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]
300gbs116527 41% 0.529 PF00266 C1_S143 - (33)7 - / - / 19 2
301gbs162138 48% 0.522 PF00266 C1_S156 - (43)3 - / - / 37 1
302gbs045320 53% 0.506 PF00268 5 - (0)? - / - / - 0
303gbs083622 87% 0.571 PF00268 C4_S16 - (0)2 - / - / 1 1
304gbs009010 35% 0.344 PF00268 3 - (0)? - / - / - 0
305gbs03960 34% 0.439 PF00271 1 - (0)? - / - / - 0
306gbs13640 40% 0.540 PF00271 14 - (14)? - / - / - 0
307gbs166619 35% 0.427 PF00271 C3_S15 - (0)1 - / - / 1 1
308gbs000820 45% 0.436 PF00271 22 - (0)? - / - / - 0
309gbs153119 71% 0.497 PF00271 C4_S124 - (0)3 4 / 3 / 1 0
310gbs084321 36% 0.663 PF00271 C7_S128 - (0)2 - / 2 / 1 1
311gbs11284 38% 0.430 PF00271 3 - (0)? - / - / - 0
312gbs027927 52% 0.547 PF00271 C5_S142 - (0)4 1 / 4 / 4 3
313gbs079751 47% 0.615 PF00271 C6_S153 - (0)11 2 / 12 / 16 6
314gbs02180 37% 0.571 PF00273 116 - (0)? - / - / - 0
315gbs088326 62% 0.516 PF00275 C6_S119 - (11)6 1 / 2 / 6 3
316gbs086125 80% 0.538 PF00275 C6_S119 - (11)6 - / 6 / 2 3
317gbs061028 67% 0.538 PF00275 C8_S126 - (15)9 2 / 2 / 7 4
318gbs04000 34% 0.331 PF00284 0 - (0)? - / - / - 0
319gbs139523 68% 0.526 PF00288 C1_S151 - (26)9 - / 11 / 1 3
320gbs139420 52% 0.579 PF00288 C4_S133 - (24)1 - / 2 / - 1
321gbs118620 50% 0.491 PF00288 40 - (32)? - / - / - 0
322gbs014920 32% 0.500 PF00288 C1_S152 - (39)3 - / 2 / 1 2
323gbs139615 59% 0.530 PF00288 C2_S144 - (30)1 - / - / 3 1
324gbs060616 23% 0.409 PF00293 16 - (0)? - / - / - 0
325gbs196018 50% 0.354 PF00293 48 - (15)? - / - / - 0
326gbs159318 55% 0.474 PF00293 C3_S150 - (33)4 - / - / 5 2
327gbs126818 41% 0.408 PF00293 16 - (0)? - / - / - 0
328gbs126910 37% 0.514 PF00293 16 - (0)? - / - / - 0
329gbs156419 28% 0.443 PF00293 15 - (0)? - / - / - 0
330gbs053412 23% 0.392 PF00293 14 - (0)? - / - / - 0
331gbs151415 54% 0.473 PF00293 14 - (0)? - / - / - 0
332gbs067017 42% 0.505 PF00294 27 - (19)? - / - / - 0
333gbs011725 34% 0.458 PF00294 C1_S159 - (47)7 - / 4 / 20 4
334gbs133420 61% 0.474 PF00294 C1_S144 - (31)3 - / 2 / 2 3
335gbs191620 57% 0.561 PF00294 C1_S143 - (34)5 - / 5 / 2 3
336gbs141722 44% 0.515 PF00294 C2_S158 - (39)4 - / - / 8 2
337gbs189317 32% 0.538 PF00294 42 - (19)? - / - / - 0
338gbs109419 29% 0.495 PF00296 14 - (9)? - / - / - 0
339gbs075316 47% 0.534 PF00296 C5_S119 - (9)? - / - / 1 0
340gbs005816 76% 0.346 PF00297 0 - (0)? - / - / - 0
341gbs009119 36% 0.468 PF00300 C4_S112 - (9)3 - / - / 1 0
342gbs077315 36% 0.508 PF00300 C2_S134 - (31)2 - / - / 2 0
343gbs078445 54% 0.561 PF00300 C1_S149 - (41)15 - / - / 28 5
344gbs138522 34% 0.517 PF00303 C2_S132 - (17)5 - / - / 5 2
345gbs019720 60% 0.629 PF00312 0 - (0)? - / - / - 0
346gbs205323 68% 0.528 PF00313 C5_S139 - (0)4 3 / 2 / - 0
347gbs045518 56% 0.480 PF00317 C4_S18 - (8)3 - / 2 / 2 3
348gbs083718 51% 0.487 PF00317 C2_S117 - (17)3 - / - / 4 3
349gbs204116 53% 0.473 PF00317 C3_S110 - (7)3 - / - / 3 3
350gbs187320 51% 0.716 PF00318 3 - (0)? - / - / - 0

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