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]
1bsu012409 100% 0.772 PF00831 2 - (0)? - / - / - 0
2bsu2990019 100% 0.606 PF02390 21 - (13)? - / - / - 0
3bsu0839016 100% 0.638 PF12867 7 - (0)? - / - / - 0
4bsu1940017 100% 0.630 PF00080 1 - (0)? - / - / - 0
5bsu0002020 100% 0.603 PF02768 C2_S121 - (0)2 - / - / 2 0
6bsu3252034 100% 0.589 PF00266 C1_S140 - (26)13 - / 1 / 11 2
7bsu0226011 100% 0.590 PF12697 16 - (0)? - / - / - 0
8bsu0597020 100% 0.711 PF06971 C8_S133 - (0)4 - / 4 / 2 2
9bsu401309 100% 0.607 PF07702 26 - (0)? - / - / - 0
10bsu0048036 100% 0.623 PF01042 C6_S122 - (0)5 - / - / 7 0
11bsu2525011 100% 0.601 PF00571 C1_S137 - (0)4 - / 1 / 3 2
12bsu3530023 100% 0.544 PF07516 C2_S113 - (0)2 - / 2 / 3 1
13bsu3448017 100% 0.605 PF00440 13 - (0)? - / - / - 0
14bsu2564050 100% 0.636 PF01467 C1_S178 - (45)18 10 / 10 / 13 7
15bsu163909 100% 0.557 PF00771 0 - (0)? - / - / - 0
16bsu1014020 100% 0.604 PF01593 C1_S147 - (27)2 5 / - / - 1
17bsu0121020 100% 0.483 PF00237 10 - (0)0 - / - / - 0
18bsu1660020 100% 0.460 PF00575 0 - (0)? - / - / - 0
19bsu3019055 100% 0.559 PF00067 C5_S1150 - (0)5 33 / - / 2 1
20bsu0687020 100% 0.582 PF12680 51 - (6)2 - / - / - 0
21bsu1355022 100% 0.573 PF01008 C6_S16 - (4)2 - / - / 2 1
22bsu305709 100% 0.553 PF10763 0 - (0)? - / - / - 0
23bsu128203 100% 0.673 PF14185 2 - (0)? - / - / - 0
24bsu373403 100% 0.637 PF09148 4 - (0)1 - / - / - 0
25bsu3872030 100% 0.655 PF03853 C2_S159 - (49)20 1 / 7 / 23 9
26bsu0051023 100% 0.595 PF13793 C7_S115 - (12)5 - / - / 8 3
27bsu2820020 100% 0.521 PF02190 0 - (0)? - / - / - 0
28bsu218308 100% 0.545 PF00069 26 - (14)? - / - / - 0
29bsu1549056 100% 0.625 PF02729 C8_S157 - (43)20 - / 20 / 13 8
30bsu3501020 100% 0.546 PF01979 C1_S118 - (7)4 - / - / 5 2
31bsu1835020 100% 0.513 PF02113 C4_S119 - (0)2 - / - / 2 0
32bsu1165024 100% 0.462 PF03070 C4_S136 - (16)9 - / - / 15 3
33bsu0007048 100% 0.542 PF00521 C8_S193 - (0)7 - / 1 / 35 0
34bsu1766040 100% 0.502 PF00692 C7_S1135 - (89)7 - / - / 24 3
35bsu1920014 100% 0.607 PF00072 10 - (0)1 - / - / - 0
36bsu0644020 100% 0.581 PF00206 C3_S117 - (6)3 - / - / 4 1
37bsu1356018 100% 0.542 PF01636 C1_S146 - (30)4 - / 10 / 4 2
38bsu1823020 100% 0.576 PF00682 11 - (0)? - / - / - 0
39bsu151203 100% 0.555 PF01442 C6_S16 - (0)1 - / - / 3 1
40bsu2578020 100% 0.730 PF01451 C6_S111 - (2)1 - / - / 3 1
41bsu3215010 100% 0.546 PF00583 C2_S166 - (43)1 - / - / 2 1
42bsu2949020 100% 0.593 PF08534 C1_S119 - (0)4 - / - / 1 1
43bsu1038016 100% 0.774 PF00015 C5_S119 - (0)2 6 / - / - 1
44bsu1423014 100% 0.737 PF00085 20 - (0)? - / - / - 0
45bsu3114013 100% 0.612 PF05995 C1_S121 - (12)2 - / - / 3 1
46bsu3617019 100% 0.516 PF04493 C5_S118 - (0)2 4 / 1 / - 0
47bsu098007 100% 0.632 PF06133 4 - (0)? - / - / - 0
48bsu2913043 100% 0.868 PF00180 C7_S156 - (52)17 - / 13 / 23 5
49bsu284606 100% 0.445 PF04051 5 - (0)? - / - / - 0
50bsu003304 100% 0.459 PF07716 0 - (0)? - / - / - 0

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