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]
1bsu0047018 100% 0.604 PF00156 C2_S128 - (18)3 - / - / 3 2
2bsu1156020 100% 0.640 PF01152 C5_S188 - (0)3 5 / - / 1 0
3bsu2881021 100% 0.619 PF04616 C1_S122 - (0)4 - / 1 / 2 1
4bsu214802 100% 0.407 PF00595 3 - (0)1 - / - / - 0
5bsu1739021 100% 0.574 PF00268 C7_S12 - (0)2 - / - / 1 1
6bsu1673012 100% 0.594 PF02826 41 - (35)1 - / - / - 0
7bsu261206 100% 0.483 PF11436 2 - (0)? - / - / - 0
8bsu3027017 100% 0.586 PF01547 C2_S134 - (0)2 - / - / 2 1
9bsu3299020 100% 0.557 PF00210 4 - (0)0 - / - / - 0
10bsu3012018 100% 0.835 PF07470 C2_S129 - (0)3 - / - / 2 2
11bsu003304 100% 0.459 PF07716 0 - (0)? - / - / - 0
12bsu243604 100% 0.634 PF12685 1 - (0)? - / - / - 0
13bsu3655012 100% 0.482 PF01551 2 - (0)? - / - / - 0
14bsu2706014 100% 0.576 PF03830 3 - (3)? - / - / - 0
15bsu0117020 100% 0.449 PF00573 0 - (0)? - / - / - 0
16bsu0056010 100% 0.611 PF04014 7 - (0)? - / - / - 0
17bsu263003 100% 0.300 PF01386 3 - (0)? - / - / - 0
18bsu2369015 100% 0.774 PF00583 31 - (17)? - / - / - 0
19bsu2425024 100% 0.541 PF02863 C8_S1103 - (0)2 - / - / 5 1
20bsu0049010 100% 0.638 PF00056 3 - (0)2 - / - / - 0
21bsu3390049 100% 0.592 PF03952 C1_S130 - (26)10 - / 1 / 24 7
22bsu3615018 100% 0.594 PF03358 53 - (36)? - / - / - 0
23bsu0037013 100% 0.520 PF04014 C1_S13 - (0)? - / - / 1 0
24bsu2990019 100% 0.606 PF02390 21 - (13)? - / - / - 0
25bsu2820020 100% 0.521 PF02190 0 - (0)? - / - / - 0
26bsu1884061 100% 0.890 PF00722 C8_S173 - (0)20 1 / 2 / 36 9
27bsu1324015 100% 0.618 PF01910 C4_S12 - (0)1 - / - / 1 1
28bsu1038016 100% 0.774 PF00015 C5_S119 - (0)2 6 / - / - 1
29bsu3350020 100% 0.378 PF00403 1 - (0)1 - / - / - 0
30bsu3397020 100% 0.580 PF00356 C2_S122 - (0)2 - / - / 3 1
31bsu0029020 100% 0.607 PF00543 C1_S122 - (0)2 - / 9 / - 1
32bsu3524017 100% 0.589 PF00595 C2_S125 - (0)? - / 3 / 3 0
33bsu2207012 100% 0.606 PF00156 C1_S124 - (10)3 - / 2 / 2 2
34bsu0012021 100% 0.614 PF01174 32 - (0)1 - / - / - 0
35bsu3593029 100% 0.571 PF05025 C3_S128 - (0)6 - / - / 12 1
36bsu0644020 100% 0.581 PF00206 C3_S117 - (6)3 - / - / 4 1
37bsu182393 100% 0.465 PF12197 0 - (0)? - / - / - 0
38bsu4029018 100% 0.839 PF00583 10 - (0)? - / - / - 0
39bsu0586018 100% 0.593 PF00480 C2_S122 - (20)? - / - / 1 0
40bsu3351015 100% 0.772 PF00403 1 - (0)? - / - / - 0
41bsu1816016 100% 0.624 PF04616 C1_S129 - (0)5 - / - / 5 2
42bsu1719020 100% 0.559 PF14765 C2_S12 - (0)? - / - / 1 0
43bsu1152014 100% 0.834 PF05389 1 - (0)? - / - / - 0
44bsu2949020 100% 0.593 PF08534 C1_S119 - (0)4 - / - / 1 1
45bsu0002020 100% 0.603 PF02768 C2_S121 - (0)2 - / - / 2 0
46bsu1169013 100% 0.658 PF01180 11 - (8)? - / - / - 0
47bsu0756023 100% 0.838 PF00544 C6_S118 - (0)3 - / - / 8 1
48bsu0011030 100% 0.703 PF01680 C6_S119 - (7)6 - / - / 2 1
49bsu127603 100% 0.880 PF12937 13 - (0)? - / - / - 0
50bsu0687020 100% 0.582 PF12680 51 - (6)2 - / - / - 0

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