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]
200gbs094744 68% 0.621 PF00056 C7_S140 - (30)5 2 / 14 / 7 2
201gbs164219 37% 0.558 PF01479 C2_S117 - (0)5 - / - / 1 1
202gbs144326 39% 0.516 PF00266 C1_S146 - (35)5 - / - / 14 1
203gbs074820 45% 0.582 PF08282 C2_S122 - (3)5 - / - / 1 0
204gbs108920 59% 0.569 PF01268 C1_S117 - (0)5 - / 4 / 6 2
205gbs189124 99% 0.528 PF00106 C1_S161 - (46)5 1 / - / 3 1
206gbs014825 36% 0.555 PF00005 C1_S147 - (0)5 - / 2 / 3 4
207gbs128820 99% 0.553 PF02922 C1_S134 - (0)5 - / - / 2 2
208gbs194722 43% 0.624 PF00512 C3_S132 - (30)5 2 / 10 / - 3
209gbs156714 66% 0.557 PF01593 C2_S130 - (17)5 - / - / 1 0
210gbs054122 53% 0.618 PF03853 C3_S163 - (51)5 - / 3 / 1 2
211gbs115428 75% 0.558 PF00478 C2_S156 - (41)5 - / 4 / 6 3
212gbs078817 69% 0.539 PF08245 C1_S142 - (19)5 2 / 2 / - 4
213gbs138522 34% 0.517 PF00303 C2_S132 - (17)5 - / - / 5 2
214gbs089920 64% 0.581 PF03099 C3_S123 - (16)5 - / 1 / 3 3
215gbs035721 66% 0.539 PF01230 C6_S193 - (0)5 - / - / 2 1
216gbs003825 31% 0.593 PF00701 C7_S116 - (16)5 - / - / 8 1
217gbs212724 56% 0.530 PF00579 C3_S136 - (28)5 - / - / 7 3
218gbs030720 45% 0.517 PF00069 C1_S185 - (14)4 - / 4 / 5 3
219gbs180420 61% 0.552 PF00753 C1_S117 - (0)4 5 / 1 / 3 3
220gbs195620 47% 0.574 PF02475 C1_S155 - (39)4 - / 2 / 6 1
221gbs184723 39% 0.571 PF02826 C1_S179 - (62)4 - / - / 4 0
222gbs186715 34% 0.574 PF01712 C4_S151 - (38)4 - / 7 / 2 3
223gbs171617 36% 0.392 PF08279 C3_S116 - (0)4 - / - / 1 1
224gbs127122 94% 0.772 PF01370 C1_S175 - (68)4 23 / - / - 2
225gbs094620 79% 0.545 PF02852 C1_S1111 - (100)4 4 / - / - 1
226gbs089830 43% 0.554 PF02852 C3_S158 - (51)4 18 / 2 / - 2
227gbs142320 52% 0.561 PF07992 C1_S1130 - (96)4 7 / - / - 2
228gbs208922 40% 0.500 PF04069 C2_S116 - (0)4 - / - / 1 0
229gbs144833 39% 0.455 PF01202 C3_S158 - (54)4 4 / 13 / 8 2
230gbs104713 49% 0.428 PF01351 C2_S130 - (0)4 - / 1 / 4 1
231gbs104814 47% 0.564 PF01926 C14_S113 - (0)4 - / 7 / - 3
232gbs190020 64% 0.497 PF00587 C1_S136 - (30)4 4 / 2 / - 2
233gbs171820 77% 0.572 PF00857 C5_S130 - (0)4 - / - / 5 1
234gbs159318 55% 0.474 PF00293 C3_S150 - (33)4 - / - / 5 2
235gbs001722 64% 0.632 PF13793 C5_S120 - (13)4 - / - / 7 3
236gbs032120 55% 0.607 PF00465 C2_S131 - (28)4 4 / - / 5 2
237gbs092120 61% 0.548 PF01641 C6_S113 - (0)4 - / - / 6 1
238gbs208219 36% 0.461 PF00512 C1_S129 - (25)4 2 / 1 / 1 2
239gbs043019 37% 0.565 PF00512 C3_S133 - (26)4 1 / 3 / - 3
240gbs082119 38% 0.551 PF01479 C7_S117 - (0)4 - / - / 1 1
241gbs212222 91% 0.584 PF02274 C3_S112 - (7)4 - / - / 3 2
242gbs067120 52% 0.469 PF02837 C1_S124 - (0)4 - / - / 4 1
243gbs004220 52% 0.604 PF02844 C1_S132 - (21)4 - / 3 / 5 3
244gbs175126 42% 0.575 PF00557 C1_S120 - (1)4 - / 1 / 4 0
245gbs153815 62% 0.565 PF02073 C5_S14 - (0)4 - / - / 2 1
246gbs181217 67% 0.488 PF03144 C2_S119 - (0)4 - / 8 / 2 2
247gbs118419 41% 0.528 PF08245 C1_S124 - (12)4 - / - / 3 2
248gbs052013 55% 0.449 PF03143 C2_S132 - (0)4 - / - / 4 2
249gbs166417 36% 0.460 PF08245 C2_S124 - (13)4 1 / 2 / 1 3
250gbs205323 68% 0.528 PF00313 C5_S139 - (0)4 3 / 2 / - 0

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