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]
450bsu2348023 40% 0.494 PF00768 C4_S129 - (0)5 - / - / 7 3
451bsu2755023 53% 0.562 PF01336 C5_S140 - (25)6 - / 5 / 7 3
452bsu3336023 47% 0.506 PF00884 C1_S110 - (1)3 - / - / 3 1
453bsu0902023 39% 0.399 PF03358 C2_S147 - (28)5 - / - / 2 0
454bsu1025023 47% 0.584 PF03099 C2_S127 - (17)12 3 / 2 / 13 3
455bsu1439023 52% 0.498 PF00294 C1_S143 - (32)9 - / 1 / 8 4
456bsu2847023 51% 0.544 PF13840 C1_S120 - (0)5 - / - / 5 1
457bsu3105023 39% 0.558 PF00465 C4_S139 - (35)4 2 / 3 / - 3
458bsu2945023 54% 0.495 PF00764 C4_S119 - (17)8 - / - / 4 2
459bsu2236023 46% 0.520 PF01336 C7_S122 - (16)10 - / 9 / 1 5
460bsu3760023 49% 0.487 PF07647 C3_S114 - (0)7 - / 1 / 4 3
461bsu1355022 100% 0.573 PF01008 C6_S16 - (4)2 - / - / 2 1
462bsu2968022 35% 0.542 PF13193 C3_S147 - (9)8 - / 2 / 3 4
463bsu3280022 47% 0.592 PF01597 17 - (0)5 - / - / - 0
464bsu3723022 51% 0.414 PF00005 C2_S15 - (0)2 - / 2 / 2 1
465bsu0434022 38% 0.475 PF02776 C7_S191 - (67)7 - / 2 / 3 3
466bsu0328022 43% 0.620 PF00590 C2_S133 - (30)3 - / 9 / 1 1
467bsu3978022 99% 0.585 PF00248 C7_S154 - (36)4 2 / 2 / 1 1
468bsu3601022 99% 0.610 PF02776 C5_S157 - (28)6 - / 1 / 3 2
469bsu3850022 100% 0.559 PF13193 C2_S126 - (16)7 - / 8 / 2 4
470bsu0447022 50% 0.407 PF10766 C4_S123 - (0)2 - / - / 2 1
471bsu0967022 44% 0.560 PF01063 C8_S151 - (39)12 - / 8 / 14 5
472bsu2836022 52% 0.534 PF01725 C2_S120 - (12)6 - / 10 / 2 2
473bsu3854022 35% 0.477 PF00106 C1_S141 - (28)5 1 / 2 / - 2
474bsu2643022 50% 0.530 PF00486 C2_S141 - (0)4 - / - / 3 2
475bsu1358022 42% 0.630 PF00155 C1_S126 - (18)4 - / - / 6 2
476bsu1303022 58% 0.527 PF03061 C2_S131 - (26)3 - / - / 12 2
477bsu3596022 59% 0.613 PF13407 C1_S149 - (0)4 - / 2 / 13 2
478bsu1198022 34% 0.573 PF00106 C1_S151 - (30)2 - / - / 2 0
479bsu1815022 91% 0.529 PF02055 C2_S135 - (2)9 - / 1 / 3 1
480bsu0102022 93% 0.589 PF03946 C2_S16 - (0)2 - / - / 2 1
481bsu2328022 100% 0.587 PF00383 C3_S149 - (0)3 2 / - / 1 1
482bsu3984022 41% 0.585 PF00106 C2_S176 - (50)3 4 / - / 1 1
483bsu1161022 59% 0.539 PF01513 C2_S141 - (32)20 - / 8 / 15 13
484bsu2232022 46% 0.490 PF00905 C2_S12 - (0)1 - / - / 2 1
485bsu2831022 47% 0.594 PF02776 C5_S182 - (38)15 12 / 4 / 10 4
486bsu3359022 77% 0.544 PF00106 C1_S192 - (56)3 - / - / 1 0
487bsu0210022 100% 0.807 PF00067 C4_S196 - (1)2 11 / - / - 1
488bsu2417022 49% 0.512 PF00108 C5_S111 - (3)6 - / 2 / 1 1
489bsu4011022 65% 0.601 PF00232 C2_S188 - (72)11 - / 4 / 7 5
490bsu2756022 61% 0.525 PF03129 C1_S19 - (0)2 - / 3 / 2 1
491bsu2736022 51% 0.631 PF01596 C1_S137 - (29)3 - / 4 / 4 1
492bsu0330022 33% 0.571 PF07992 C3_S181 - (55)4 - / - / 3 0
493bsu3676022 80% 0.625 PF00275 C7_S116 - (9)6 - / 4 / 5 3
494bsu3304022 64% 0.520 PF00206 C4_S116 - (10)7 - / - / 7 2
495bsu0038022 67% 0.612 PF01588 C2_S121 - (0)3 3 / 1 / 1 3
496bsu0962022 45% 0.515 PF03009 C4_S125 - (19)5 - / - / 2 1
497bsu2004022 87% 0.548 PF00268 C4_S12 - (0)2 - / - / 1 1
498bsu2269022 99% 0.531 PF07736 C9_S16 - (0)2 - / - / 1 0
499bsu2666022 53% 0.605 PF01187 16 - (1)2 - / - / - 0
500bsu1902022 51% 0.548 PF01593 C4_S179 - (78)3 3 / 3 / - 1

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