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]
150gbs191925 61% 0.480 PF04650 C5_S175 - (37)10 - / - / 19 4
151gbs000725 78% 0.573 PF01195 C2_S123 - (0)13 - / 1 / 8 5
152gbs211925 44% 0.581 PF02863 C9_S1128 - (0)4 - / - / 9 0
153gbs014825 36% 0.555 PF00005 C1_S147 - (0)5 - / 2 / 3 4
154gbs212724 56% 0.530 PF00579 C3_S136 - (28)5 - / - / 7 3
155gbs104624 56% 0.636 PF00132 C2_S1121 - (53)8 - / - / 5 0
156gbs189124 99% 0.528 PF00106 C1_S161 - (46)5 1 / - / 3 1
157gbs080824 62% 0.628 PF00081 C9_S14 - (1)3 - / - / 3 1
158gbs169224 54% 0.588 PF02733 C6_S141 - (23)6 2 / - / 3 0
159gbs176024 43% 0.504 PF14815 C2_S148 - (0)9 11 / - / 5 2
160gbs012524 45% 0.699 PF01116 C1_S127 - (21)9 - / - / 18 5
161gbs142424 50% 0.574 PF01746 C5_S130 - (19)12 - / 16 / 6 5
162gbs034324 55% 0.446 PF00587 C2_S135 - (34)7 - / 11 / 6 4
163gbs140824 47% 0.438 PF00005 C1_S153 - (53)2 - / 4 / - 1
164gbs066824 36% 0.555 PF02826 C1_S159 - (42)4 3 / 1 / 4 1
165gbs002724 78% 0.636 PF00551 C7_S1145 - (15)3 - / - / 2 1
166gbs011224 42% 0.540 PF00749 C5_S119 - (16)5 - / 5 / 5 2
167gbs042124 51% 0.397 PF00702 C3_S116 - (0)5 - / 6 / 1 2
168gbs010023 37% 0.603 PF08543 C1_S193 - (58)7 - / 9 / 2 2
169gbs172923 52% 0.554 PF01648 C6_S135 - (22)3 - / - / 5 1
170gbs060523 45% 0.603 PF00702 C2_S115 - (13)4 - / - / 4 3
171gbs205323 68% 0.528 PF00313 C5_S139 - (0)4 3 / 2 / - 0
172gbs082923 48% 0.430 PF07973 C2_S122 - (20)7 1 / 4 / 4 5
173gbs183823 58% 0.558 PF04069 C3_S130 - (0)7 - / - / 3 1
174gbs167123 35% 0.483 PF00512 C3_S129 - (24)6 2 / 4 / 1 3
175gbs200523 72% 0.508 PF01717 C2_S113 - (8)7 - / 1 / 8 3
176gbs115823 51% 0.549 PF00106 C1_S154 - (37)4 9 / - / - 2
177gbs206123 48% 0.502 PF03129 C1_S128 - (9)3 - / 1 / 7 2
178gbs139523 68% 0.526 PF00288 C1_S151 - (26)9 - / 11 / 1 3
179gbs138723 63% 0.540 PF00368 C3_S120 - (12)12 - / 1 / - 1
180gbs004423 50% 0.545 PF02222 C2_S152 - (37)8 - / 7 / 11 5
181gbs187823 43% 0.528 PF02016 C4_S139 - (0)3 - / - / 3 0
182gbs205523 38% 0.580 PF02863 C8_S1168 - (0)4 - / - / 5 1
183gbs184723 39% 0.571 PF02826 C1_S179 - (62)4 - / - / 4 0
184gbs127023 98% 0.777 PF08124 C1_S129 - (0)10 1 / 1 / 9 3
185gbs117023 52% 0.542 PF00232 C2_S190 - (70)13 - / 1 / 9 5
186gbs093622 45% 0.579 PF00005 C1_S121 - (0)1 - / 1 / - 0
187gbs084422 50% 0.538 PF00485 C2_S137 - (21)10 2 / 5 / 5 6
188gbs194722 43% 0.624 PF00512 C3_S132 - (30)5 2 / 10 / - 3
189gbs063022 99% 0.440 PF02038 C4_S111 - (0)2 - / - / 3 0
190gbs138522 34% 0.517 PF00303 C2_S132 - (17)5 - / - / 5 2
191gbs177322 42% 0.461 PF01243 C4_S139 - (0)2 - / 11 / - 1
192gbs093022 58% 0.628 PF00365 C6_S113 - (12)3 - / 3 / 1 1
193gbs127122 94% 0.772 PF01370 C1_S175 - (68)4 23 / - / - 2
194gbs181422 73% 0.536 PF00164 C2_S114 - (0)0 - / - / 2 0
195gbs083622 87% 0.571 PF00268 C4_S16 - (0)2 - / - / 1 1
196gbs011022 80% 0.696 PF00484 9 - (0)3 - / - / - 0
197gbs212222 91% 0.584 PF02274 C3_S112 - (7)4 - / - / 3 2
198gbs120922 68% 0.536 PF13361 C7_S133 - (0)2 3 / 6 / 7 2
199gbs005022 40% 0.530 PF01451 C9_S117 - (2)7 - / - / 9 4
200gbs001722 64% 0.632 PF13793 C5_S120 - (13)4 - / - / 7 3

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