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]
350bsu3095019 38% 0.452 PF00534 C2_S143 - (16)6 - / 7 / 5 1
351bsu2521020 65% 0.591 PF01807 C3_S115 - (0)10 - / 7 / 5 6
352bsu1919019 100% 0.513 PF07730 C2_S116 - (14)5 - / 7 / 3 3
353bsu0433025 46% 0.490 PF00550 C1_S124 - (12)7 - / 7 / 3 3
354bsu3038030 39% 0.488 PF00005 C1_S116 - (0)8 - / 7 / 3 3
355bsu2311021 42% 0.414 PF00512 C3_S118 - (15)5 - / 7 / 2 3
356bsu1385031 41% 0.509 PF00403 C1_S114 - (0)10 - / 7 / 2 3
357bsu1605013 100% 0.589 PF01926 C11_S114 - (0)5 - / 7 / 1 4
358bsu2803017 57% 0.581 PF00012 C1_S117 - (0)4 - / 7 / 1 2
359bsu0001018 39% 0.526 PF08299 C2_S116 - (0)2 - / 7 / - 1
360bsu2827051 77% 0.622 PF00180 C5_S155 - (46)15 - / 6 / 31 4
361bsu3061053 39% 0.566 PF08402 C1_S142 - (0)10 - / 6 / 27 5
362bsu0390053 47% 0.585 PF00202 C1_S161 - (32)10 - / 6 / 20 3
363bsu2761028 55% 0.584 PF00156 C3_S149 - (38)8 - / 6 / 13 3
364bsu0046031 37% 0.507 PF00288 C1_S166 - (46)17 - / 6 / 13 6
365bsu1133037 58% 0.542 PF08541 C2_S151 - (31)17 - / 6 / 13 3
366bsu3599045 44% 0.673 PF02525 C1_S1153 - (70)20 - / 6 / 8 1
367bsu2914026 49% 0.598 PF00285 C7_S117 - (13)7 - / 6 / 7 3
368bsu2414027 40% 0.580 PF00285 C10_S117 - (13)6 - / 6 / 5 2
369bsu2567015 69% 0.652 PF01926 C2_S139 - (0)5 - / 6 / 5 3
370bsu3796027 45% 0.609 PF00171 C4_S128 - (12)9 - / 6 / 4 3
371bsu2821013 79% 0.548 PF01648 C4_S122 - (19)3 - / 6 / 2 1
372bsu0154015 41% 0.488 PF01656 C2_S135 - (0)5 - / 6 / 1 2
373bsu1436028 52% 0.561 PF00005 C1_S116 - (0)6 - / 6 / 1 2
374bsu1092021 42% 0.581 PF14306 C4_S119 - (17)4 - / 6 / - 2
375bsu0386015 100% 0.596 PF00881 C4_S162 - (40)2 - / 6 / - 1
376bsu2819018 100% 0.615 PF01926 C2_S138 - (0)3 - / 6 / - 2
377bsu1559021 41% 0.527 PF14306 C4_S120 - (18)4 - / 6 / - 2
378bsu338909 99% 0.535 PF00583 C2_S146 - (22)2 - / 6 / - 1
379bsu3772019 91% 0.559 PF02142 C2_S136 - (24)2 - / 6 / - 1
380bsu3197020 57% 0.522 PF00857 C5_S124 - (0)6 - / 6 / - 3
381bsu2997067 58% 0.555 PF00291 C3_S168 - (46)15 - / 5 / 48 6
382bsu1300050 36% 0.497 PF00005 C1_S144 - (0)9 - / 5 / 22 5
383bsu1134045 100% 0.544 PF02801 C3_S153 - (5)20 - / 5 / 18 9
384bsu3470043 43% 0.532 PF00005 C1_S127 - (0)11 - / 5 / 17 6
385bsu1121040 44% 0.561 PF00696 C1_S179 - (66)13 - / 5 / 17 4
386bsu2496034 38% 0.527 PF00005 C1_S121 - (0)10 - / 5 / 13 6
387bsu3455027 100% 0.673 PF13419 C1_S122 - (11)13 - / 5 / 12 8
388bsu2755023 53% 0.562 PF01336 C5_S140 - (25)6 - / 5 / 7 3
389bsu0879016 69% 0.480 PF01964 C3_S112 - (0)7 - / 5 / 5 2
390bsu3391019 81% 0.862 PF01676 C4_S19 - (9)4 - / 5 / 4 2
391bsu0908026 37% 0.546 PF09383 C1_S118 - (0)5 - / 5 / 4 3
392bsu2266023 48% 0.470 PF00218 C1_S113 - (5)10 - / 5 / 4 5
393bsu0092024 43% 0.577 PF00749 C5_S117 - (14)5 - / 5 / 3 3
394bsu1641020 100% 0.560 PF01656 C1_S167 - (65)4 - / 5 / 2 2
395bsu1575017 38% 0.605 PF04055 C4_S131 - (7)2 - / 5 / 2 0
396bsu0357017 99% 0.855 PF01648 C5_S119 - (17)3 - / 5 / 2 1
397bsu3154016 44% 0.589 PF02608 C2_S121 - (0)4 - / 5 / 2 3
398bsu017508 64% 0.697 PF00633 C2_S116 - (0)3 - / 5 / 1 2
399bsu199505 98% 0.665 PF00269 C3_S110 - (0)2 - / 5 / - 0
400bsu0591015 54% 0.512 PF00005 C3_S17 - (0)2 - / 5 / - 1

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