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]
200gbs127818 53% 0.578 PF00156 C5_S130 - (24)5 - / 3 / 4 2
201gbs157225 93% 0.644 PF00696 C1_S128 - (19)7 - / 3 / 4 3
202gbs151719 54% 0.561 PF00534 C1_S133 - (21)4 - / 3 / 2 2
203gbs125920 39% 0.554 PF07521 C1_S117 - (0)3 - / 3 / 1 2
204gbs051519 50% 0.604 PF14815 C2_S149 - (0)2 - / 3 / 1 0
205gbs093022 58% 0.628 PF00365 C6_S113 - (12)3 - / 3 / 1 1
206gbs054122 53% 0.618 PF03853 C3_S163 - (51)5 - / 3 / 1 2
207gbs141219 100% 0.668 PF02645 C6_S128 - (0)3 - / 3 / 1 2
208gbs155320 43% 0.672 PF01121 C2_S127 - (19)4 - / 3 / 1 3
209gbs186620 37% 0.559 PF01207 C4_S143 - (32)1 - / 3 / - 1
210gbs157321 35% 0.651 PF00005 C1_S142 - (41)3 - / 3 / - 2
211gbs026340 77% 0.612 PF00370 C4_S157 - (57)14 - / 2 / 18 4
212gbs012036 40% 0.571 PF00005 C1_S121 - (0)10 - / 2 / 18 5
213gbs119220 73% 0.601 PF00171 C3_S134 - (0)8 - / 2 / 8 3
214gbs187915 36% 0.460 PF05649 C6_S119 - (0)11 - / 2 / 8 7
215gbs195620 47% 0.574 PF02475 C1_S155 - (39)4 - / 2 / 6 1
216gbs204820 37% 0.525 PF00994 C3_S110 - (0)6 - / 2 / 5 3
217gbs170812 57% 0.617 PF01926 C7_S113 - (0)3 - / 2 / 4 2
218gbs014825 36% 0.555 PF00005 C1_S147 - (0)5 - / 2 / 3 4
219gbs020414 37% 0.513 PF00588 C2_S127 - (0)3 - / 2 / 2 0
220gbs140125 44% 0.395 PF00005 C1_S157 - (55)6 - / 2 / 2 2
221gbs045518 56% 0.480 PF00317 C4_S18 - (8)3 - / 2 / 2 3
222gbs11179 58% 0.673 PF00156 C2_S142 - (30)3 - / 2 / 2 2
223gbs133420 61% 0.474 PF00294 C1_S144 - (31)3 - / 2 / 2 3
224gbs170518 98% 0.642 PF01966 C6_S15 - (0)2 - / 2 / 2 2
225gbs041710 54% 0.411 PF11987 C3_S19 - (0)2 - / 2 / 2 2
226gbs014920 32% 0.500 PF00288 C1_S152 - (39)3 - / 2 / 1 2
227gbs09027 58% 0.703 PF00633 C5_S113 - (0)2 - / 2 / 1 1
228gbs084321 36% 0.663 PF00271 C7_S128 - (0)2 - / 2 / 1 1
229gbs029216 80% 0.583 PF05175 C1_S120 - (0)1 - / 2 / 1 1
230gbs020619 59% 0.629 PF02645 C2_S128 - (6)2 - / 2 / - 1
231gbs139420 52% 0.579 PF00288 C4_S133 - (24)1 - / 2 / - 1
232gbs147020 71% 0.558 PF05724 C2_S17 - (1)1 - / 2 / - 0
233gbs124517 38% 0.592 PF02706 C2_S129 - (27)2 - / 2 / - 1
234gbs053520 64% 0.505 PF10431 C5_S116 - (0)2 - / 2 / - 2
235gbs054819 69% 0.599 PF02645 C4_S128 - (0)2 - / 2 / - 1
236gbs171720 48% 0.642 PF02737 C1_S148 - (38)5 - / 2 / - 1
237gbs178421 38% 0.385 PF00005 C1_S154 - (52)1 - / 2 / - 1
238gbs111016 37% 0.456 PF00265 C3_S137 - (35)2 - / 2 / - 2
239gbs110666 79% 0.508 PF00464 C1_S197 - (51)15 - / 1 / 52 4
240gbs054442 57% 0.517 PF00348 C1_S178 - (60)13 - / 1 / 28 7
241gbs057130 40% 0.633 PF00155 C1_S138 - (33)7 - / 1 / 24 3
242gbs001831 38% 0.608 PF00155 C1_S145 - (34)9 - / 1 / 22 2
243gbs004340 63% 0.605 PF00731 C4_S138 - (28)12 - / 1 / 20 4
244gbs191128 75% 0.532 PF00128 C1_S1106 - (0)16 - / 1 / 18 7
245gbs014734 38% 0.461 PF00005 C1_S147 - (0)5 - / 1 / 16 3
246gbs174227 36% 0.371 PF00005 C2_S120 - (0)10 - / 1 / 16 5
247gbs191234 50% 0.519 PF08402 C1_S129 - (0)9 - / 1 / 13 4
248gbs117023 52% 0.542 PF00232 C2_S190 - (70)13 - / 1 / 9 5
249gbs053826 63% 0.632 PF08402 C1_S133 - (0)8 - / 1 / 9 0
250gbs200523 72% 0.508 PF01717 C2_S113 - (8)7 - / 1 / 8 3

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