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]
200bsu1529053 100% 0.623 PF00091 C3_S156 - (0)10 1 / 30 / 13 5
201bsu3660032 40% 0.542 PF00145 C4_S1108 - (35)7 1 / 30 / 4 1
202bsu2434050 68% 0.595 PF02786 C1_S163 - (31)20 1 / 15 / 31 19
203bsu1824051 53% 0.589 PF02786 C1_S161 - (30)20 1 / 15 / 31 19
204bsu0086018 99% 0.444 PF10431 C1_S126 - (0)6 1 / 15 / - 3
205bsu2289029 62% 0.687 PF02224 C2_S133 - (27)13 1 / 10 / 9 6
206bsu3872030 100% 0.655 PF03853 C2_S159 - (49)20 1 / 7 / 23 9
207bsu1326015 41% 0.605 PF02518 C3_S110 - (0)4 1 / 7 / - 0
208bsu3056021 55% 0.631 PF01293 C3_S117 - (15)4 1 / 7 / - 2
209bsu2895032 72% 0.527 PF07973 C1_S127 - (9)15 1 / 6 / 15 7
210bsu0457019 39% 0.540 PF08245 C1_S146 - (22)10 1 / 6 / - 4
211bsu1577029 50% 0.489 PF00069 C1_S156 - (15)12 1 / 4 / 10 8
212bsu1088020 33% 0.542 PF00155 C2_S147 - (25)8 1 / 4 / 7 4
213bsu3623019 46% 0.569 PF03721 C1_S123 - (13)7 1 / 4 / 2 3
214bsu2255016 44% 0.320 PF13631 C8_S160 - (0)3 1 / 3 / 1 1
215bsu1884061 100% 0.890 PF00722 C8_S173 - (0)20 1 / 2 / 36 9
216bsu3423030 47% 0.571 PF01041 C1_S145 - (0)12 1 / 2 / 13 6
217bsu0615030 43% 0.576 PF00107 C1_S152 - (30)9 1 / 2 / 6 1
218bsu3854022 35% 0.477 PF00106 C1_S141 - (28)5 1 / 2 / - 2
219bsu3424017 43% 0.473 PF00132 C4_S134 - (27)7 1 / 1 / 8 3
220bsu2385020 45% 0.554 PF00479 C1_S115 - (13)7 1 / 1 / 7 3
221bsu3200024 36% 0.504 PF00106 C1_S1121 - (76)4 1 / 1 / 2 1
222bsu3695018 45% 0.637 PF01300 C3_S111 - (0)3 1 / 1 / 2 3
223bsu0377019 57% 0.570 PF13414 C2_S124 - (0)2 1 / 1 / 1 1
224bsu2287021 100% 0.554 PF01070 C3_S139 - (14)2 1 / 1 / - 2
225bsu3049014 96% 0.700 PF08704 C2_S116 - (11)1 1 / 1 / - 0
226bsu2948012 44% 0.541 PF00398 C4_S18 - (0)? 1 / 1 / - 0
227bsu2025018 45% 0.429 PF00145 C2_S189 - (28)5 1 / - / 8 0
228bsu2680020 37% 0.515 PF01070 C2_S137 - (2)2 1 / - / 8 1
229bsu0735023 48% 0.553 PF00171 C3_S127 - (0)6 1 / - / 3 3
230bsu0799021 40% 0.595 PF03446 C1_S117 - (0)1 1 / - / 1 0
231bsu1699020 50% 0.527 PF00107 C1_S122 - (10)? 1 / - / - 0
232bsu2362020 64% 0.589 PF00248 C3_S138 - (19)3 1 / - / - 0
233bsu1752011 82% 0.621 PF13302 C1_S115 - (0)? 1 / - / - 0
234bsu0723018 30% 0.499 PF01494 C1_S171 - (36)1 1 / - / - 1
235bsu1532020 47% ? PF04545 C5_S124 - (0)1 1 / - / - 0
236bsu3768019 100% 0.604 PF00106 C2_S149 - (25)2 1 / - / - 1
237bsu0391021 56% 0.581 PF00171 C4_S113 - (0)3 1 / - / - 1
238bsu2161077 55% 0.556 PF00565 C9_S177 - (0)6 - / 66 / 5 1
239bsu1762074 56% 0.550 PF00565 C6_S175 - (0)6 - / 64 / 6 1
240bsu2727077 73% 0.621 PF01048 C1_S1117 - (62)20 - / 52 / 19 16
241bsu2273081 72% 0.639 PF00334 C7_S177 - (76)20 - / 45 / 31 12
242bsu4042047 79% 0.592 PF00709 C5_S191 - (67)20 - / 31 / 19 8
243bsu1603057 46% 0.554 PF01746 C9_S161 - (20)20 - / 29 / 24 29
244bsu0822058 55% 0.482 PF00005 C2_S199 - (88)12 - / 27 / 12 5
245bsu3393061 81% 0.876 PF00162 C5_S192 - (80)20 - / 26 / 24 9
246bsu1225048 35% 0.468 PF08402 C1_S145 - (0)13 - / 24 / 10 6
247bsu1572095 67% 0.552 PF01327 C5_S1109 - (15)20 - / 23 / 52 10
248bsu1311037 58% 0.546 PF02844 C7_S159 - (7)12 - / 23 / - 8
249bsu2267066 43% 0.504 PF00591 C7_S191 - (1)20 - / 22 / 33 8
250bsu0050049 51% 0.534 PF12804 C1_S158 - (37)16 - / 22 / 18 9

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