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]
600bsu0480020 99% 0.530 PF00171 30 - (0)? - / - / - 0
601bsu3826020 44% 0.399 PF04261 C6_S127 - (0)5 5 / 4 / - 2
602bsu1821020 41% 0.473 PF01039 4 - (0)2 - / - / - 0
603bsu1287020 49% 0.543 PF00903 28 - (0)1 - / - / - 0
604bsu2931020 100% 0.582 PF00296 C2_S119 - (9)1 - / 1 / - 1
605bsu2408020 79% 0.618 PF02812 C7_S117 - (0)6 2 / 6 / 3 3
606bsu0076020 27% 0.536 PF01063 45 - (38)1 - / - / - 0
607bsu0649020 96% 0.471 PF00156 C6_S16 - (1)3 - / 1 / 5 2
608bsu3548020 100% 0.614 PF02645 C3_S134 - (0)3 - / 1 / 3 1
609bsu2882020 100% 0.551 PF02127 1 - (0)? - / - / - 0
610bsu2752020 99% 0.645 PF02082 C2_S13 - (0)? - / - / 2 0
611bsu1660020 100% 0.460 PF00575 0 - (0)? - / - / - 0
612bsu1246020 57% 0.575 PF01510 16 - (0)? - / - / - 0
613bsu2545020 48% 0.601 PF05185 C3_S136 - (0)4 - / 2 / 6 0
614bsu3045020 31% 0.595 PF00005 C1_S16 - (0)1 - / - / 1 0
615bsu0070020 76% 0.557 PF03309 C8_S118 - (10)3 - / - / 2 0
616bsu3713020 100% 0.718 PF00072 3 - (0)? - / - / - 0
617bsu1737020 100% 0.677 PF07972 C4_S125 - (24)2 10 / - / - 1
618bsu2826020 37% 0.450 PF00694 C4_S120 - (7)8 - / - / 2 2
619bsu1835020 100% 0.513 PF02113 C4_S119 - (0)2 - / - / 2 0
620bsu0131020 100% 0.598 PF00347 0 - (0)? - / - / - 0
621bsu0149020 100% 0.413 PF00572 0 - (0)? - / - / - 0
622bsu0653020 100% 0.598 PF02844 C1_S127 - (17)2 - / 3 / 3 2
623bsu1097020 99% 0.499 PF02746 C1_S17 - (0)3 - / - / 1 0
624bsu2863020 50% 0.580 PF01588 0 - (0)? - / - / - 0
625bsu3444020 32% 0.397 PF00144 C2_S127 - (0)3 - / - / 2 0
626bsu0327020 49% 0.568 PF07992 C1_S163 - (49)2 7 / - / - 1
627bsu2558020 49% 0.611 PF00383 C5_S127 - (3)3 - / 1 / 4 1
628bsu2513020 79% 0.615 PF01261 C2_S133 - (0)3 - / - / 5 0
629bsu0127020 100% 0.554 PF00467 0 - (0)? - / - / - 0
630bsu1699020 50% 0.527 PF00107 C1_S122 - (10)? 1 / - / - 0
631bsu3664020 64% 0.547 PF01979 C3_S113 - (2)1 - / - / 1 0
632bsu0880020 33% 0.466 PF01565 56 - (38)? - / - / - 0
633bsu0363020 60% 0.589 PF02441 C2_S117 - (14)1 - / 2 / - 1
634bsu3030020 28% 0.460 PF00056 23 - (13)? - / - / - 0
635bsu3779020 100% 0.589 PF02812 0 - (0)? - / - / - 0
636bsu0948020 39% 0.604 PF00155 10 - (1)? - / - / - 0
637bsu3197020 57% 0.522 PF00857 C5_S124 - (0)6 - / 6 / - 3
638bsu2163020 100% 0.557 PF02522 C2_S114 - (0)3 3 / 9 / 1 1
639bsu1953020 51% 0.602 PF01187 16 - (0)2 - / - / - 0
640bsu1670020 35% 0.585 PF01522 13 - (0)2 - / - / - 0
641bsu1759020 33% 0.539 PF00480 17 - (6)? - / - / - 0
642bsu0537020 32% 0.597 PF00155 C1_S142 - (23)5 - / 1 / 8 3
643bsu0921020 37% 0.472 PF01479 C6_S110 - (0)1 - / - / 3 0
644bsu2208020 100% 0.595 PF02074 3 - (0)? - / - / - 0
645bsu0235020 56% 0.698 PF00358 0 - (0)? - / - / - 0
646bsu1339020 38% 0.443 PF00535 C2_S137 - (17)2 - / - / 7 1
647bsu3349020 43% 0.475 PF00403 1 - (0)1 - / - / - 0
648bsu0356020 29% 0.573 PF00155 C2_S135 - (20)5 - / 2 / - 2
649bsu0223020 56% 0.531 PF02222 C1_S154 - (39)11 - / 7 / 13 5
650bsu4062020 34% 0.594 PF00005 C1_S14 - (0)1 - / - / 1 1

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