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]
400bsu1298024 100% 0.791 PF02746 C1_S111 - (0)4 - / - / 1 1
401bsu1165024 100% 0.462 PF03070 C4_S136 - (16)9 - / - / 15 3
402bsu2425024 100% 0.541 PF02863 C8_S1103 - (0)2 - / - / 5 1
403bsu3488024 44% 0.693 PF00977 C1_S129 - (0)9 2 / 5 / 4 5
404bsu1733024 58% 0.571 PF01715 C2_S135 - (15)8 - / - / 9 4
405bsu3217024 67% 0.581 PF01678 C4_S17 - (3)4 - / - / 4 3
406bsu3934024 99% 0.650 PF09021 C6_S128 - (0)4 3 / - / 16 1
407bsu3052024 77% 0.575 PF00132 65 - (34)3 - / - / - 0
408bsu1856024 35% 0.572 PF02826 C3_S150 - (39)6 - / 1 / 3 1
409bsu1400024 47% 0.629 PF00155 C1_S139 - (26)8 - / 1 / 12 2
410bsu2350024 77% 0.669 PF01676 C4_S112 - (0)6 - / - / 8 3
411bsu3086024 40% 0.542 PF03721 C3_S124 - (14)4 - / 3 / 3 3
412bsu3591024 35% 0.498 PF00356 C2_S132 - (0)2 - / 2 / 16 0
413bsu1027024 35% 0.551 PF13193 C1_S126 - (0)4 - / 1 / 4 2
414bsu0092024 43% 0.577 PF00749 C5_S117 - (14)5 - / 5 / 3 3
415bsu0213024 56% 0.586 PF03009 C3_S119 - (9)3 - / - / 1 1
416bsu2837024 100% 0.549 PF03725 C1_S18 - (0)3 - / 1 / 3 3
417bsu0594024 45% 0.592 PF00814 C2_S132 - (25)10 - / 14 / 4 5
418bsu3705024 41% 0.661 PF03949 C2_S112 - (7)5 4 / 1 / 3 2
419bsu0944024 100% 0.544 PF00285 C6_S113 - (9)3 - / 1 / 6 1
420bsu3200024 36% 0.504 PF00106 C1_S1121 - (76)4 1 / 1 / 2 1
421bsu2262024 52% 0.606 PF00155 C1_S127 - (21)8 - / 1 / 8 3
422bsu0947024 44% 0.475 PF02028 C10_S169 - (0)6 - / - / 7 1
423bsu3105023 39% 0.558 PF00465 C4_S139 - (35)4 2 / 3 / - 3
424bsu1554023 68% 0.542 PF01180 C1_S168 - (39)8 - / 3 / 8 3
425bsu0735023 48% 0.553 PF00171 C3_S127 - (0)6 1 / - / 3 3
426bsu3760023 49% 0.487 PF07647 C3_S114 - (0)7 - / 1 / 4 3
427bsu3022023 38% 0.485 PF00155 C1_S133 - (21)9 - / - / 10 5
428bsu1317023 100% 0.464 PF00383 C7_S144 - (8)4 - / - / 6 1
429bsu1318023 52% 0.467 PF01717 C4_S113 - (5)8 - / 1 / 5 2
430bsu2945023 54% 0.495 PF00764 C4_S119 - (17)8 - / - / 4 2
431bsu0972023 47% 0.473 PF00005 C1_S126 - (0)9 - / 8 / 4 4
432bsu0902023 39% 0.399 PF03358 C2_S147 - (28)5 - / - / 2 0
433bsu0784023 99% 0.592 PF00149 C1_S118 - (0)5 - / - / 3 1
434bsu3530023 100% 0.544 PF07516 C2_S113 - (0)2 - / 2 / 3 1
435bsu3247023 47% 0.643 PF01799 C5_S134 - (20)7 - / - / 7 0
436bsu0051023 100% 0.595 PF13793 C7_S115 - (12)5 - / - / 8 3
437bsu1640023 100% 0.691 PF00448 C9_S148 - (0)7 - / 3 / 7 3
438bsu2484023 48% 0.535 PF00884 C3_S110 - (1)3 - / - / 3 1
439bsu3336023 47% 0.506 PF00884 C1_S110 - (1)3 - / - / 3 1
440bsu2755023 53% 0.562 PF01336 C5_S140 - (25)6 - / 5 / 7 3
441bsu3490023 52% 0.615 PF00155 C1_S120 - (15)8 - / 1 / 9 3
442bsu2348023 40% 0.494 PF00768 C4_S129 - (0)5 - / - / 7 3
443bsu2910023 40% 0.390 PF00512 C2_S115 - (0)4 2 / 3 / 3 3
444bsu3354023 56% 0.578 PF02525 C1_S1168 - (89)7 - / 10 / 2 2
445bsu2266023 48% 0.470 PF00218 C1_S113 - (5)10 - / 5 / 4 5
446bsu1012023 99% 0.585 PF01208 C2_S114 - (9)6 6 / 2 / - 2
447bsu1295023 37% 0.503 PF00005 C1_S120 - (0)3 - / 1 / 4 2
448bsu3967023 56% 0.630 PF01116 C3_S117 - (11)5 - / - / 12 3
449bsu1025023 47% 0.584 PF03099 C2_S127 - (17)12 3 / 2 / 13 3
450bsu0652023 44% 0.495 PF02142 C12_S117 - (10)10 2 / 7 / 3 3

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