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]
100gbs179312 44% 0.652 PF13411 C2_S118 - (0)? - / - / 1 0
101gbs094137 60% 0.651 PF00383 C5_S156 - (38)13 - / - / 29 7
102gbs157321 35% 0.651 PF00005 C1_S142 - (41)3 - / 3 / - 2
103gbs09286 50% 0.649 PF07702 41 - (0)? - / - / - 0
104gbs185220 53% 0.648 PF01261 33 - (0)? - / - / - 0
105gbs058420 35% 0.647 PF00258 74 - (72)? - / - / - 0
106gbs157120 58% 0.647 PF01765 C3_S13 - (0)1 - / - / 3 0
107gbs147913 37% 0.647 PF02302 2 - (0)? - / - / - 0
108gbs208113 47% 0.646 PF00072 C4_S110 - (0)2 - / - / 2 0
109gbs11459 22% 0.645 PF00261 0 - (0)? - / - / - 0
110gbs08778 38% 0.645 PF00430 0 - (0)? - / - / - 0
111gbs052210 97% 0.644 PF08245 C1_S139 - (19)1 - / - / 1 0
112gbs157225 93% 0.644 PF00696 C1_S128 - (19)7 - / 3 / 4 3
113gbs16637 34% 0.644 PF00583 48 - (34)? - / - / - 0
114gbs20304 46% 0.644 PF00166 0 - (0)? - / - / - 0
115gbs05334 74% 0.643 PF01717 0 - (0)? - / - / - 0
116gbs139320 69% 0.643 PF01070 C3_S142 - (31)3 1 / 2 / - 2
117gbs171720 48% 0.642 PF02737 C1_S148 - (38)5 - / 2 / - 1
118gbs170518 98% 0.642 PF01966 C6_S15 - (0)2 - / 2 / 2 2
119gbs154420 41% 0.642 PF00903 C1_S138 - (0)2 - / - / 2 0
120gbs003220 76% 0.641 PF04131 C2_S133 - (11)6 - / - / 6 2
121gbs101815 86% 0.640 PF00440 8 - (0)? - / - / - 0
122gbs013720 63% 0.640 PF00005 C1_S111 - (0)2 - / - / 1 1
123gbs07520 26% 0.640 PF11976 3 - (0)? - / - / - 0
124gbs00110 42% 0.640 PF01717 3 - (0)? - / - / - 0
125gbs154235 48% 0.640 PF00248 C6_S1121 - (72)13 15 / - / 3 3
126gbs056920 58% 0.639 PF00106 C1_S1143 - (70)2 3 / 1 / - 1
127gbs169510 55% 0.639 PF02734 C7_S17 - (5)2 - / 4 / - 1
128gbs136713 27% 0.639 PF00717 5 - (0)? - / - / - 0
129gbs00810 29% 0.638 PF01147 3 - (0)? - / - / - 0
130gbs116421 53% 0.638 PF13793 C4_S136 - (17)1 - / - / 4 1
131gbs14465 50% 0.637 PF01023 0 - (0)? - / - / - 0
132gbs108120 76% 0.637 PF00156 C2_S132 - (19)3 - / - / 3 1
133gbs062915 100% 0.637 PF05737 0 - (0)? - / - / - 0
134gbs078248 75% 0.637 PF03143 C3_S165 - (0)5 13 / 25 / 2 3
135gbs002724 78% 0.636 PF00551 C7_S1145 - (15)3 - / - / 2 1
136gbs091668 55% 0.636 PF00334 C7_S162 - (57)20 - / 18 / 41 9
137gbs138321 60% 0.636 PF10431 C6_S113 - (11)? - / - / 1 0
138gbs104624 56% 0.636 PF00132 C2_S1121 - (53)8 - / - / 5 0
139gbs042614 39% 0.635 PF00549 13 - (10)? - / - / - 0
140gbs055717 47% 0.635 PF08282 21 - (2)3 - / - / - 0
141gbs185334 90% 0.634 PF00215 C1_S142 - (37)11 - / - / 27 6
142gbs057130 40% 0.633 PF00155 C1_S138 - (33)7 - / 1 / 24 3
143gbs000910 42% 0.633 PF01479 1 - (0)? - / - / - 0
144gbs001722 64% 0.632 PF13793 C5_S120 - (13)4 - / - / 7 3
145gbs038011 36% 0.632 PF01402 6 - (3)? - / - / - 0
146gbs17613 42% 0.632 PF00717 49 - (0)1 - / - / - 0
147gbs053826 63% 0.632 PF08402 C1_S133 - (0)8 - / 1 / 9 0
148gbs042714 72% 0.632 PF01475 0 - (0)? - / - / - 0
149gbs134012 32% 0.632 PF01402 3 - (0)? - / - / - 0
150gbs15830 41% 0.631 PF00510 1 - (0)? - / - / - 0

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