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]
150gbs086420 88% 0.473 PF00557 C3_S152 - (1)2 - / - / 3 1
151gbs004423 50% 0.545 PF02222 C2_S152 - (37)8 - / 7 / 11 5
152gbs049013 41% 0.492 PF13302 52 - (0)? - / - / - 0
153gbs095513 51% 0.545 PF13932 C1_S152 - (32)2 4 / - / - 1
154gbs173519 29% 0.399 PF00251 C2_S152 - (16)1 - / - / 1 1
155gbs066334 37% 0.527 PF08402 C1_S152 - (49)10 - / - / 15 5
156gbs014920 32% 0.500 PF00288 C1_S152 - (39)3 - / 2 / 1 2
157gbs188420 32% 0.528 PF00356 C3_S152 - (0)2 - / - / 2 0
158gbs139523 68% 0.526 PF00288 C1_S151 - (26)9 - / 11 / 1 3
159gbs171220 58% 0.471 PF01425 C7_S151 - (0)2 - / - / 2 2
160gbs054028 54% 0.659 PF02882 C5_S151 - (37)15 7 / 6 / 12 7
161gbs186715 34% 0.574 PF01712 C4_S151 - (38)4 - / 7 / 2 3
162gbs015430 60% 0.574 PF00579 C3_S151 - (40)7 - / 9 / 7 4
163gbs045012 46% 0.424 PF00583 51 - (30)? - / - / - 0
164gbs174141 42% 0.384 PF00005 C2_S151 - (49)7 - / 21 / 1 5
165gbs210920 54% 0.612 PF00005 C1_S150 - (0)2 - / - / 1 1
166gbs110338 38% 0.427 PF00005 C4_S150 - (48)6 - / 21 / 1 4
167gbs17966 79% 0.545 PF02852 C3_S150 - (45)2 2 / - / - 1
168gbs11477 43% 0.758 PF00717 50 - (0)? - / - / - 0
169gbs195920 48% 0.519 PF00583 50 - (23)0 - / - / - 0
170gbs184920 40% 0.524 PF00356 50 - (0)? - / - / - 0
171gbs159318 55% 0.474 PF00293 C3_S150 - (33)4 - / - / 5 2
172gbs087420 36% 0.545 PF00534 C1_S150 - (21)6 - / 7 / 7 3
173gbs172428 42% 0.715 PF08501 C7_S150 - (47)7 10 / 6 / 4 2
174gbs212439 73% 0.710 PF02729 C8_S150 - (42)11 - / 5 / 20 5
175gbs159450 79% 0.606 PF12804 C4_S150 - (33)20 1 / 27 / 15 12
176gbs17613 42% 0.632 PF00717 49 - (0)1 - / - / - 0
177gbs078445 54% 0.561 PF00300 C1_S149 - (41)15 - / - / 28 5
178gbs051519 50% 0.604 PF14815 C2_S149 - (0)2 - / 3 / 1 0
179gbs13245 41% 0.187 PF12950 C3_S149 - (22)1 - / - / 1 0
180gbs159720 36% 0.511 PF02894 C1_S149 - (41)1 - / - / 1 0
181gbs056720 43% 0.527 PF00561 49 - (3)? - / - / - 0
182gbs161220 56% 0.582 PF03848 C1_S149 - (26)6 - / 7 / 1 1
183gbs171720 48% 0.642 PF02737 C1_S148 - (38)5 - / 2 / - 1
184gbs16637 34% 0.644 PF00583 48 - (34)? - / - / - 0
185gbs176024 43% 0.504 PF14815 C2_S148 - (0)9 11 / - / 5 2
186gbs196018 50% 0.354 PF00293 48 - (15)? - / - / - 0
187gbs127411 33% 0.463 PF01266 48 - (37)? - / - / - 0
188gbs191720 55% 0.544 PF02502 C7_S148 - (36)6 - / - / 2 1
189gbs109520 54% 0.542 PF00724 48 - (24)? - / - / - 0
190gbs172826 49% 0.473 PF01168 C2_S148 - (37)6 - / 6 / 14 3
191gbs117520 67% 0.595 PF02793 C1_S147 - (0)5 - / - / 7 3
192gbs05119 33% 0.487 PF04055 C2_S147 - (13)2 - / 4 / 1 1
193gbs177715 33% 0.281 PF00230 47 - (0)? - / - / - 0
194gbs014825 36% 0.555 PF00005 C1_S147 - (0)5 - / 2 / 3 4
195gbs154011 38% 0.526 PF01425 47 - (0)? - / - / - 0
196gbs014734 38% 0.461 PF00005 C1_S147 - (0)5 - / 1 / 16 3
197gbs169428 71% 0.606 PF02733 C11_S147 - (25)8 3 / - / 7 0
198gbs122949 84% 0.523 PF01751 C3_S147 - (0)17 5 / 20 / 9 10
199gbs165916 47% 0.486 PF01464 46 - (0)? - / - / - 0
200gbs04394 32% 0.192 PF12122 46 - (0)? - / - / - 0

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