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]
150gbs15305 37% 0.631 PF00929 17 - (0)? - / - / - 0
151gbs15830 41% 0.631 PF00510 1 - (0)? - / - / - 0
152gbs107416 100% 0.631 PF06013 1 - (0)? - / - / - 0
153gbs127613 61% 0.631 PF00975 15 - (0)? - / - / - 0
154gbs181320 70% 0.630 PF00177 7 - (0)1 - / - / - 0
155gbs031017 54% 0.630 PF00072 3 - (0)? - / - / - 0
156gbs118044 47% 0.630 PF01288 C7_S188 - (37)18 2 / 21 / 16 9
157gbs20973 74% 0.629 PF01423 2 - (0)? - / - / - 0
158gbs020619 59% 0.629 PF02645 C2_S128 - (6)2 - / 2 / - 1
159gbs019720 60% 0.629 PF00312 0 - (0)? - / - / - 0
160gbs16918 57% 0.629 PF00753 10 - (0)? - / - / - 0
161gbs09050 33% 0.628 PF08295 0 - (0)? - / - / - 0
162gbs159167 73% 0.628 PF01048 C1_S191 - (49)20 - / 37 / 17 13
163gbs080824 62% 0.628 PF00081 C9_S14 - (1)3 - / - / 3 1
164gbs093022 58% 0.628 PF00365 C6_S113 - (12)3 - / 3 / 1 1
165gbs19084 35% 0.628 PF02518 24 - (0)? - / - / - 0
166gbs162520 36% 0.627 PF12170 8 - (0)? - / - / - 0
167gbs04437 49% 0.626 PF00825 C3_S12 - (0)1 - / - / 1 0
168gbs030420 46% 0.626 PF00551 62 - (8)2 - / - / - 0
169gbs118330 59% 0.626 PF01227 C9_S125 - (0)8 - / - / 22 3
170gbs04755 45% 0.626 PF00717 67 - (0)? - / - / - 0
171gbs12995 41% 0.626 PF02335 142 - (0)? - / - / - 0
172gbs208539 65% 0.624 PF02729 C8_S146 - (36)12 - / 8 / 18 5
173gbs194722 43% 0.624 PF00512 C3_S132 - (30)5 2 / 10 / - 3
174gbs170643 47% 0.624 PF01467 C4_S168 - (39)18 12 / 7 / 12 5
175gbs086020 42% 0.624 PF02581 C2_S144 - (35)13 - / 7 / 10 4
176gbs189212 99% 0.624 PF02502 C4_S119 - (0)1 - / - / 1 1
177gbs15686 37% 0.624 PF06855 3 - (0)? - / - / - 0
178gbs110715 32% 0.624 PF01300 C6_S18 - (0)2 - / 1 / 1 2
179gbs181517 51% 0.624 PF00156 C2_S143 - (35)1 - / - / 2 0
180gbs191055 54% 0.624 PF01370 C1_S1134 - (116)7 43 / 1 / - 2
181gbs031158 57% 0.623 PF00160 C1_S1128 - (5)14 - / 29 / 9 2
182gbs157420 35% 0.623 PF00005 17 - (0)? - / - / - 0
183gbs166720 73% 0.623 PF01926 C1_S127 - (0)3 - / 5 / - 2
184gbs107970 50% 0.622 PF02729 C9_S171 - (45)20 - / 23 / 21 6
185gbs074948 50% 0.622 PF02978 C5_S175 - (52)11 4 / 16 / 8 3
186gbs033937 58% 0.622 PF02786 C1_S170 - (33)14 - / 15 / 10 8
187gbs190111 54% 0.622 PF00595 19 - (0)? - / - / - 0
188gbs094744 68% 0.621 PF00056 C7_S140 - (30)5 2 / 14 / 7 2
189gbs18260 57% 0.621 PF00012 6 - (0)? - / - / - 0
190gbs032816 56% 0.621 PF13419 C1_S122 - (8)1 - / - / 1 0
191gbs008014 94% 0.621 PF01176 1 - (0)? - / - / - 0
192gbs04811 29% 0.620 PF03853 4 - (0)? - / - / - 0
193gbs117921 63% 0.620 PF02873 C3_S156 - (44)2 7 / - / 1 1
194gbs146815 52% 0.620 PF04055 C4_S124 - (4)4 - / - / 6 0
195gbs059714 44% 0.619 PF00072 C4_S111 - (0)2 - / - / 1 0
196gbs114915 51% 0.619 PF02295 C4_S16 - (0)? - / - / 1 0
197gbs140212 31% 0.619 PF01047 14 - (0)? - / - / - 0
198gbs054122 53% 0.618 PF03853 C3_S163 - (51)5 - / 3 / 1 2
199gbs169913 52% 0.617 PF13411 23 - (0)? - / - / - 0
200gbs067328 47% 0.617 PF01081 C2_S130 - (26)4 - / - / 10 1

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