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]
100gbs010620 51% 0.551 PF00117 C4_S17 - (5)6 - / 1 / 5 3
101gbs010715 38% 0.370 PF12695 29 - (0)? - / - / - 0
102gbs010818 75% 0.239 PF00692 C5_S130 - (19)4 - / - / 2 0
103gbs010915 39% 0.572 PF06745 0 - (0)? - / - / - 0
104gbs011022 80% 0.696 PF00484 9 - (0)3 - / - / - 0
105gbs011120 33% 0.537 PF02852 54 - (49)? - / - / - 0
106gbs011224 42% 0.540 PF00749 C5_S119 - (16)5 - / 5 / 5 2
107gbs011321 47% 0.594 PF13407 C2_S138 - (0)2 - / - / 11 1
108gbs01140 33% 0.067 PF01032 2 - (0)? - / - / - 0
109gbs011520 33% 0.608 PF00005 11 - (0)? - / - / - 0
110gbs011627 56% 0.712 PF05025 C1_S126 - (0)6 - / - / 10 1
111gbs011725 34% 0.458 PF00294 C1_S159 - (47)7 - / 4 / 20 4
112gbs011820 49% 0.593 PF00356 24 - (0)? - / - / - 0
113gbs01190 27% 0.095 PF01435 2 - (0)? - / - / - 0
114gbs012036 40% 0.571 PF00005 C1_S121 - (0)10 - / 2 / 18 5
115gbs012111 43% 0.436 PF00072 18 - (0)? - / - / - 0
116gbs012219 34% 0.537 PF00512 C4_S132 - (29)5 3 / 8 / - 3
117gbs012325 48% 0.534 PF00764 C5_S119 - (16)6 - / - / 4 2
118gbs012420 47% 0.472 PF00206 3 - (0)? - / - / - 0
119gbs012524 45% 0.699 PF01116 C1_S127 - (21)9 - / - / 18 5
120gbs012620 57% 0.574 PF00056 C3_S167 - (56)2 3 / 2 / - 1
121gbs01272 46% 0.616 PF00830 0 - (0)? - / - / - 0
122gbs01280 38% 0.553 PF01361 2 - (0)? - / - / - 0
123gbs012910 20% 0.403 PF02645 3 - (0)? - / - / - 0
124gbs01305 41% 0.564 PF01145 0 - (0)? - / - / - 0
125gbs013130 55% 0.605 PF08402 C1_S144 - (0)9 - / 12 / 7 5
126gbs013210 25% 0.459 -15 - (0)? - / - / - 0
127gbs01331 38% 0.423 PF04253 15 - (0)? - / - / - 0
128gbs01340 40% 0.130 PF09096 1 - (0)? - / - / - 0
129gbs01350 30% 0.336 PF00227 0 - (0)? - / - / - 0
130gbs01361 30% 0.280 PF03999 3 - (0)? - / - / - 0
131gbs013720 63% 0.640 PF00005 C1_S111 - (0)2 - / - / 1 1
132gbs01385 37% 0.386 PF01458 2 - (0)? - / - / - 0
133gbs013920 52% 0.558 PF00266 C1_S161 - (46)8 - / - / 13 2
134gbs014016 78% 0.515 PF01592 5 - (0)? - / - / - 0
135gbs01416 29% 0.395 PF01458 0 - (0)? - / - / - 0
136gbs014220 38% 0.531 PF00768 30 - (0)? - / - / - 0
137gbs014320 47% 0.483 PF00768 23 - (0)? - / - / - 0
138gbs014420 30% 0.507 PF00496 31 - (0)? - / - / - 0
139gbs01454 37% 0.354 PF00528 2 - (0)? - / - / - 0
140gbs01464 41% 0.380 PF00528 1 - (0)? - / - / - 0
141gbs014734 38% 0.461 PF00005 C1_S147 - (0)5 - / 1 / 16 3
142gbs014825 36% 0.555 PF00005 C1_S147 - (0)5 - / 2 / 3 4
143gbs014920 32% 0.500 PF00288 C1_S152 - (39)3 - / 2 / 1 2
144gbs015015 53% 0.585 PF01047 20 - (0)? - / - / - 0
145gbs015119 31% 0.598 PF00005 11 - (0)? - / - / - 0
146gbs01522 34% 0.327 PF01032 2 - (0)? - / - / - 0
147gbs01537 58% 0.509 PF01650 12 - (0)? - / - / - 0
148gbs015430 60% 0.574 PF00579 C3_S151 - (40)7 - / 9 / 7 4
149gbs015520 59% 0.570 PF00905 C1_S123 - (0)2 - / - / 2 2
150gbs015632 63% 0.390 PF04560 C7_S172 - (0)2 - / - / 21 0

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