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]
200312_tI_PICSI8 51% 0.650 0.621 PF00234 C2_S11 - (0)- - / - / 1 -
201567_tIII_VITVI20 41% 0.609 0.621 PF00234 0 - (0)- - / - / - -
202350_tI_RICCO8 36% 0.540 0.620 PF00234 1 - (0)- - / - / - -
203020_tI_WHEAT11 71% 0.623 0.620 PF00234 C4_S13 - (0)- - / 1 / 1 -
204135_tII_ARATH12 43% 0.551 0.620 PF00234 0 - (0)- - / - / - -
205276_tI_LENCU10 59% 0.655 0.619 PF00234 C2_S14 - (0)- - / 1 / 3 -
206694_tI_POPTR8 31% 0.587 0.619 PF00234 0 - (0)- - / - / - -
207754_tI_VITVI10 60% 0.606 0.619 PF00234 C2_S12 - (0)- - / - / 2 -
208197_tI_AMBAR10 38% 0.560 0.619 PF00234 0 - (0)- - / - / - -
209096_tII_WHEAT12 75% 0.593 0.619 PF00234 C3_S11 - (0)- - / - / 1 -
210003_tI_WHEAT10 86% 0.608 0.619 PF00234 C2_S14 - (0)- - / 1 / 3 -
211677_tVI_BRADI9 29% 0.667 0.618 PF00234 0 - (0)- - / - / - -
212786_tI_MEDTR8 43% 0.646 0.618 PF00234 1 - (0)- - / - / - -
213296_tI_TOBAC10 70% 0.594 0.618 PF00234 C3_S13 - (0)- - / - / 3 -
214330_tI_POPTR8 60% 0.599 0.618 PF00234 C4_S12 - (0)- - / - / 2 -
215375_tI_SOLCI8 74% 0.625 0.618 PF00234 C3_S14 - (0)- - / 2 / 2 -
216666_tIV_BRADI11 44% 0.575 0.617 PF00234 0 - (0)- - / - / - -
217027_tI_WHEAT9 59% 0.550 0.616 PF00234 C2_S13 - (0)- - / - / 3 -
218023_tI_WHEAT9 67% 0.590 0.615 PF00234 C3_S13 - (0)- - / 1 / 2 -
219128_tII_ARATH12 38% 0.612 0.615 PF00234 0 - (0)- - / - / - -
220711_t0_SELMO19 40% 0.589 0.615 PF00234 0 - (0)- - / - / - -
221124_tII_ORYSA12 54% 0.614 0.615 PF00234 C4_S11 - (0)- - / - / 1 -
222557_tIII_LILLO20 35% 0.635 0.615 PF00234 0 - (0)- - / - / - -
223057_tI_WHEAT8 51% 0.615 0.615 PF00234 C2_S12 - (0)- - / - / 2 -
224034_tI_WHEAT8 62% 0.551 0.615 PF00234 C3_S13 - (0)- - / - / 3 -
225788_tI_MEDTR8 50% 0.612 0.615 PF00234 C2_S11 - (0)- - / - / 1 -
226323_tI_PLAAC10 63% 0.638 0.615 PF00234 C2_S14 - (0)- - / 1 / 3 -
227794_tII_ARATH6 33% 0.577 0.614 PF14368 0 - (0)- - / - / - -
228621_tIV_THECC13 47% 0.565 0.614 PF00234 C3_S12 - (0)- - / - / 2 -
229257_tI_GYMCO9 60% 0.588 0.614 PF00234 C2_S13 - (0)- - / - / 3 -
230090_tII_WHEAT12 78% 0.572 0.614 PF00234 C3_S11 - (0)- - / 1 / - -
231018_tI_WHEAT10 68% 0.613 0.613 PF00234 C5_S13 - (0)- - / 1 / 1 -
232007_tI_WHEAT11 71% 0.630 0.612 PF00234 C4_S13 - (0)- - / 1 / 2 -
233216_tI_BRANA8 56% 0.583 0.612 PF00234 C2_S12 - (0)- - / - / 2 -
234430_tI_ZEAMP8 86% 0.591 0.612 PF00234 C2_S14 - (0)- - / 2 / 2 -
235559_tIII_LILLO20 38% 0.605 0.612 PF00234 0 - (0)- - / - / - -
236532_tII_MAIZE12 38% 0.591 0.611 PF00234 0 - (0)- - / - / - -
237423_tI_MAIZE10 41% 0.593 0.611 PF00234 0 - (0)- - / - / - -
238010_tI_WHEAT9 70% 0.627 0.611 PF00234 C6_S13 - (0)- - / 1 / 1 -
239025_tI_WHEAT9 64% 0.611 0.611 PF00234 C4_S13 - (0)- - / 1 / 2 -
240102_tII_WHEAT12 54% 0.611 0.611 PF00234 0 - (0)- - / - / - -
241551_tIII_SILLA19 39% 0.589 0.611 PF00234 0 - (0)- - / - / - -
242396_tI_VITAE9 63% 0.606 0.611 PF00234 C3_S13 - (0)- - / - / 3 -
243049_tI_WHEAT8 60% 0.608 0.610 PF00234 C2_S12 - (0)- - / - / 1 -
244324_tI_PLAOI8 64% 0.634 0.610 PF00234 C3_S14 - (0)- - / 1 / 3 -
245093_tII_WHEAT12 75% 0.586 0.610 PF00234 C1_S11 - (0)- - / 1 / - -
246269_tI_HORVU10 67% 0.610 0.610 PF00234 C5_S13 - (0)- - / 1 / 1 -
247489_tVI_RICCO9 29% 0.621 0.609 PF00234 0 - (0)- - / - / - -
248399_tI_VITSX10 60% 0.624 0.608 PF00234 C2_S12 - (0)- - / - / 2 -
249085_tII_WHEAT12 100% 0.573 0.608 PF00234 C4_S11 - (0)- - / - / 1 -
250784_tI_MEDTR10 44% 0.621 0.607 PF00234 1 - (0)- - / - / - -

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