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]
300bsu2241029 63% 0.677 PF02261 C3_S148 - (8)2 - / 2 / 6 2
301bsu1577029 50% 0.489 PF00069 C1_S156 - (15)12 1 / 4 / 10 8
302bsu2421029 47% 0.595 PF00724 C1_S1123 - (61)7 - / - / 10 2
303bsu2278029 67% 0.606 PF01227 C13_S122 - (0)8 - / - / 22 3
304bsu0831028 47% 0.595 PF08402 C1_S140 - (0)5 - / 9 / 2 2
305bsu0243028 100% 0.611 PF04960 C6_S121 - (15)8 - / - / 8 3
306bsu2260028 68% 0.574 PF00275 C7_S119 - (13)7 2 / 2 / 6 4
307bsu2761028 55% 0.584 PF00156 C3_S149 - (38)8 - / 6 / 13 3
308bsu1633028 72% 0.632 PF00072 C1_S136 - (0)3 - / - / 6 0
309bsu2788028 34% 0.520 PF00266 C1_S146 - (35)8 - / - / 24 2
310bsu3298028 35% 0.494 PF00106 C1_S1123 - (96)4 7 / - / 2 1
311bsu3140028 48% 0.665 PF00155 C1_S141 - (29)7 - / 1 / 18 3
312bsu1704028 40% 0.509 PF00488 C4_S160 - (0)2 - / 14 / 9 0
313bsu1436028 52% 0.561 PF00005 C1_S116 - (0)6 - / 6 / 1 2
314bsu2741028 50% 0.437 PF07973 C1_S127 - (21)14 3 / 6 / 8 6
315bsu1467028 50% 0.529 PF00459 C6_S137 - (29)13 - / - / 10 3
316bsu1714027 34% 0.464 PF02801 C3_S153 - (1)7 - / - / 7 0
317bsu2412027 74% 0.598 PF02548 C4_S132 - (20)9 - / - / 10 3
318bsu3802027 100% 0.547 PF08543 C2_S163 - (48)9 - / 3 / 12 2
319bsu0019027 53% 0.561 PF12170 C1_S141 - (0)2 - / - / 7 0
320bsu0209027 100% 0.517 PF00905 C3_S162 - (0)7 - / - / 7 3
321bsu3487027 65% 0.612 PF00977 C1_S134 - (7)6 - / - / 2 2
322bsu3796027 45% 0.609 PF00171 C4_S128 - (12)9 - / 6 / 4 3
323bsu3863027 69% 0.471 PF06628 C8_S112 - (1)2 7 / - / - 1
324bsu2751027 44% 0.525 PF00266 C2_S145 - (31)7 - / - / 22 2
325bsu2177027 43% 0.376 PF00291 C1_S129 - (26)5 - / 2 / 13 2
326bsu1396027 42% 0.570 PF03446 C1_S128 - (15)5 4 / 1 / 2 3
327bsu4008027 58% 0.576 PF03446 C3_S127 - (14)10 - / 1 / 11 6
328bsu3926027 60% 0.545 PF00232 C1_S191 - (74)12 - / - / 10 6
329bsu3907027 99% 0.547 PF00722 C2_S148 - (20)8 - / 4 / 3 1
330bsu1651027 61% 0.630 PF00696 C1_S127 - (17)7 - / 3 / 5 3
331bsu0393027 83% 0.582 PF00106 C1_S1101 - (67)7 22 / - / 4 2
332bsu1590027 49% 0.595 PF00698 C1_S119 - (14)9 - / - / 7 0
333bsu3455027 100% 0.673 PF13419 C1_S122 - (11)13 - / 5 / 12 8
334bsu2414027 40% 0.580 PF00285 C10_S117 - (13)6 - / 6 / 5 2
335bsu2361027 55% 0.448 PF00293 C2_S1107 - (44)14 - / - / 18 4
336bsu4085027 70% 0.635 PF00132 C1_S169 - (35)4 - / - / 12 1
337bsu2919027 100% 0.813 PF00365 C3_S117 - (4)6 - / - / 11 3
338bsu0882027 67% 0.439 PF06628 C5_S119 - (4)4 11 / - / 2 1
339bsu3468026 48% 0.588 PF02826 C1_S161 - (37)9 6 / 3 / 5 3
340bsu1666026 41% 0.499 PF01509 C6_S137 - (0)4 11 / 1 / 7 0
341bsu2708026 42% 0.486 PF00158 C1_S118 - (0)6 - / - / 12 3
342bsu1406026 66% 0.572 PF00106 C1_S1123 - (81)7 2 / 6 / 6 2
343bsu2914026 49% 0.598 PF00285 C7_S117 - (13)7 - / 6 / 7 3
344bsu1483026 61% 0.588 PF04960 C6_S132 - (15)8 - / - / 12 2
345bsu0298026 43% 0.660 PF08402 C2_S18 - (0)4 - / 1 / 5 1
346bsu3454026 100% 0.636 PF00574 C7_S132 - (0)4 - / - / 10 1
347bsu0110026 75% 0.569 PF00164 C4_S114 - (0)0 - / - / 2 0
348bsu2319026 100% 0.540 PF00768 C5_S135 - (0)10 - / - / 9 2
349bsu0863026 57% 0.502 PF14815 C3_S153 - (0)9 12 / 1 / 6 2
350bsu1933026 54% 0.575 PF00081 C6_S19 - (1)3 - / - / 1 0

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