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]
250bsu0727015 43% 0.589 PF12804 C1_S157 - (37)2 - / 4 / - 2
251bsu2263066 43% 0.589 PF00290 C3_S157 - (27)20 - / 4 / 41 16
252bsu1055020 100% 0.608 PF01041 C1_S157 - (0)5 - / 3 / 5 2
253bsu3435017 36% 0.501 PF02719 C1_S157 - (55)8 12 / 2 / 2 4
254bsu1963058 99% 0.595 PF01048 C3_S157 - (38)20 - / - / 50 17
255bsu1549056 100% 0.625 PF02729 C8_S157 - (43)20 - / 20 / 13 8
256bsu0783020 44% 0.568 PF00881 57 - (37)2 - / - / - 0
257bsu3911066 100% 0.551 PF00271 C1_S157 - (0)13 3 / 17 / 29 7
258bsu2913043 100% 0.868 PF00180 C7_S156 - (52)17 - / 13 / 23 5
259bsu1050020 43% 0.540 PF01494 C1_S156 - (35)4 12 / 2 / 1 0
260bsu1523019 79% 0.621 PF02873 C3_S156 - (39)3 9 / - / 1 1
261bsu0570013 40% 0.542 PF00392 56 - (0)3 - / - / - 0
262bsu208300 41% 0.384 PF00701 56 - (0)? - / - / - 0
263bsu1577029 50% 0.489 PF00069 C1_S156 - (15)12 1 / 4 / 10 8
264bsu0880020 33% 0.466 PF01565 56 - (38)? - / - / - 0
265bsu1529053 100% 0.623 PF00091 C3_S156 - (0)10 1 / 30 / 13 5
266bsu3085021 51% 0.501 PF00483 C1_S156 - (45)5 - / 9 / 2 3
267bsu2850048 100% 0.699 PF00085 C1_S155 - (0)5 - / - / 8 0
268bsu2827051 77% 0.622 PF00180 C5_S155 - (46)15 - / 6 / 31 4
269bsu1122051 45% 0.565 PF00202 C1_S155 - (34)10 - / 4 / 21 3
270bsu4093019 30% 0.494 PF01568 55 - (0)? - / - / - 0
271bsu4076016 98% 0.582 PF01872 55 - (16)1 - / - / - 0
272bsu263505 39% 0.769 PF00717 55 - (0)? - / - / - 0
273bsu0223020 56% 0.531 PF02222 C1_S154 - (39)11 - / 7 / 13 5
274bsu2270039 40% 0.518 PF01202 C3_S154 - (49)6 7 / 14 / 10 2
275bsu0912020 43% 0.299 PF00072 C5_S154 - (0)2 - / - / 2 1
276bsu336409 37% 0.378 PF12697 54 - (19)? - / - / - 0
277bsu0351024 99% 0.552 PF00550 C1_S154 - (28)8 - / 13 / 2 5
278bsu0248031 95% 0.580 PF00150 C1_S154 - (39)20 - / 3 / 14 7
279bsu3978022 99% 0.585 PF00248 C7_S154 - (36)4 2 / 2 / 1 1
280bsu0999016 100% 0.373 PF01047 53 - (0)? - / - / - 0
281bsu136809 42% 0.543 PF00691 53 - (0)1 - / - / - 0
282bsu2681048 36% 0.578 PF01177 C5_S153 - (37)8 - / 1 / 33 3
283bsu1134045 100% 0.544 PF02801 C3_S153 - (5)20 - / 5 / 18 9
284bsu3829020 100% 0.931 PF02581 C2_S153 - (40)15 - / 11 / 12 0
285bsu3615018 100% 0.594 PF03358 53 - (36)? - / - / - 0
286bsu0617020 37% 0.494 PF00294 C1_S153 - (35)4 - / - / 3 2
287bsu3210020 62% 0.568 PF07992 53 - (34)? - / - / - 0
288bsu1613065 43% 0.616 PF00290 C1_S153 - (24)20 - / 4 / 41 16
289bsu1714027 34% 0.464 PF02801 C3_S153 - (1)7 - / - / 7 0
290bsu3778051 70% 0.554 PF00171 C4_S153 - (0)18 - / 17 / 15 6
291bsu1137052 38% 0.448 PF00005 C1_S153 - (0)9 - / 7 / 26 6
292bsu0863026 57% 0.502 PF14815 C3_S153 - (0)9 12 / 1 / 6 2
293bsu0180020 37% 0.459 PF00730 C3_S153 - (0)2 - / - / 2 0
294bsu2799019 51% 0.565 PF01656 C2_S153 - (0)5 3 / 9 / 1 1
295bsu0321049 90% 0.555 PF00171 C4_S153 - (0)17 - / 16 / 13 6
296bsu3392056 69% 0.555 PF00121 C7_S153 - (30)20 - / - / 32 0
297bsu1495010 45% 0.532 PF00571 52 - (0)? - / - / - 0
298bsu1017040 45% 0.509 PF08541 C2_S152 - (31)18 - / 3 / 15 4
299bsu4092021 60% 0.502 PF07670 C1_S152 - (0)6 - / 2 / 4 3
300bsu0010029 38% 0.566 PF00768 C4_S152 - (0)8 - / - / 3 1

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