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]
200gbs067328 47% 0.617 PF01081 C2_S130 - (26)4 - / - / 10 1
201gbs169913 52% 0.617 PF13411 23 - (0)? - / - / - 0
202gbs132714 32% 0.616 PF00717 18 - (0)? - / - / - 0
203gbs157820 54% 0.616 PF00687 0 - (0)? - / - / - 0
204gbs197910 83% 0.616 PF06013 1 - (0)? - / - / - 0
205gbs01272 46% 0.616 PF00830 0 - (0)? - / - / - 0
206gbs079751 47% 0.615 PF00271 C6_S153 - (0)11 2 / 12 / 16 6
207gbs172020 59% 0.615 PF00155 C1_S130 - (26)3 - / 1 / 2 2
208gbs144220 45% 0.614 PF02926 C5_S112 - (9)3 - / 1 / 2 2
209gbs136812 22% 0.614 PF03960 5 - (0)? - / - / - 0
210gbs005426 65% 0.614 PF00107 C1_S158 - (33)8 1 / 1 / 2 2
211gbs109711 57% 0.613 PF00106 19 - (13)? - / - / - 0
212gbs00934 50% 0.612 PF01274 5 - (0)? - / - / - 0
213gbs026340 77% 0.612 PF00370 C4_S157 - (57)14 - / 2 / 18 4
214gbs210920 54% 0.612 PF00005 C1_S150 - (0)2 - / - / 1 1
215gbs158920 83% 0.611 PF01297 C7_S14 - (0)1 - / - / 1 1
216gbs042014 52% 0.610 PF03965 C4_S114 - (0)2 - / - / 2 0
217gbs102216 35% 0.610 PF01895 29 - (0)? - / - / - 0
218gbs18996 52% 0.610 PF02244 10 - (0)? - / - / - 0
219gbs20729 41% 0.610 PF13193 19 - (0)? - / - / - 0
220gbs20953 50% 0.610 PF12777 1 - (0)? - / - / - 0
221gbs061525 45% 0.609 PF03767 C5_S130 - (1)11 - / - / 19 4
222gbs10852 39% 0.609 PF02729 5 - (5)? - / - / - 0
223gbs109116 76% 0.608 PF02146 34 - (12)? - / - / - 0
224gbs060857 96% 0.608 PF03952 C1_S142 - (34)11 - / 3 / 31 7
225gbs011520 33% 0.608 PF00005 11 - (0)? - / - / - 0
226gbs173418 54% 0.608 PF00358 0 - (0)? - / - / - 0
227gbs001831 38% 0.608 PF00155 C1_S145 - (34)9 - / 1 / 22 2
228gbs032120 55% 0.607 PF00465 C2_S131 - (28)4 4 / - / 5 2
229gbs192733 49% 0.607 PF02580 C11_S119 - (0)9 - / 1 / 8 2
230gbs19253 72% 0.607 PF08934 0 - (0)? - / - / - 0
231gbs081926 63% 0.606 PF01182 C1_S119 - (11)12 - / - / 12 6
232gbs169428 71% 0.606 PF02733 C11_S147 - (25)8 3 / - / 7 0
233gbs159450 79% 0.606 PF12804 C4_S150 - (33)20 1 / 27 / 15 12
234gbs02290 26% 0.605 PF06109 0 - (0)? - / - / - 0
235gbs180511 57% 0.605 PF03738 9 - (0)1 - / - / - 0
236gbs146314 33% 0.605 PF01497 35 - (0)? - / - / - 0
237gbs013130 55% 0.605 PF08402 C1_S144 - (0)9 - / 12 / 7 5
238gbs031713 43% 0.605 PF02302 7 - (5)1 - / - / - 0
239gbs004340 63% 0.605 PF00731 C4_S138 - (28)12 - / 1 / 20 4
240gbs10302 35% 0.604 PF05256 4 - (0)? - / - / - 0
241gbs051519 50% 0.604 PF14815 C2_S149 - (0)2 - / 3 / 1 0
242gbs051821 68% 0.604 PF00480 C2_S132 - (25)5 - / - / 4 2
243gbs145920 52% 0.604 PF01546 8 - (0)? - / - / - 0
244gbs094216 39% 0.604 PF02608 C3_S114 - (0)3 - / 4 / 1 3
245gbs004220 52% 0.604 PF02844 C1_S132 - (21)4 - / 3 / 5 3
246gbs180951 63% 0.603 PF00162 C8_S182 - (72)18 - / 25 / 20 8
247gbs010023 37% 0.603 PF08543 C1_S193 - (58)7 - / 9 / 2 2
248gbs035921 54% 0.603 PF00005 C1_S118 - (0)1 - / - / 1 1
249gbs060523 45% 0.603 PF00702 C2_S115 - (13)4 - / - / 4 3
250gbs04100 31% 0.603 PF03221 13 - (0)? - / - / - 0

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