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]
200gbs115823 51% 0.549 PF00106 C1_S154 - (37)4 9 / - / - 2
201gbs053220 57% 0.449 PF01588 C1_S130 - (13)2 - / 1 / 1 2
202gbs166720 73% 0.623 PF01926 C1_S127 - (0)3 - / 5 / - 2
203gbs181925 83% 0.728 PF00834 C3_S116 - (10)5 - / - / 4 2
204gbs012325 48% 0.534 PF00764 C5_S119 - (16)6 - / - / 4 2
205gbs190020 64% 0.497 PF00587 C1_S136 - (30)4 4 / 2 / - 2
206gbs018720 50% 0.499 PF00005 C1_S121 - (0)3 - / - / 3 2
207gbs171220 58% 0.471 PF01425 C7_S151 - (0)2 - / - / 2 2
208gbs010023 37% 0.603 PF08543 C1_S193 - (58)7 - / 9 / 2 2
209gbs127122 94% 0.772 PF01370 C1_S175 - (68)4 23 / - / - 2
210gbs170812 57% 0.617 PF01926 C7_S113 - (0)3 - / 2 / 4 2
211gbs170518 98% 0.642 PF01966 C6_S15 - (0)2 - / 2 / 2 2
212gbs051821 68% 0.604 PF00480 C2_S132 - (25)5 - / - / 4 2
213gbs027021 35% 0.568 PF00005 C1_S119 - (0)6 - / 5 / - 2
214gbs089320 47% 0.513 PF01926 C1_S136 - (0)3 - / 4 / 2 2
215gbs001831 38% 0.608 PF00155 C1_S145 - (34)9 - / 1 / 22 2
216gbs208219 36% 0.461 PF00512 C1_S129 - (25)4 2 / 1 / 1 2
217gbs025220 34% 0.590 PF08402 C1_S13 - (0)2 - / 1 / 1 2
218gbs159318 55% 0.474 PF00293 C3_S150 - (33)4 - / - / 5 2
219gbs013920 52% 0.558 PF00266 C1_S161 - (46)8 - / - / 13 2
220gbs129317 38% 0.438 PF03009 C1_S118 - (12)3 - / - / 2 2
221gbs111016 37% 0.456 PF00265 C3_S137 - (35)2 - / 2 / - 2
222gbs156019 47% 0.659 PF01926 C1_S162 - (0)4 6 / 3 / 1 2
223gbs031158 57% 0.623 PF00160 C1_S1128 - (5)14 - / 29 / 9 2
224gbs020220 45% 0.557 PF01588 C2_S129 - (17)4 - / 1 / 3 2
225gbs181217 67% 0.488 PF03144 C2_S119 - (0)4 - / 8 / 2 2
226gbs033420 66% 0.560 PF00698 C1_S121 - (16)5 - / - / 5 2
227gbs191055 54% 0.624 PF01370 C1_S1134 - (116)7 43 / 1 / - 2
228gbs144720 79% 0.477 PF01264 C7_S12 - (0)2 - / 1 / 1 2
229gbs094744 68% 0.621 PF00056 C7_S140 - (30)5 2 / 14 / 7 2
230gbs015520 59% 0.570 PF00905 C1_S123 - (0)2 - / - / 2 2
231gbs126521 55% 0.560 PF02776 C6_S156 - (20)6 - / - / 4 2
232gbs181128 100% 0.507 PF00044 C1_S118 - (10)3 6 / 2 / - 2
233gbs003220 76% 0.641 PF04131 C2_S133 - (11)6 - / - / 6 2
234gbs206123 48% 0.502 PF03129 C1_S128 - (9)3 - / 1 / 7 2
235gbs005313 35% 0.532 PF00465 C1_S118 - (15)3 - / 6 / - 2
236gbs127818 53% 0.578 PF00156 C5_S130 - (24)5 - / 3 / 4 2
237gbs176024 43% 0.504 PF14815 C2_S148 - (0)9 11 / - / 5 2
238gbs192733 49% 0.607 PF02580 C11_S119 - (0)9 - / 1 / 8 2
239gbs054122 53% 0.618 PF03853 C3_S163 - (51)5 - / 3 / 1 2
240gbs188921 100% 0.521 PF07470 C1_S115 - (0)7 - / 1 / 4 2
241gbs032120 55% 0.607 PF00465 C2_S131 - (28)4 4 / - / 5 2
242gbs155466 57% 0.524 PF06827 C5_S1161 - (0)5 - / 27 / 40 2
243gbs011224 42% 0.540 PF00749 C5_S119 - (16)5 - / 5 / 5 2
244gbs139320 69% 0.643 PF01070 C3_S142 - (31)3 1 / 2 / - 2
245gbs116527 41% 0.529 PF00266 C1_S143 - (33)7 - / - / 19 2
246gbs108920 59% 0.569 PF01268 C1_S117 - (0)5 - / 4 / 6 2
247gbs042124 51% 0.397 PF00702 C3_S116 - (0)5 - / 6 / 1 2
248gbs125920 39% 0.554 PF07521 C1_S117 - (0)3 - / 3 / 1 2
249gbs199720 43% 0.415 PF03641 C3_S115 - (1)5 - / - / 4 2
250gbs138522 34% 0.517 PF00303 C2_S132 - (17)5 - / - / 5 2

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