Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000002438 (Pseudomonas aeruginosa - Jan 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]
200PA01994 39% 0.756 PF00561 0 - (0)? - / - / - 0
201PA02000 24% 0.018 PF09204 0 - (0)? - / - / - 0
202PA020120 36% 0.616 PF12697 11 - (7)? - / - / - 0
203PA020220 37% 0.530 PF01425 34 - (0)? - / - / - 0
204PA020318 33% 0.553 -35 - (0)? - / - / - 0
205PA02047 40% 0.308 PF00528 1 - (0)? - / - / - 0
206PA02057 30% 0.284 PF00528 2 - (0)? - / - / - 0
207PA020638 45% 0.534 PF08402 C1_S126 - (0)10 - / 10 / 8 5
208PA020715 39% 0.396 PF03466 12 - (0)? - / - / - 0
209PA020817 22% 0.345 PF01144 6 - (0)? - / - / - 0
210PA02092 47% 0.366 PF07228 2 - (0)? - / - / - 0
211PA02100 22% 0.191 PF05697 15 - (0)? - / - / - 0
212PA021119 35% 0.314 PF01039 6 - (0)? - / - / - 0
213PA021216 22% 0.454 PF01039 0 - (0)? - / - / - 0
214PA02134 34% 0.417 PF01722 7 - (5)? - / - / - 0
215PA021421 39% 0.592 PF00698 C1_S120 - (15)2 - / - / 3 1
216PA02150 47% 0.101 PF00374 2 - (0)? - / - / - 0
217PA02160 47% -0.006 PF00005 1 - (0)? - / - / - 0
218PA021714 37% 0.526 PF03466 7 - (0)? - / - / - 0
219PA021819 46% 0.608 PF03466 20 - (0)? - / - / - 0
220PA021921 56% 0.506 PF00171 30 - (30)1 - / - / - 0
221PA02203 29% 0.388 PF13520 4 - (0)? - / - / - 0
222PA022122 56% 0.590 PF00202 C1_S141 - (27)4 - / 1 / 4 2
223PA022216 48% 0.488 PF01547 29 - (0)? - / - / - 0
224PA022320 99% 0.620 PF00701 26 - (23)? - / - / - 0
225PA02248 35% 0.475 PF00596 20 - (20)? - / - / - 0
226PA02251 46% 0.372 PF00717 72 - (0)? - / - / - 0
227PA02269 34% 0.475 PF01144 6 - (0)? - / - / - 0
228PA022710 41% 0.476 PF01144 9 - (1)? - / - / - 0
229PA022820 55% 0.502 PF00108 0 - (0)? - / - / - 0
230PA022910 42% 0.278 PF07690 15 - (0)? - / - / - 0
231PA023020 80% 0.537 PF00206 8 - (0)? - / - / - 0
232PA023120 49% 0.522 PF12697 C1_S124 - (0)1 - / - / 1 0
233PA023212 37% 0.570 PF02627 8 - (0)? - / - / - 0
234PA023317 31% 0.528 PF03466 14 - (0)? - / - / - 0
235PA02342 16% 0.079 PF03502 0 - (0)? - / - / - 0
236PA023511 38% 0.335 PF07690 14 - (0)? - / - / - 0
237PA023611 35% 0.670 PF01614 3 - (0)? - / - / - 0
238PA023718 28% 0.437 PF02894 32 - (12)? - / - / - 0
239PA023820 34% 0.551 PF01261 10 - (0)? - / - / - 0
240PA02390 22% 0.230 -1 - (0)? - / - / - 0
241PA024027 100% ? PF00267 C5_S1112 - (0)2 - / - / 6 0
242PA024112 38% 0.310 PF07690 3 - (0)? - / - / - 0
243PA024217 35% 0.454 PF00903 8 - (0)? - / - / - 0
244PA024313 29% 0.403 PF00440 21 - (0)? - / - / - 0
245PA024420 51% 0.495 PF08501 C3_S150 - (47)6 - / 5 / 5 3
246PA024519 61% 0.672 PF01220 C6_S126 - (0)1 - / - / 1 1
247PA024610 39% 0.344 PF07690 117 - (0)? - / - / - 0
248PA024737 100% 0.824 PF01494 C1_S1105 - (94)6 36 / 1 / 1 4
249PA024811 38% 0.310 PF12833 22 - (0)? - / - / - 0
250PA024918 40% 0.418 PF00583 64 - (22)? - / - / - 0

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