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]
200bsu0118020 100% 0.410 PF00276 1 - (0)? - / - / - 0
201bsu3082019 100% 0.587 PF02776 C8_S145 - (23)2 - / 1 / 1 1
202bsu003304 100% 0.459 PF07716 0 - (0)? - / - / - 0
203bsu0995016 100% 0.578 PF00397 C5_S112 - (0)1 - / - / 1 0
204bsu151203 100% 0.555 PF01442 C6_S16 - (0)1 - / - / 3 1
205bsu3911066 100% 0.551 PF00271 C1_S157 - (0)13 3 / 17 / 29 7
206bsu3754011 100% 0.751 PF01361 C2_S119 - (0)1 - / - / 2 1
207bsu373403 100% 0.637 PF09148 4 - (0)1 - / - / - 0
208bsu0209027 100% 0.517 PF00905 C3_S162 - (0)7 - / - / 7 3
209bsu3936017 100% 0.693 PF01175 C4_S116 - (16)2 7 / - / - 1
210bsu3852016 100% 0.748 PF00550 3 - (0)? - / - / - 0
211bsu0501018 100% 0.607 PF07719 11 - (0)? - / - / - 0
212bsu2382032 100% 0.686 PF00724 C2_S1178 - (105)10 2 / 8 / 10 3
213bsu0839016 100% 0.638 PF12867 7 - (0)? - / - / - 0
214bsu1962024 100% 0.525 PF01079 C8_S115 - (0)6 - / - / 6 3
215bsu0127020 100% 0.554 PF00467 0 - (0)? - / - / - 0
216bsu354605 100% 0.525 PF10719 1 - (0)? - / - / - 0
217bsu1641020 100% 0.560 PF01656 C1_S167 - (65)4 - / 5 / 2 2
218bsu01370104 100% 0.604 PF05191 C3_S1153 - (137)15 76 / 27 / - 6
219bsu0586018 100% 0.593 PF00480 C2_S122 - (20)? - / - / 1 0
220bsu3252034 100% 0.589 PF00266 C1_S140 - (26)13 - / 1 / 11 2
221bsu4055021 100% 0.638 PF02833 C1_S111 - (0)4 - / - / 7 1
222bsu3215010 100% 0.546 PF00583 C2_S166 - (43)1 - / - / 2 1
223bsu0270021 100% 0.798 PF01674 C1_S119 - (6)7 - / - / 9 2
224bsu358203 100% 0.459 PF05504 0 - (0)? - / - / - 0
225bsu1160018 100% 0.534 PF04607 0 - (0)? - / - / - 0
226bsu3574014 100% 0.592 PF01467 C3_S128 - (20)4 - / 8 / 1 2
227bsu4100020 100% 0.555 PF02527 C1_S19 - (0)? - / 1 / - 0
228bsu1423014 100% 0.737 PF00085 20 - (0)? - / - / - 0
229bsu1168018 100% 0.553 PF02597 0 - (0)? - / - / - 0
230bsu2235016 100% 0.790 PF07261 0 - (0)? - / - / - 0
231bsu4054016 100% 0.572 PF01638 C3_S113 - (0)4 - / - / 1 1
232bsu2284025 100% 0.631 PF01926 C1_S133 - (0)4 4 / 11 / - 2
233bsu371608 100% 0.549 PF00613 C5_S118 - (0)1 - / - / 1 1
234bsu3503021 100% 0.612 PF07702 C1_S131 - (0)3 - / - / 3 1
235bsu0687020 100% 0.582 PF12680 51 - (6)2 - / - / - 0
236bsu1863019 100% 0.659 PF03330 C3_S120 - (0)8 - / 2 / 8 4
237bsu2885014 100% 0.610 PF00453 0 - (0)? - / - / - 0
238bsu0465016 100% 0.470 PF01402 2 - (0)? - / - / - 0
239bsu280007 100% 0.435 PF03775 1 - (0)? - / - / - 0
240bsu1375014 100% 0.582 PF14489 C3_S120 - (0)4 - / - / 7 2
241bsu342106 100% 0.725 PF09628 1 - (0)? - / - / - 0
242bsu0131020 100% 0.598 PF00347 0 - (0)? - / - / - 0
243bsu2328022 100% 0.587 PF00383 C3_S149 - (0)3 2 / - / 1 1
244bsu2529020 100% 0.804 PF00398 C1_S112 - (8)4 - / 3 / 2 3
245bsu0007048 100% 0.542 PF00521 C8_S193 - (0)7 - / 1 / 35 0
246bsu243604 100% 0.634 PF12685 1 - (0)? - / - / - 0
247bsu0313033 100% 0.789 PF02540 C5_S166 - (59)12 - / 14 / 16 5
248bsu3593029 100% 0.571 PF05025 C3_S128 - (0)6 - / - / 12 1
249bsu1081020 100% 0.661 PF00494 30 - (0)1 - / - / - 0
250bsu0466016 100% 0.545 PF02452 C1_S11 - (0)? - / - / 1 0

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