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]
150bsu3866030 35% 0.477 PF00005 C1_S132 - (0)10 - / 11 / 5 5
151bsu3488024 44% 0.693 PF00977 C1_S129 - (0)9 2 / 5 / 4 5
152bsu0643031 61% 0.595 PF02222 C2_S149 - (36)9 - / 12 / 10 5
153bsu3689046 84% 0.544 PF14681 C6_S149 - (38)12 - / 10 / 21 5
154bsu0382025 35% 0.540 PF00005 C1_S119 - (0)7 - / 7 / 8 5
155bsu0351024 99% 0.552 PF00550 C1_S154 - (28)8 - / 13 / 2 5
156bsu2266023 48% 0.470 PF00218 C1_S113 - (5)10 - / 5 / 4 5
157bsu1830029 43% 0.536 PF00550 C1_S143 - (24)7 - / 13 / 1 5
158bsu0822058 55% 0.482 PF00005 C2_S199 - (88)12 - / 27 / 12 5
159bsu2725034 60% 0.581 PF01053 C1_S123 - (17)12 - / 2 / 14 5
160bsu3881047 53% 0.495 PF08402 C2_S133 - (0)10 - / 7 / 20 5
161bsu3155038 34% 0.383 PF00005 C5_S138 - (0)8 - / - / 20 5
162bsu1312020 49% 0.518 PF14850 C1_S134 - (26)12 6 / - / 8 5
163bsu2236023 46% 0.520 PF01336 C7_S122 - (16)10 - / 9 / 1 5
164bsu3706044 70% 0.467 PF00265 C10_S142 - (41)11 13 / 16 / 3 5
165bsu3255046 52% 0.530 PF08402 C1_S142 - (0)12 - / 18 / 7 5
166bsu3395018 100% 0.633 PF04198 C3_S136 - (15)8 - / - / 9 5
167bsu1818043 50% 0.478 PF00483 C1_S178 - (70)15 - / 14 / 22 5
168bsu1470040 55% 0.470 PF02868 C8_S139 - (0)17 - / 1 / 7 5
169bsu0146048 54% 0.582 PF00005 C1_S145 - (0)11 - / 1 / 33 5
170bsu0725083 66% 0.549 PF00067 C3_S1157 - (29)14 82 / 1 / 11 5
171bsu3526041 40% 0.554 PF08402 C1_S123 - (0)10 - / 14 / 7 5
172bsu3583020 52% 0.395 PF00083 C1_S124 - (0)6 - / - / 9 5
173bsu0883039 40% 0.668 PF08402 C1_S125 - (0)12 - / 1 / 17 5
174bsu4040018 100% 0.563 PF00512 C3_S140 - (25)8 3 / 9 / 1 4
175bsu2386029 83% 0.558 PF03446 C2_S127 - (14)10 - / 3 / 9 4
176bsu0069036 72% 0.619 PF09336 C2_S121 - (21)5 - / 14 / 5 4
177bsu2975056 76% 0.544 PF00793 C2_S174 - (74)8 - / - / 38 4
178bsu1595053 54% 0.586 PF02978 C8_S170 - (0)15 4 / 13 / 16 4
179bsu1088020 33% 0.542 PF00155 C2_S147 - (25)8 1 / 4 / 7 4
180bsu0788030 100% 0.684 PF01451 C6_S129 - (2)9 - / - / 14 4
181bsu3253022 47% 0.542 PF01546 C1_S114 - (0)5 - / - / 5 4
182bsu0456070 50% 0.572 PF01820 C1_S1109 - (82)15 2 / 35 / 21 4
183bsu2905091 100% 0.634 PF00248 C5_S1151 - (87)15 31 / 6 / 25 4
184bsu2573024 41% 0.464 PF03446 C1_S130 - (16)9 - / - / 13 4
185bsu2566057 45% 0.553 PF08501 C6_S168 - (63)12 5 / 15 / 26 4
186bsu1085020 38% 0.534 PF02894 C1_S128 - (0)4 - / - / 4 4
187bsu3373035 43% 0.641 PF08402 C2_S135 - (0)9 - / 9 / 5 4
188bsu2831022 47% 0.594 PF02776 C5_S182 - (38)15 12 / 4 / 10 4
189bsu3383036 43% 0.639 PF08402 C1_S137 - (0)9 - / 13 / 2 4
190bsu1011020 46% 0.391 PF00905 C1_S19 - (0)4 - / - / 4 4
191bsu0642036 80% 0.612 PF00731 C7_S133 - (26)12 - / 1 / 16 4
192bsu1863019 100% 0.659 PF03330 C3_S120 - (0)8 - / 2 / 8 4
193bsu1605013 100% 0.589 PF01926 C11_S114 - (0)5 - / 7 / 1 4
194bsu1734072 100% 0.514 PF01423 C5_S187 - (0)15 - / - / 48 4
195bsu1643021 55% 0.538 PF07194 C1_S117 - (0)7 - / - / 16 4
196bsu3986025 39% 0.533 PF00171 C3_S118 - (7)8 - / 1 / 6 4
197bsu3344073 46% 0.544 PF00175 C2_S1106 - (90)8 37 / 15 / 1 4
198bsu3275036 48% 0.530 PF08402 C1_S122 - (0)6 - / 4 / 12 4
199bsu2327019 42% 0.441 PF00677 C2_S121 - (21)4 - / 4 / 4 4
200bsu1439023 52% 0.498 PF00294 C1_S143 - (32)9 - / 1 / 8 4

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