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]
150gbs211925 44% 0.581 PF02863 C9_S1128 - (0)4 - / - / 9 0
151gbs056525 39% 0.528 PF08402 C1_S115 - (0)2 - / - / 5 1
152gbs181925 83% 0.728 PF00834 C3_S116 - (10)5 - / - / 4 2
153gbs011725 34% 0.458 PF00294 C1_S159 - (47)7 - / 4 / 20 4
154gbs002724 78% 0.636 PF00551 C7_S1145 - (15)3 - / - / 2 1
155gbs104624 56% 0.636 PF00132 C2_S1121 - (53)8 - / - / 5 0
156gbs142424 50% 0.574 PF01746 C5_S130 - (19)12 - / 16 / 6 5
157gbs034324 55% 0.446 PF00587 C2_S135 - (34)7 - / 11 / 6 4
158gbs212724 56% 0.530 PF00579 C3_S136 - (28)5 - / - / 7 3
159gbs080824 62% 0.628 PF00081 C9_S14 - (1)3 - / - / 3 1
160gbs169224 54% 0.588 PF02733 C6_S141 - (23)6 2 / - / 3 0
161gbs189124 99% 0.528 PF00106 C1_S161 - (46)5 1 / - / 3 1
162gbs066824 36% 0.555 PF02826 C1_S159 - (42)4 3 / 1 / 4 1
163gbs042124 51% 0.397 PF00702 C3_S116 - (0)5 - / 6 / 1 2
164gbs176024 43% 0.504 PF14815 C2_S148 - (0)9 11 / - / 5 2
165gbs140824 47% 0.438 PF00005 C1_S153 - (53)2 - / 4 / - 1
166gbs011224 42% 0.540 PF00749 C5_S119 - (16)5 - / 5 / 5 2
167gbs012524 45% 0.699 PF01116 C1_S127 - (21)9 - / - / 18 5
168gbs010023 37% 0.603 PF08543 C1_S193 - (58)7 - / 9 / 2 2
169gbs205323 68% 0.528 PF00313 C5_S139 - (0)4 3 / 2 / - 0
170gbs082923 48% 0.430 PF07973 C2_S122 - (20)7 1 / 4 / 4 5
171gbs127023 98% 0.777 PF08124 C1_S129 - (0)10 1 / 1 / 9 3
172gbs206123 48% 0.502 PF03129 C1_S128 - (9)3 - / 1 / 7 2
173gbs200523 72% 0.508 PF01717 C2_S113 - (8)7 - / 1 / 8 3
174gbs139523 68% 0.526 PF00288 C1_S151 - (26)9 - / 11 / 1 3
175gbs184723 39% 0.571 PF02826 C1_S179 - (62)4 - / - / 4 0
176gbs060523 45% 0.603 PF00702 C2_S115 - (13)4 - / - / 4 3
177gbs187823 43% 0.528 PF02016 C4_S139 - (0)3 - / - / 3 0
178gbs183823 58% 0.558 PF04069 C3_S130 - (0)7 - / - / 3 1
179gbs004423 50% 0.545 PF02222 C2_S152 - (37)8 - / 7 / 11 5
180gbs167123 35% 0.483 PF00512 C3_S129 - (24)6 2 / 4 / 1 3
181gbs117023 52% 0.542 PF00232 C2_S190 - (70)13 - / 1 / 9 5
182gbs138723 63% 0.540 PF00368 C3_S120 - (12)12 - / 1 / - 1
183gbs205523 38% 0.580 PF02863 C8_S1168 - (0)4 - / - / 5 1
184gbs172923 52% 0.554 PF01648 C6_S135 - (22)3 - / - / 5 1
185gbs115823 51% 0.549 PF00106 C1_S154 - (37)4 9 / - / - 2
186gbs201222 83% 0.524 PF13603 C1_S117 - (0)4 - / 4 / 1 1
187gbs093622 45% 0.579 PF00005 C1_S121 - (0)1 - / 1 / - 0
188gbs212222 91% 0.584 PF02274 C3_S112 - (7)4 - / - / 3 2
189gbs181422 73% 0.536 PF00164 C2_S114 - (0)0 - / - / 2 0
190gbs063022 99% 0.440 PF02038 C4_S111 - (0)2 - / - / 3 0
191gbs141722 44% 0.515 PF00294 C2_S158 - (39)4 - / - / 8 2
192gbs127122 94% 0.772 PF01370 C1_S175 - (68)4 23 / - / - 2
193gbs179222 36% 0.570 PF02353 C2_S146 - (26)10 - / 16 / 8 0
194gbs005022 40% 0.530 PF01451 C9_S117 - (2)7 - / - / 9 4
195gbs084422 50% 0.538 PF00485 C2_S137 - (21)10 2 / 5 / 5 6
196gbs011022 80% 0.696 PF00484 9 - (0)3 - / - / - 0
197gbs054122 53% 0.618 PF03853 C3_S163 - (51)5 - / 3 / 1 2
198gbs145122 51% 0.535 PF00884 C4_S111 - (4)3 - / - / 3 1
199gbs208922 40% 0.500 PF04069 C2_S116 - (0)4 - / - / 1 0
200gbs177322 42% 0.461 PF01243 C4_S139 - (0)2 - / 11 / - 1

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