Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
LTP (May 2014)

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)		 Modeller
(QMean Score)		 Classification code

 Binding Site (All) 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]
 [Best Score]
 Main Code
 [Name]
 [Number]
 [Number]
 Distribution of CDocking pKd
 [Number]
200113_tII_WHEAT12 74% 0.672 0.657 PF00234 C3_S11 - (0)- - / - / 1 -
201727_tV_SELMO12 36% 0.509 0.510 PF00234 0 - (0)- - / - / - -
202453_tII_MAIZE12 38% 0.511 0.664 PF14368 0 - (0)- - / - / - -
203401_tI_VITVI11 49% 0.653 0.653 PF00234 C2_S12 - (0)- - / - / 1 -
204726_tVI_SELMO11 35% 0.522 0.506 PF00234 0 - (0)- - / - / - -
205518_tI_TAMHI11 65% 0.603 0.645 PF00234 C5_S13 - (0)- - / - / 3 -
206156_tV_WHEAT11 33% 0.520 0.521 PF00234 0 - (0)- - / - / - -
207528_tI_TOBAC11 42% 0.587 0.567 PF00234 C3_S11 - (0)- - / - / 1 -
208162_tV_WHEAT11 33% 0.452 0.448 PF00234 0 - (0)- - / - / - -
209586_tV_MAIZE11 34% 0.454 0.495 PF00234 0 - (0)- - / - / - -
210736_tVI_VITVI11 28% 0.504 0.524 PF00234 0 - (0)- - / - / - -
211015_tI_WHEAT11 70% 0.633 0.631 PF00234 C5_S13 - (0)- - / 1 / 1 -
212742_tVI_VITVI11 27% 0.315 0.316 PF00234 0 - (0)- - / - / - -
213110_tII_WHEAT11 60% 0.591 0.591 PF00234 C2_S11 - (0)- - / - / 1 -
214543_tII_TAMHI11 43% 0.703 0.703 PF14368 0 - (0)- - / - / - -
215501_tIV_MEDTR11 37% 0.527 0.605 PF00234 0 - (0)- - / - / - -
216758_tVI_VITVI11 30% 0.412 0.434 PF00234 0 - (0)- - / - / - -
217157_tV_WHEAT11 35% 0.440 0.482 PF00234 0 - (0)- - / - / - -
218185_tIX_ARATH11 54% 0.300 0.352 PF00234 0 - (0)- - / - / - -
219017_tI_WHEAT11 68% 0.531 0.544 PF00234 C5_S13 - (0)- - / 1 / 1 -
220737_tVI_VITVI11 32% 0.376 0.473 PF00234 0 - (0)- - / - / - -
221495_tII_RICCO11 33% 0.412 0.429 PF00234 0 - (0)- - / - / - -
222608_tVI_THECC11 30% 0.444 0.587 PF00234 0 - (0)- - / - / - -
223176_tVI_WHEAT11 33% 0.653 0.636 PF00234 0 - (0)- - / - / - -
224678_tII_BRADI11 65% 0.556 0.555 PF00234 C3_S11 - (0)- - / 1 / - -
225492_tVI_RICCO11 28% 0.391 0.391 PF00234 0 - (0)- - / - / - -
226763_tI_VITVI11 34% 0.533 0.519 PF00234 0 - (0)- - / - / - -
227487_tVI_POPTR11 30% 0.370 0.457 PF00234 0 - (0)- - / - / - -
228494_tIV_RICCO11 48% 0.504 0.581 PF00234 C3_S12 - (0)- - / - / 2 -
229443_tII_RICCO11 30% 0.567 0.570 PF00234 0 - (0)- - / - / - -
230007_tI_WHEAT11 71% 0.630 0.612 PF00234 C4_S13 - (0)- - / 1 / 2 -
231640_tV_THECC11 32% 0.525 0.593 PF00234 0 - (0)- - / - / - -
232756_tVI_VITVI11 27% 0.449 0.502 PF00234 0 - (0)- - / - / - -
233731_tV_SELMO11 33% 0.542 0.542 PF00234 0 - (0)- - / - / - -
234013_tI_WHEAT11 70% 0.606 0.571 PF00234 C5_S13 - (0)- - / 1 / 1 -
235579_tV_VITVI11 39% 0.392 0.377 PF00234 0 - (0)- - / - / - -
236612_tVI_THECC11 29% 0.442 0.438 PF00234 0 - (0)- - / - / - -
237155_tIV_ARATH11 39% 0.598 0.597 PF00234 0 - (0)- - / - / - -
238466_tVI_VITVI11 27% 0.369 0.351 PF00234 0 - (0)- - / - / - -
239646_tIV_THECC11 45% 0.420 0.410 PF00234 0 - (0)- - / - / - -
240005_tI_WHEAT11 70% 0.644 0.644 PF00234 C5_S13 - (0)- - / 1 / 1 -
241705_tVI_SELMO11 30% 0.473 0.465 PF00234 0 - (0)- - / - / - -
242599_tII_ARATH11 33% 0.469 0.492 PF00234 0 - (0)- - / - / - -
243151_tIV_ARATH11 100% 0.553 0.572 PF00234 C3_S12 - (0)- - / 2 / - -
244089_tII_WHEAT11 77% 0.645 0.645 PF00234 C5_S11 - (0)- - / 1 / - -
245676_tV_BRADI11 30% 0.486 0.434 PF00234 0 - (0)- - / - / - -
246002_tI_WHEAT11 96% 0.547 0.548 PF00234 C2_S14 - (0)- - / 1 / 2 -
247114_tII_ORYSA11 43% 0.650 0.683 PF00234 0 - (0)- - / - / - -
248764_tV_VITVI11 29% 0.465 0.564 PF00234 0 - (0)- - / - / - -
249701_tXI_SELMO11 36% 0.480 0.517 PF00234 0 - (0)- - / - / - -
250020_tI_WHEAT11 71% 0.623 0.620 PF00234 C4_S13 - (0)- - / 1 / 1 -

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