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]
50bsu3012018 100% 0.835 PF07470 C2_S129 - (0)3 - / - / 2 2
51bsu1741018 100% 0.464 PF05036 8 - (0)1 - / - / - 0
52bsu3954024 100% 0.483 PF02275 C6_S115 - (10)8 - / - / 4 0
53bsu072006 100% 0.472 PF01027 0 - (0)? - / - / - 0
54bsu0660025 100% 0.692 PF01884 C2_S127 - (0)7 - / 2 / 6 3
55bsu3454026 100% 0.636 PF00574 C7_S132 - (0)4 - / - / 10 1
56bsu1172032 100% 0.614 PF00106 C5_S168 - (36)8 17 / 8 / 1 3
57bsu3034059 100% 0.669 PF13426 C2_S177 - (0)3 20 / 18 / 7 2
58bsu2993020 100% 0.545 PF02922 C1_S117 - (0)6 - / - / 6 3
59bsu026307 100% 0.534 PF02416 3 - (0)? - / - / - 0
60bsu3299020 100% 0.557 PF00210 4 - (0)0 - / - / - 0
61bsu1355022 100% 0.573 PF01008 C6_S16 - (4)2 - / - / 2 1
62bsu243604 100% 0.634 PF12685 1 - (0)? - / - / - 0
63bsu1717020 100% 0.653 PF00378 C2_S117 - (0)4 - / - / 11 1
64bsu126604 100% 0.522 PF09393 0 - (0)? - / - / - 0
65bsu263003 100% 0.300 PF01386 3 - (0)? - / - / - 0
66bsu3094013 100% 0.898 PF02333 C2_S13 - (0)2 - / - / 3 1
67bsu0501018 100% 0.607 PF07719 11 - (0)? - / - / - 0
68bsu0687020 100% 0.582 PF12680 51 - (6)2 - / - / - 0
69bsu128203 100% 0.673 PF14185 2 - (0)? - / - / - 0
70bsu075302 100% 0.459 PF00115 7 - (0)? - / - / - 0
71bsu3168013 100% 0.531 PF00072 10 - (0)? - / - / - 0
72bsu313907 100% 0.548 PF00575 4 - (0)? - / - / - 0
73bsu0210022 100% 0.807 PF00067 C4_S196 - (1)2 11 / - / - 1
74bsu1962024 100% 0.525 PF01079 C8_S115 - (0)6 - / - / 6 3
75bsu403807 100% 0.521 PF09648 1 - (0)? - / - / - 0
76bsu3455027 100% 0.673 PF13419 C1_S122 - (11)13 - / 5 / 12 8
77bsu0118020 100% 0.410 PF00276 1 - (0)? - / - / - 0
78bsu0466016 100% 0.545 PF02452 C1_S11 - (0)? - / - / 1 0
79bsu3943018 100% 0.608 PF04198 C2_S126 - (12)3 - / - / 2 1
80bsu098007 100% 0.632 PF06133 4 - (0)? - / - / - 0
81bsu0037013 100% 0.520 PF04014 C1_S13 - (0)? - / - / 1 0
82bsu3911066 100% 0.551 PF00271 C1_S157 - (0)13 3 / 17 / 29 7
83bsu1409017 100% 0.549 PF10388 C2_S134 - (0)4 - / - / 3 1
84bsu3019055 100% 0.559 PF00067 C5_S1150 - (0)5 33 / - / 2 1
85bsu1014020 100% 0.604 PF01593 C1_S147 - (27)2 5 / - / - 1
86bsu4029018 100% 0.839 PF00583 10 - (0)? - / - / - 0
87bsu2287021 100% 0.554 PF01070 C3_S139 - (14)2 1 / 1 / - 2
88bsu0474020 100% 0.601 PF07228 4 - (0)? - / - / - 0
89bsu310209 100% 0.526 PF00313 0 - (0)? - / - / - 0
90bsu207305 100% 0.590 PF09643 0 - (0)? - / - / - 0
91bsu1555021 100% 0.871 PF00215 C2_S139 - (26)10 - / 12 / 2 3
92bsu3023071 100% 0.552 PF00202 C1_S1136 - (79)20 - / - / 54 6
93bsu109507 100% 0.596 PF02679 C3_S18 - (0)1 - / - / 2 0
94bsu1841048 100% 0.612 PF01019 C3_S143 - (24)7 - / - / 22 5
95bsu3503021 100% 0.612 PF07702 C1_S131 - (0)3 - / - / 3 1
96bsu0586018 100% 0.593 PF00480 C2_S122 - (20)? - / - / 1 0
97bsu3114013 100% 0.612 PF05995 C1_S121 - (12)2 - / - / 3 1
98bsu342106 100% 0.725 PF09628 1 - (0)? - / - / - 0
99bsu2913043 100% 0.868 PF00180 C7_S156 - (52)17 - / 13 / 23 5
100bsu0683019 100% 0.616 PF07719 16 - (0)? - / - / - 0

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