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]
100bsu0408016 100% 0.580 PF01195 6 - (0)? - / - / - 0
101bsu2328022 100% 0.587 PF00383 C3_S149 - (0)3 2 / - / 1 1
102bsu3229017 100% 0.609 PF13344 C2_S112 - (1)2 - / - / 2 0
103bsu2990019 100% 0.606 PF02390 21 - (13)? - / - / - 0
104bsu3109031 100% 0.548 PF02254 C3_S150 - (0)3 - / 11 / 2 3
105bsu313907 100% 0.548 PF00575 4 - (0)? - / - / - 0
106bsu0798020 100% 0.643 PF01522 18 - (0)? - / - / - 0
107bsu1578020 100% 0.554 PF03193 C3_S120 - (0)2 - / 8 / - 1
108bsu109507 100% 0.596 PF02679 C3_S18 - (0)1 - / - / 2 0
109bsu076409 100% 0.603 PF00708 C5_S19 - (7)2 - / - / 1 0
110bsu0002020 100% 0.603 PF02768 C2_S121 - (0)2 - / - / 2 0
111bsu188105 100% 0.596 PF11518 2 - (0)1 - / - / - 0
112bsu0644020 100% 0.581 PF00206 C3_S117 - (6)3 - / - / 4 1
113bsu128203 100% 0.673 PF14185 2 - (0)? - / - / - 0
114bsu4043019 100% 0.590 PF00903 6 - (0)? - / - / - 0
115bsu342106 100% 0.725 PF09628 1 - (0)? - / - / - 0
116bsu1166010 100% 0.633 PF02581 C1_S113 - (3)4 - / - / 3 1
117bsu2489011 100% 0.624 PF01812 C7_S17 - (0)2 - / 3 / - 1
118bsu0126019 100% 0.671 PF00238 0 - (0)? - / - / - 0
119bsu3517018 100% 0.517 PF00271 C5_S131 - (0)3 4 / 3 / 1 0
120bsu173506 100% 0.580 PF14157 C8_S12 - (0)2 - / - / 2 1
121bsu1920014 100% 0.607 PF00072 10 - (0)1 - / - / - 0
122bsu1919019 100% 0.513 PF07730 C2_S116 - (14)5 - / 7 / 3 3
123bsu3811019 100% 0.499 PF00881 C3_S172 - (42)2 - / 9 / - 1
124bsu121506 100% 0.518 PF14172 C3_S17 - (0)1 - / - / 1 1
125bsu072006 100% 0.472 PF01027 0 - (0)? - / - / - 0
126bsu2319026 100% 0.540 PF00768 C5_S135 - (0)10 - / - / 9 2
127bsu0134011 100% 0.634 PF00327 1 - (0)? - / - / - 0
128bsu1359020 100% 0.592 PF02788 0 - (0)? - / - / - 0
129bsu0839016 100% 0.638 PF12867 7 - (0)? - / - / - 0
130bsu1172032 100% 0.614 PF00106 C5_S168 - (36)8 17 / 8 / 1 3
131bsu158102 100% 0.275 PF08183 2 - (0)? - / - / - 0
132bsu1863019 100% 0.659 PF03330 C3_S120 - (0)8 - / 2 / 8 4
133bsu3791016 100% 0.550 PF00535 C4_S124 - (12)4 - / - / 6 2
134bsu277208 100% 0.539 PF02668 3 - (0)? - / - / - 0
135bsu182393 100% 0.465 PF12197 0 - (0)? - / - / - 0
136bsu3351015 100% 0.772 PF00403 1 - (0)? - / - / - 0
137bsu1389018 100% 0.874 PF00358 0 - (0)? - / - / - 0
138bsu1324015 100% 0.618 PF01910 C4_S12 - (0)1 - / - / 1 1
139bsu207305 100% 0.590 PF09643 0 - (0)? - / - / - 0
140bsu2931020 100% 0.582 PF00296 C2_S119 - (9)1 - / 1 / - 1
141bsu0121020 100% 0.483 PF00237 10 - (0)0 - / - / - 0
142bsu0049010 100% 0.638 PF00056 3 - (0)2 - / - / - 0
143bsu2913043 100% 0.868 PF00180 C7_S156 - (52)17 - / 13 / 23 5
144bsu1697020 100% 0.701 PF00149 7 - (0)? - / - / - 0
145bsu1580019 100% 0.539 PF04263 C2_S120 - (14)4 - / - / 2 1
146bsu3215010 100% 0.546 PF00583 C2_S166 - (43)1 - / - / 2 1
147bsu3936017 100% 0.693 PF01175 C4_S116 - (16)2 7 / - / - 1
148bsu0012021 100% 0.614 PF01174 32 - (0)1 - / - / - 0
149bsu1195018 100% 0.581 PF02729 0 - (0)? - / - / - 0
150bsu01370104 100% 0.604 PF05191 C3_S1153 - (137)15 76 / 27 / - 6

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