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]
250bsu0050049 51% 0.534 PF12804 C1_S158 - (37)16 - / 22 / 18 9
251bsu2743039 62% 0.613 PF08402 C1_S142 - (0)12 - / 21 / 7 5
252bsu1549056 100% 0.625 PF02729 C8_S157 - (43)20 - / 20 / 13 8
253bsu0821052 54% 0.468 PF00005 C1_S177 - (0)8 - / 19 / 21 5
254bsu0645031 68% 0.470 PF01259 C3_S160 - (45)11 - / 19 / 11 6
255bsu0090037 38% 0.512 PF01128 C1_S142 - (32)9 - / 19 / 5 3
256bsu0009050 80% 0.573 PF00478 C2_S172 - (50)19 - / 18 / 26 7
257bsu3255046 52% 0.530 PF08402 C1_S142 - (0)12 - / 18 / 7 5
258bsu0869038 61% 0.408 PF00005 C2_S132 - (0)9 - / 18 / 4 6
259bsu3778051 70% 0.554 PF00171 C4_S153 - (0)18 - / 17 / 15 6
260bsu3291034 50% 0.747 PF00106 C1_S194 - (75)10 - / 17 / 14 4
261bsu1694036 69% 0.607 PF00154 C1_S142 - (0)11 - / 17 / 8 5
262bsu0145061 53% 0.529 PF08402 C1_S146 - (0)13 - / 16 / 26 7
263bsu3652049 100% 0.536 PF00543 C4_S173 - (0)7 - / 16 / 20 3
264bsu0359038 59% 0.553 PF08402 C1_S131 - (0)10 - / 16 / 14 5
265bsu0321049 90% 0.555 PF00171 C4_S153 - (0)17 - / 16 / 13 6
266bsu2396034 64% 0.544 PF08402 C1_S129 - (0)12 - / 16 / 9 5
267bsu0013032 59% 0.413 PF00587 C3_S142 - (36)10 - / 16 / 9 6
268bsu3784066 54% 0.528 PF00483 C1_S180 - (72)20 - / 15 / 39 8
269bsu2934033 54% 0.650 PF08402 C1_S126 - (0)12 - / 15 / 7 5
270bsu3948036 54% 0.638 PF08402 C1_S120 - (0)7 - / 15 / 1 4
271bsu1818043 50% 0.478 PF00483 C1_S178 - (70)15 - / 14 / 22 5
272bsu0313033 100% 0.789 PF02540 C5_S166 - (59)12 - / 14 / 16 5
273bsu1704028 40% 0.509 PF00488 C4_S160 - (0)2 - / 14 / 9 0
274bsu3526041 40% 0.554 PF08402 C1_S123 - (0)10 - / 14 / 7 5
275bsu0069036 72% 0.619 PF09336 C2_S121 - (21)5 - / 14 / 5 4
276bsu0594024 45% 0.592 PF00814 C2_S132 - (25)10 - / 14 / 4 5
277bsu2913043 100% 0.868 PF00180 C7_S156 - (52)17 - / 13 / 23 5
278bsu0351024 99% 0.552 PF00550 C1_S154 - (28)8 - / 13 / 2 5
279bsu3383036 43% 0.639 PF08402 C1_S137 - (0)9 - / 13 / 2 4
280bsu1830029 43% 0.536 PF00550 C1_S143 - (24)7 - / 13 / 1 5
281bsu1451030 63% 0.642 PF02254 C2_S147 - (0)2 - / 13 / - 3
282bsu3855063 50% 0.601 PF01063 C6_S1183 - (119)20 - / 12 / 62 0
283bsu1502061 98% 0.501 PF01467 C2_S1138 - (86)20 - / 12 / 28 9
284bsu0651047 54% 0.595 PF00551 C2_S1144 - (20)14 - / 12 / 23 5
285bsu0643031 61% 0.595 PF02222 C2_S149 - (36)9 - / 12 / 10 5
286bsu1555021 100% 0.871 PF00215 C2_S139 - (26)10 - / 12 / 2 3
287bsu3327036 51% 0.588 PF08402 C1_S118 - (0)8 - / 12 / 2 4
288bsu1370021 63% 0.572 PF10431 C1_S118 - (0)6 - / 12 / - 3
289bsu0239079 48% 0.576 PF01063 C6_S1222 - (150)20 - / 11 / 75 0
290bsu3829020 100% 0.931 PF02581 C2_S153 - (40)15 - / 11 / 12 0
291bsu0662032 69% 0.522 PF03119 C6_S134 - (20)17 - / 11 / 12 0
292bsu2405034 44% 0.544 PF00676 C4_S131 - (20)8 - / 11 / 9 6
293bsu0082035 79% 0.534 PF01336 C5_S142 - (28)14 - / 11 / 6 6
294bsu3567022 53% 0.488 PF00483 C1_S166 - (52)10 - / 11 / 5 3
295bsu3866030 35% 0.477 PF00005 C1_S132 - (0)10 - / 11 / 5 5
296bsu3109031 100% 0.548 PF02254 C3_S150 - (0)3 - / 11 / 2 3
297bsu3689046 84% 0.544 PF14681 C6_S149 - (38)12 - / 10 / 21 5
298bsu2967031 81% 0.550 PF00579 C4_S132 - (20)8 - / 10 / 8 0
299bsu0088018 44% 0.644 PF00633 C5_S122 - (0)6 - / 10 / 7 3
300bsu2773019 59% 0.578 PF05496 C2_S119 - (0)7 - / 10 / 5 3

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