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]
200bsu1136036 37% 0.497 PF00005 C1_S137 - (0)9 - / 2 / 6 4
201bsu1694036 69% 0.607 PF00154 C1_S142 - (0)11 - / 17 / 8 5
202bsu1030036 99% 0.755 PF00082 C1_S134 - (0)2 - / - / 8 1
203bsu3948036 54% 0.638 PF08402 C1_S120 - (0)7 - / 15 / 1 4
204bsu0048036 100% 0.623 PF01042 C6_S122 - (0)5 - / - / 7 0
205bsu0283036 55% 0.557 PF00106 C1_S1110 - (73)12 19 / 11 / 3 4
206bsu3383036 43% 0.639 PF08402 C1_S137 - (0)9 - / 13 / 2 4
207bsu2279035 87% 0.548 PF00216 C7_S161 - (0)2 4 / 5 / 14 1
208bsu2947035 58% 0.647 PF00871 C6_S157 - (51)20 2 / 15 / 12 12
209bsu1592035 100% 0.792 PF00550 C7_S138 - (0)11 - / - / 8 2
210bsu3462035 56% 0.490 PF16657 C1_S135 - (0)9 - / 2 / 23 4
211bsu0926035 67% 0.521 PF00202 C1_S146 - (22)5 - / - / 12 2
212bsu0082035 79% 0.534 PF01336 C5_S142 - (28)14 - / 11 / 6 6
213bsu1826035 50% 0.550 PF02771 C1_S137 - (37)8 4 / 12 / 7 4
214bsu2002035 100% 0.501 PF00692 C7_S164 - (47)6 - / - / 22 3
215bsu1422035 52% 0.631 PF00578 C1_S118 - (0)8 - / - / 7 1
216bsu3373035 43% 0.641 PF08402 C2_S135 - (0)9 - / 9 / 5 4
217bsu2431034 53% 0.646 PF02882 C4_S144 - (32)15 2 / 15 / 15 6
218bsu3291034 50% 0.747 PF00106 C1_S194 - (75)10 - / 17 / 14 4
219bsu0236034 50% 0.635 PF01182 C5_S122 - (17)13 - / - / 17 6
220bsu2326034 57% 0.649 PF00926 C7_S126 - (0)8 - / - / 21 3
221bsu2496034 38% 0.527 PF00005 C1_S121 - (0)10 - / 5 / 13 6
222bsu2396034 64% 0.544 PF08402 C1_S129 - (0)12 - / 16 / 9 5
223bsu2105034 71% 0.683 PF00216 C9_S161 - (0)2 5 / 6 / 11 1
224bsu2405034 44% 0.544 PF00676 C4_S131 - (20)8 - / 11 / 9 6
225bsu1377034 57% 0.624 PF00106 C1_S1102 - (56)11 2 / 4 / 6 3
226bsu2725034 60% 0.581 PF01053 C1_S123 - (17)12 - / 2 / 14 5
227bsu3252034 100% 0.589 PF00266 C1_S140 - (26)13 - / 1 / 11 2
228bsu1417034 40% 0.548 PF00258 C1_S1109 - (107)4 10 / 9 / - 2
229bsu1188034 51% 0.605 PF01053 C1_S122 - (16)12 - / 1 / 16 5
230bsu2446033 65% 0.569 PF00557 C1_S120 - (1)8 - / 1 / 7 0
231bsu1022033 37% 0.419 -C11_S122 - (0)4 - / - / 10 2
232bsu0313033 100% 0.789 PF02540 C5_S166 - (59)12 - / 14 / 16 5
233bsu3055033 71% 0.513 PF00438 C6_S114 - (9)8 - / - / 8 0
234bsu2934033 54% 0.650 PF08402 C1_S126 - (0)12 - / 15 / 7 5
235bsu3789032 44% 0.579 PF01041 C1_S167 - (0)13 - / 4 / 9 5
236bsu0053032 53% 0.622 PF01195 C6_S115 - (0)11 - / 1 / 6 4
237bsu1142032 100% 0.575 PF00579 C4_S135 - (24)11 4 / 3 / 6 3
238bsu1172032 100% 0.614 PF00106 C5_S168 - (36)8 17 / 8 / 1 3
239bsu2703032 44% 0.519 PF00251 C3_S140 - (0)8 - / 2 / 9 2
240bsu1813032 99% 0.539 PF00150 C1_S159 - (42)20 - / 3 / 14 7
241bsu2357032 73% 0.563 PF00206 C3_S116 - (10)7 - / - / 10 3
242bsu1003032 100% 0.468 PF01230 C3_S182 - (0)9 - / 4 / 7 3
243bsu0013032 59% 0.413 PF00587 C3_S142 - (36)10 - / 16 / 9 6
244bsu0662032 69% 0.522 PF03119 C6_S134 - (20)17 - / 11 / 12 0
245bsu2895032 72% 0.527 PF07973 C1_S127 - (9)15 1 / 6 / 15 7
246bsu2382032 100% 0.686 PF00724 C2_S1178 - (105)10 2 / 8 / 10 3
247bsu2864032 79% 0.477 PF01409 C1_S126 - (13)11 - / 8 / 6 8
248bsu3660032 40% 0.542 PF00145 C4_S1108 - (35)7 1 / 30 / 4 1
249bsu1385031 41% 0.509 PF00403 C1_S114 - (0)10 - / 7 / 2 3
250bsu3316031 40% 0.486 PF00005 C2_S118 - (0)7 - / 1 / 9 3

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