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]
300gbs171120 67% 0.492 PF02637 0 - (0)? - / - / - 0
301gbs162320 53% 0.540 PF00590 15 - (14)? - / - / - 0
302gbs189420 40% 0.674 PF01081 C5_S126 - (22)3 - / - / 4 1
303gbs102120 35% 0.411 PF01433 C2_S130 - (1)2 - / - / 2 1
304gbs045120 44% 0.494 PF00082 0 - (0)? - / - / - 0
305gbs159720 36% 0.511 PF02894 C1_S149 - (41)1 - / - / 1 0
306gbs168620 44% 0.584 PF08402 22 - (0)? - / - / - 0
307gbs188420 32% 0.528 PF00356 C3_S152 - (0)2 - / - / 2 0
308gbs078520 50% 0.446 PF00905 C1_S114 - (0)2 - / - / 2 1
309gbs012620 57% 0.574 PF00056 C3_S167 - (56)2 3 / 2 / - 1
310gbs192620 62% 0.656 PF01297 1 - (0)? - / - / - 0
311gbs152820 43% 0.541 PF00534 15 - (8)? - / - / - 0
312gbs110820 36% 0.547 PF05175 C1_S133 - (0)4 - / 9 / 1 0
313gbs171720 48% 0.642 PF02737 C1_S148 - (38)5 - / 2 / - 1
314gbs046120 42% 0.507 PF03079 C2_S110 - (0)1 - / - / 1 1
315gbs210920 54% 0.612 PF00005 C1_S150 - (0)2 - / - / 1 1
316gbs163920 43% 0.521 PF02737 45 - (44)? - / - / - 0
317gbs028520 71% 0.566 PF02749 C3_S130 - (11)3 - / - / 3 1
318gbs195920 48% 0.519 PF00583 50 - (23)0 - / - / - 0
319gbs150920 53% 0.498 PF00356 C2_S127 - (0)1 - / - / 1 0
320gbs172020 59% 0.615 PF00155 C1_S130 - (26)3 - / 1 / 2 2
321gbs018420 36% 0.526 PF00496 57 - (0)? - / - / - 0
322gbs173620 51% 0.560 PF00356 41 - (0)? - / - / - 0
323gbs023520 41% 0.450 PF08402 32 - (0)? - / - / - 0
324gbs004220 52% 0.604 PF02844 C1_S132 - (21)4 - / 3 / 5 3
325gbs056720 43% 0.527 PF00561 49 - (3)? - / - / - 0
326gbs118620 50% 0.491 PF00288 40 - (32)? - / - / - 0
327gbs154420 41% 0.642 PF00903 C1_S138 - (0)2 - / - / 2 0
328gbs086020 42% 0.624 PF02581 C2_S144 - (35)13 - / 7 / 10 4
329gbs125920 39% 0.554 PF07521 C1_S117 - (0)3 - / 3 / 1 2
330gbs042420 37% 0.579 PF08282 20 - (2)3 - / - / - 0
331gbs092720 30% 0.506 PF00005 8 - (0)? - / - / - 0
332gbs200420 32% 0.319 PF02219 16 - (10)? - / - / - 0
333gbs151020 29% 0.396 PF00400 C1_S145 - (0)1 - / - / 1 1
334gbs089720 40% 0.557 PF02817 28 - (28)? - / - / - 0
335gbs087120 40% 0.474 PF00128 29 - (11)? - / - / - 0
336gbs058020 53% 0.592 PF09223 0 - (0)? - / - / - 0
337gbs038720 31% 0.491 PF01751 19 - (0)? - / - / - 0
338gbs049420 100% 0.544 PF01408 31 - (9)? - / - / - 0
339gbs095720 62% 0.507 PF09084 14 - (1)? - / - / - 0
340gbs063120 100% 0.482 -0 - (0)? - / - / - 0
341gbs147520 63% 0.495 -0 - (0)? - / - / - 0
342gbs129120 50% 0.587 PF01546 C1_S118 - (1)1 - / - / 3 0
343gbs019420 37% 0.529 PF00456 33 - (19)? - / - / - 0
344gbs157820 54% 0.616 PF00687 0 - (0)? - / - / - 0
345gbs023320 54% 0.480 PF04069 C3_S129 - (1)7 - / - / 5 3
346gbs155320 43% 0.672 PF01121 C2_S127 - (19)4 - / 3 / 1 3
347gbs011520 33% 0.608 PF00005 11 - (0)? - / - / - 0
348gbs154120 38% 0.441 PF01479 C3_S120 - (0)4 - / - / 1 1
349gbs141120 41% 0.547 PF01743 C4_S120 - (16)1 - / - / 2 1
350gbs187220 45% 0.591 PF00889 3 - (0)1 - / - / - 0

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