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]
300bsu3593029 100% 0.571 PF05025 C3_S128 - (0)6 - / - / 12 1
301bsu2241029 63% 0.677 PF02261 C3_S148 - (8)2 - / 2 / 6 2
302bsu3439029 97% 0.845 PF00135 C1_S1100 - (24)15 - / - / 11 0
303bsu2421029 47% 0.595 PF00724 C1_S1123 - (61)7 - / - / 10 2
304bsu1436028 52% 0.561 PF00005 C1_S116 - (0)6 - / 6 / 1 2
305bsu3298028 35% 0.494 PF00106 C1_S1123 - (96)4 7 / - / 2 1
306bsu0831028 47% 0.595 PF08402 C1_S140 - (0)5 - / 9 / 2 2
307bsu2761028 55% 0.584 PF00156 C3_S149 - (38)8 - / 6 / 13 3
308bsu2260028 68% 0.574 PF00275 C7_S119 - (13)7 2 / 2 / 6 4
309bsu0243028 100% 0.611 PF04960 C6_S121 - (15)8 - / - / 8 3
310bsu1704028 40% 0.509 PF00488 C4_S160 - (0)2 - / 14 / 9 0
311bsu2788028 34% 0.520 PF00266 C1_S146 - (35)8 - / - / 24 2
312bsu1467028 50% 0.529 PF00459 C6_S137 - (29)13 - / - / 10 3
313bsu2741028 50% 0.437 PF07973 C1_S127 - (21)14 3 / 6 / 8 6
314bsu1633028 72% 0.632 PF00072 C1_S136 - (0)3 - / - / 6 0
315bsu3140028 48% 0.665 PF00155 C1_S141 - (29)7 - / 1 / 18 3
316bsu4085027 70% 0.635 PF00132 C1_S169 - (35)4 - / - / 12 1
317bsu3926027 60% 0.545 PF00232 C1_S191 - (74)12 - / - / 10 6
318bsu3796027 45% 0.609 PF00171 C4_S128 - (12)9 - / 6 / 4 3
319bsu1396027 42% 0.570 PF03446 C1_S128 - (15)5 4 / 1 / 2 3
320bsu1651027 61% 0.630 PF00696 C1_S127 - (17)7 - / 3 / 5 3
321bsu0393027 83% 0.582 PF00106 C1_S1101 - (67)7 22 / - / 4 2
322bsu0882027 67% 0.439 PF06628 C5_S119 - (4)4 11 / - / 2 1
323bsu3487027 65% 0.612 PF00977 C1_S134 - (7)6 - / - / 2 2
324bsu3907027 99% 0.547 PF00722 C2_S148 - (20)8 - / 4 / 3 1
325bsu2177027 43% 0.376 PF00291 C1_S129 - (26)5 - / 2 / 13 2
326bsu2414027 40% 0.580 PF00285 C10_S117 - (13)6 - / 6 / 5 2
327bsu2751027 44% 0.525 PF00266 C2_S145 - (31)7 - / - / 22 2
328bsu3802027 100% 0.547 PF08543 C2_S163 - (48)9 - / 3 / 12 2
329bsu4008027 58% 0.576 PF03446 C3_S127 - (14)10 - / 1 / 11 6
330bsu2361027 55% 0.448 PF00293 C2_S1107 - (44)14 - / - / 18 4
331bsu0209027 100% 0.517 PF00905 C3_S162 - (0)7 - / - / 7 3
332bsu2919027 100% 0.813 PF00365 C3_S117 - (4)6 - / - / 11 3
333bsu2412027 74% 0.598 PF02548 C4_S132 - (20)9 - / - / 10 3
334bsu3863027 69% 0.471 PF06628 C8_S112 - (1)2 7 / - / - 1
335bsu1714027 34% 0.464 PF02801 C3_S153 - (1)7 - / - / 7 0
336bsu1590027 49% 0.595 PF00698 C1_S119 - (14)9 - / - / 7 0
337bsu3455027 100% 0.673 PF13419 C1_S122 - (11)13 - / 5 / 12 8
338bsu0019027 53% 0.561 PF12170 C1_S141 - (0)2 - / - / 7 0
339bsu2380026 35% 0.541 PF14748 C4_S123 - (16)3 - / - / 6 1
340bsu0908026 37% 0.546 PF09383 C1_S118 - (0)5 - / 5 / 4 3
341bsu1483026 61% 0.588 PF04960 C6_S132 - (15)8 - / - / 12 2
342bsu4000026 36% 0.600 PF00106 C2_S199 - (71)7 4 / - / 8 3
343bsu0110026 75% 0.569 PF00164 C4_S114 - (0)0 - / - / 2 0
344bsu0863026 57% 0.502 PF14815 C3_S153 - (0)9 12 / 1 / 6 2
345bsu3468026 48% 0.588 PF02826 C1_S161 - (37)9 6 / 3 / 5 3
346bsu2914026 49% 0.598 PF00285 C7_S117 - (13)7 - / 6 / 7 3
347bsu0298026 43% 0.660 PF08402 C2_S18 - (0)4 - / 1 / 5 1
348bsu1666026 41% 0.499 PF01509 C6_S137 - (0)4 11 / 1 / 7 0
349bsu3454026 100% 0.636 PF00574 C7_S132 - (0)4 - / - / 10 1
350bsu2319026 100% 0.540 PF00768 C5_S135 - (0)10 - / - / 9 2

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