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]
350gbs06099 55% 0.558 PF01223 10 - (0)2 - / - / - 0
351gbs09027 58% 0.703 PF00633 C5_S113 - (0)2 - / 2 / 1 1
352gbs074717 35% 0.554 PF08282 17 - (2)2 - / - / - 0
353gbs046818 98% 0.708 PF00440 C1_S118 - (0)2 - / - / 6 1
354gbs210314 85% 0.569 PF03054 C1_S122 - (16)2 - / 1 / 2 1
355gbs194520 30% 0.449 PF03372 16 - (1)2 - / - / - 0
356gbs170518 98% 0.642 PF01966 C6_S15 - (0)2 - / 2 / 2 2
357gbs210117 50% 0.442 PF13932 C1_S124 - (19)2 2 / - / - 1
358gbs078520 50% 0.446 PF00905 C1_S114 - (0)2 - / - / 2 1
359gbs084321 36% 0.663 PF00271 C7_S128 - (0)2 - / 2 / 1 1
360gbs110715 32% 0.624 PF01300 C6_S18 - (0)2 - / 1 / 1 2
361gbs027319 37% 0.518 PF00696 C2_S135 - (24)2 - / 1 / - 0
362gbs085717 36% 0.540 PF03070 C5_S127 - (7)2 - / - / 2 1
363gbs126219 54% 0.595 PF13407 C1_S114 - (0)2 - / - / 4 2
364gbs055131 77% 0.490 PF00216 C6_S158 - (0)2 3 / 4 / 10 0
365gbs151820 42% 0.480 PF07516 C4_S111 - (0)2 - / 1 / 2 1
366gbs090920 100% 0.757 PF13344 C1_S115 - (3)2 - / - / 2 0
367gbs086420 88% 0.473 PF00557 C3_S152 - (1)2 - / - / 3 1
368gbs056525 39% 0.528 PF08402 C1_S115 - (0)2 - / - / 5 1
369gbs030420 46% 0.626 PF00551 62 - (8)2 - / - / - 0
370gbs091415 100% 0.579 PF09711 9 - (1)2 - / - / - 0
371gbs051519 50% 0.604 PF14815 C2_S149 - (0)2 - / 3 / 1 0
372gbs109817 40% 0.453 PF02441 C2_S122 - (17)2 - / 3 / 6 1
373gbs154310 54% 0.547 PF00881 64 - (41)2 - / - / - 0
374gbs059714 44% 0.619 PF00072 C4_S111 - (0)2 - / - / 1 0
375gbs11963 50% 0.745 PF00717 41 - (0)2 - / - / - 0
376gbs063022 99% 0.440 PF02038 C4_S111 - (0)2 - / - / 3 0
377gbs172321 42% 0.567 PF00710 C5_S117 - (16)2 - / - / 5 1
378gbs043619 73% 0.562 PF00383 C4_S127 - (8)2 - / 1 / 4 0
379gbs05119 33% 0.487 PF04055 C2_S147 - (13)2 - / 4 / 1 1
380gbs015632 63% 0.390 PF04560 C7_S172 - (0)2 - / - / 21 0
381gbs041710 54% 0.411 PF11987 C3_S19 - (0)2 - / 2 / 2 2
382gbs050516 36% 0.574 PF04055 C4_S123 - (4)2 - / 5 / 2 0
383gbs079220 48% 0.562 PF03144 C2_S126 - (0)2 - / 4 / - 1
384gbs052720 34% 0.541 PF01168 C2_S125 - (15)2 - / - / 3 0
385gbs025220 34% 0.590 PF08402 C1_S13 - (0)2 - / 1 / 1 2
386gbs177219 45% 0.488 PF02901 3 - (3)2 - / - / - 0
387gbs011321 47% 0.594 PF13407 C2_S138 - (0)2 - / - / 11 1
388gbs180711 62% 0.583 PF13411 C4_S119 - (0)2 - / - / 1 0
389gbs095513 51% 0.545 PF13932 C1_S152 - (32)2 4 / - / - 1
390gbs205426 38% 0.491 PF00488 C3_S169 - (0)2 - / 12 / 12 0
391gbs088715 62% 0.453 PF00583 C2_S144 - (24)2 1 / - / 2 1
392gbs203317 40% 0.560 PF13407 C2_S113 - (0)2 - / - / 4 2
393gbs144720 79% 0.477 PF01264 C7_S12 - (0)2 - / 1 / 1 2
394gbs210920 54% 0.612 PF00005 C1_S150 - (0)2 - / - / 1 1
395gbs167214 48% 0.517 PF00486 C4_S12 - (0)2 - / - / 1 0
396gbs067520 64% 0.583 PF03786 14 - (3)2 - / - / - 0
397gbs193010 60% 0.602 PF00258 C3_S138 - (35)2 3 / - / - 1
398gbs177322 42% 0.461 PF01243 C4_S139 - (0)2 - / 11 / - 1
399gbs013720 63% 0.640 PF00005 C1_S111 - (0)2 - / - / 1 1
400gbs030620 100% 0.537 PF00481 C1_S15 - (0)2 - / - / 1 0

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