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]
100bsu0373045 37% 0.532 PF00005 C1_S131 - (0)10 - / 1 / 20 5
101bsu3076040 35% 0.578 PF00005 C1_S133 - (0)11 - / 1 / 21 5
102bsu3964030 42% 0.499 PF00005 C1_S123 - (22)8 - / 8 / 5 4
103bsu3042053 44% 0.655 PF00005 C1_S139 - (0)12 - / 9 / 27 5
104bsu2495046 38% 0.502 PF00005 C1_S146 - (0)13 - / 7 / 30 7
105bsu2147018 33% 0.366 PF00005 7 - (0)? - / - / - 0
106bsu208900 24% 0.337 PF00005 1 - (0)? - / - / - 0
107bsu2811029 35% 0.332 PF00005 C2_S116 - (0)7 - / 9 / 3 3
108bsu0146048 54% 0.582 PF00005 C1_S145 - (0)11 - / 1 / 33 5
109bsu2496034 38% 0.527 PF00005 C1_S121 - (0)10 - / 5 / 13 6
110bsu3873022 40% ? PF00005 C2_S14 - (4)3 - / 1 / 2 2
111bsu0822058 55% 0.482 PF00005 C2_S199 - (88)12 - / 27 / 12 5
112bsu097101 43% ? PF00005 9 - (0)? - / - / - 0
113bsu3482010 57% ? PF00005 6 - (0)? - / - / - 0
114bsu1433025 50% 0.469 PF00005 C1_S115 - (0)3 - / 1 / 3 1
115bsu0972023 47% 0.473 PF00005 C1_S126 - (0)9 - / 8 / 4 4
116bsu3723022 51% 0.414 PF00005 C2_S15 - (0)2 - / 2 / 2 1
117bsu0821052 54% 0.468 PF00005 C1_S177 - (0)8 - / 19 / 21 5
118bsu0869038 61% 0.408 PF00005 C2_S132 - (0)9 - / 18 / 4 6
119bsu1432020 50% 0.445 PF00005 16 - (0)4 - / - / - 0
120bsu189702 45% 0.222 PF00005 3 - (0)? - / - / - 0
121bsu1481016 35% 0.515 PF00005 5 - (0)? - / - / - 0
122bsu0591015 54% 0.512 PF00005 C3_S17 - (0)2 - / 5 / - 1
123bsu2443012 31% 0.414 PF00005 1 - (0)? - / - / - 0
124bsu3516018 82% 0.516 PF00005 C2_S15 - (0)2 - / - / 2 1
125bsu402800 28% 0.012 PF00008 14 - (0)? - / - / - 0
126bsu196390 33% 0.297 PF00010 1 - (0)? - / - / - 0
127bsu075400 37% 0.129 PF00010 2 - (0)? - / - / - 0
128bsu194908 26% 0.443 PF00011 3 - (0)? - / - / - 0
129bsu1797017 31% 0.526 PF00011 5 - (0)? - / - / - 0
130bsu2224015 25% 0.468 PF00011 5 - (0)? - / - / - 0
131bsu0555011 28% 0.428 PF00011 3 - (0)? - / - / - 0
132bsu1926012 28% 0.588 PF00011 3 - (0)? - / - / - 0
133bsu2547062 88% 0.592 PF00012 C2_S165 - (0)20 7 / 28 / 10 9
134bsu1447018 51% 0.545 PF00012 C1_S129 - (0)5 - / 8 / 2 2
135bsu3641019 51% 0.613 PF00012 C1_S133 - (24)4 - / 9 / - 2
136bsu225200 45% 0.564 PF00012 0 - (0)? - / - / - 0
137bsu2803017 57% 0.581 PF00012 C1_S117 - (0)4 - / 7 / 1 2
138bsu178000 33% 0.621 PF00012 5 - (0)? - / - / - 0
139bsu087000 42% 0.552 PF00012 5 - (0)? - / - / - 0
140bsu160009 40% 0.558 PF00013 13 - (0)? - / - / - 0
141bsu022703 44% 0.242 PF00015 4 - (0)? - / - / - 0
142bsu1038016 100% 0.774 PF00015 C5_S119 - (0)2 6 / - / - 1
143bsu3123012 49% 0.465 PF00015 0 - (0)? - / - / - 0
144bsu3126011 44% 0.440 PF00015 2 - (0)? - / - / - 0
145bsu3124012 50% 0.445 PF00015 0 - (0)? - / - / - 0
146bsu0344013 49% 0.517 PF00015 0 - (0)? - / - / - 0
147bsu061803 33% 0.718 PF00017 2 - (0)? - / - / - 0
148bsu094000 29% 0.294 PF00017 2 - (0)? - / - / - 0
149bsu100805 16% 0.353 PF00018 1 - (0)? - / - / - 0
150bsu2692010 31% 0.109 PF00018 5 - (0)? - / - / - 0

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