Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000001570 (Bacillus subtilis - May 2016)

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]
450bsu1157010 41% 0.574 PF01464 C4_S140 - (0)1 - / - / 2 1
451bsu4040018 100% 0.563 PF00512 C3_S140 - (25)8 3 / 9 / 1 4
452bsu1147045 37% 0.545 PF08402 C1_S140 - (0)12 - / 7 / 21 7
453bsu0984014 23% 0.491 PF04055 40 - (9)? - / - / - 0
454bsu0831028 47% 0.595 PF08402 C1_S140 - (0)5 - / 9 / 2 2
455bsu0567013 41% 0.525 PF01047 40 - (0)1 - / - / - 0
456bsu2237030 46% 0.629 PF00155 C1_S139 - (30)7 - / 1 / 22 3
457bsu1555021 100% 0.871 PF00215 C2_S139 - (26)10 - / 12 / 2 3
458bsu1026015 50% 0.500 PF00056 C1_S139 - (34)1 2 / - / - 1
459bsu2813038 51% 0.641 PF00490 C8_S139 - (22)18 - / 1 / 27 2
460bsu0444020 41% 0.565 PF03480 C3_S139 - (0)2 - / - / 3 1
461bsu1470040 55% 0.470 PF02868 C8_S139 - (0)17 - / 1 / 7 5
462bsu0182018 51% 0.603 PF01035 C4_S139 - (0)3 - / - / 1 0
463bsu2567015 69% 0.652 PF01926 C2_S139 - (0)5 - / 6 / 5 3
464bsu0835021 74% 0.555 PF01674 C3_S139 - (0)5 - / - / 4 2
465bsu2416039 56% 0.612 PF02737 C2_S139 - (34)6 3 / 12 / 8 2
466bsu0910019 100% 0.850 PF00313 C4_S139 - (0)4 2 / 2 / - 0
467bsu1110040 55% 0.470 PF02868 C9_S139 - (0)17 - / 1 / 7 5
468bsu3970019 100% 0.605 PF02894 C1_S139 - (0)9 - / 10 / 3 3
469bsu4087021 48% 0.510 PF00356 39 - (0)? - / - / - 0
470bsu3362021 75% 0.563 PF12695 C2_S139 - (2)5 - / - / 5 0
471bsu2287021 100% 0.554 PF01070 C3_S139 - (14)2 1 / 1 / - 2
472bsu3260020 26% 0.471 -39 - (0)? - / - / - 0
473bsu0512017 91% 0.521 PF00313 C5_S139 - (0)4 2 / 2 / - 0
474bsu1518018 36% 0.496 PF08245 C1_S139 - (21)2 - / - / 2 1
475bsu3105023 39% 0.558 PF00465 C4_S139 - (35)4 2 / 3 / - 3
476bsu1400024 47% 0.629 PF00155 C1_S139 - (26)8 - / 1 / 12 2
477bsu3700019 47% 0.501 PF05175 C2_S139 - (0)6 - / 9 / 3 1
478bsu3042053 44% 0.655 PF00005 C1_S139 - (0)12 - / 9 / 27 5
479bsu168109 42% 0.538 PF07702 39 - (0)1 - / - / - 0
480bsu2362020 64% 0.589 PF00248 C3_S138 - (19)3 1 / - / - 0
481bsu2212020 46% 0.594 PF00356 C1_S138 - (0)2 - / - / 2 0
482bsu1033020 41% 0.571 PF01497 38 - (0)? - / - / - 0
483bsu2819018 100% 0.615 PF01926 C2_S138 - (0)3 - / 6 / - 2
484bsu0383018 99% 0.625 PF01497 C1_S138 - (0)3 - / 1 / 1 2
485bsu3155038 34% 0.383 PF00005 C5_S138 - (0)8 - / - / 20 5
486bsu3988011 100% 0.595 PF08007 38 - (0)? - / - / - 0
487bsu008006 38% 0.676 PF00717 38 - (0)? - / - / - 0
488bsu210206 37% 0.568 PF12844 38 - (0)? - / - / - 0
489bsu0167020 28% 0.430 PF00144 C2_S138 - (0)3 - / - / 2 0
490bsu0462019 99% 0.599 PF01648 C8_S138 - (23)2 - / 2 / 3 2
491bsu1592035 100% 0.792 PF00550 C7_S138 - (0)11 - / - / 8 2
492bsu0016020 55% 0.585 PF00704 38 - (0)1 - / - / - 0
493bsu0237020 50% 0.410 PF07702 38 - (0)1 - / - / - 0
494bsu2283020 44% 0.643 PF01210 C1_S138 - (29)5 4 / 1 / 1 3
495bsu2959025 38% 0.586 PF00266 C1_S138 - (30)7 - / - / 22 2
496bsu2744020 63% 0.605 PF00497 C1_S137 - (0)4 - / - / 4 3
497bsu1136036 37% 0.497 PF00005 C1_S137 - (0)9 - / 2 / 6 4
498bsu2902041 74% 0.627 PF00044 C1_S137 - (19)3 4 / 11 / 2 2
499bsu2829025 69% 0.479 PF07991 C4_S137 - (0)10 5 / 3 / 9 0
500bsu3925012 35% 0.602 PF00582 C1_S137 - (0)2 - / 1 / - 1

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