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]
100gbs191234 50% 0.519 PF08402 C1_S129 - (0)9 - / 1 / 13 4
101gbs013130 55% 0.605 PF08402 C1_S144 - (0)9 - / 12 / 7 5
102gbs192733 49% 0.607 PF02580 C11_S119 - (0)9 - / 1 / 8 2
103gbs078744 75% 0.586 PF01820 C1_S168 - (50)9 - / 18 / 16 3
104gbs061028 67% 0.538 PF00275 C8_S126 - (15)9 2 / 2 / 7 4
105gbs092234 35% 0.398 PF08282 C1_S132 - (24)8 - / 3 / 7 1
106gbs212636 65% 0.589 PF00696 C2_S144 - (19)8 - / 8 / 14 2
107gbs053826 63% 0.632 PF08402 C1_S133 - (0)8 - / 1 / 9 0
108gbs005426 65% 0.614 PF00107 C1_S158 - (33)8 1 / 1 / 2 2
109gbs185033 54% 0.580 PF00923 C4_S153 - (1)8 - / - / 17 3
110gbs004423 50% 0.545 PF02222 C2_S152 - (37)8 - / 7 / 11 5
111gbs161642 38% 0.464 PF03372 C2_S191 - (1)8 - / 6 / 17 0
112gbs084132 67% 0.533 PF00171 C4_S120 - (0)8 2 / 10 / 1 4
113gbs173027 37% 0.518 PF00793 C4_S120 - (17)8 - / - / 8 3
114gbs050846 47% 0.452 PF00005 C1_S157 - (55)8 - / 23 / 8 5
115gbs183321 74% 0.545 PF13193 C3_S158 - (31)8 - / 10 / 3 3
116gbs085832 46% 0.541 PF08543 C2_S1108 - (74)8 - / 5 / 12 2
117gbs119220 73% 0.601 PF00171 C3_S134 - (0)8 - / 2 / 8 3
118gbs169428 71% 0.606 PF02733 C11_S147 - (25)8 3 / - / 7 0
119gbs028432 52% 0.523 PF07992 C1_S1111 - (101)8 5 / 11 / 4 3
120gbs118330 59% 0.626 PF01227 C9_S125 - (0)8 - / - / 22 3
121gbs181018 46% 0.519 PF03767 C2_S119 - (1)8 - / - / 7 5
122gbs122833 85% 0.490 PF00521 C3_S164 - (0)8 - / - / 28 1
123gbs076934 58% 0.566 PF00926 C7_S124 - (0)8 - / - / 17 3
124gbs208437 48% 0.558 PF00696 C6_S144 - (19)8 - / 8 / 14 2
125gbs104624 56% 0.636 PF00132 C2_S1121 - (53)8 - / - / 5 0
126gbs013920 52% 0.558 PF00266 C1_S161 - (46)8 - / - / 13 2
127gbs010023 37% 0.603 PF08543 C1_S193 - (58)7 - / 9 / 2 2
128gbs116527 41% 0.529 PF00266 C1_S143 - (33)7 - / - / 19 2
129gbs202327 88% 0.597 PF01676 C7_S117 - (4)7 - / - / 8 3
130gbs174141 42% 0.384 PF00005 C2_S151 - (49)7 - / 21 / 1 5
131gbs074218 56% 0.508 PF09239 C1_S140 - (33)7 4 / 9 / - 4
132gbs004920 55% 0.535 PF05496 C3_S122 - (0)7 - / 10 / 5 4
133gbs011725 34% 0.458 PF00294 C1_S159 - (47)7 - / 4 / 20 4
134gbs057130 40% 0.633 PF00155 C1_S138 - (33)7 - / 1 / 24 3
135gbs005022 40% 0.530 PF01451 C9_S117 - (2)7 - / - / 9 4
136gbs157225 93% 0.644 PF00696 C1_S128 - (19)7 - / 3 / 4 3
137gbs200523 72% 0.508 PF01717 C2_S113 - (8)7 - / 1 / 8 3
138gbs082923 48% 0.430 PF07973 C2_S122 - (20)7 1 / 4 / 4 5
139gbs172428 42% 0.715 PF08501 C7_S150 - (47)7 10 / 6 / 4 2
140gbs164941 74% 0.595 PF01177 C3_S158 - (41)7 - / - / 30 3
141gbs178320 45% 0.546 PF00348 C1_S124 - (19)7 - / - / 9 3
142gbs191055 54% 0.624 PF01370 C1_S1134 - (116)7 43 / 1 / - 2
143gbs174029 43% 0.378 PF00005 C1_S175 - (75)7 - / 7 / 4 4
144gbs184020 44% 0.529 PF00456 C3_S115 - (10)7 - / 8 / 3 4
145gbs033121 58% 0.518 PF08541 C1_S122 - (10)7 - / 9 / 3 4
146gbs183823 58% 0.558 PF04069 C3_S130 - (0)7 - / - / 3 1
147gbs034324 55% 0.446 PF00587 C2_S135 - (34)7 - / 11 / 6 4
148gbs180020 44% 0.569 PF00814 C2_S133 - (33)7 - / 8 / 2 4
149gbs188921 100% 0.521 PF07470 C1_S115 - (0)7 - / 1 / 4 2
150gbs023320 54% 0.480 PF04069 C3_S129 - (1)7 - / - / 5 3

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