4_S151 - (38)4 - / 7 / 2 3
239gbs205323 68% 0.528 PF00313 C5_S139 - (0)4 3 / 2 / - 0
240gbs118419 41% 0.528 PF08245 C1_S124 - (12)4 - / - / 3 2
241gbs096125 42% 0.494 PF08402 C1_S143 - (0)4 - / 1 / 6 2
242gbs020220 45% 0.557 PF01588 C2_S129 - (17)4 - / 1 / 3 2
243gbs156019 47% 0.659 PF01926 C1_S162 - (0)4 6 / 3 / 1 2
244gbs115823 51% 0.549 PF00106 C1_S154 - (37)4 9 / - / - 2
245gbs141722 44% 0.515 PF00294 C2_S158 - (39)4 - / - / 8 2
246gbs181217 67% 0.488 PF03144 C2_S119 - (0)4 - / 8 / 2 2
247gbs162921 36% 0.672 PF00005 C1_S119 - (0)4 - / 10 / 2 2
248gbs142320 52% 0.561 PF07992 C1_S1130 - (96)4 7 / - / - 2
249gbs066824 36% 0.555 PF02826 C1_S159 - (42)4 3 / 1 / 4 1
250gbs144833 39% 0.455 PF01202 C3_S158 - (54)4 4 / 13 / 8 2

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