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]
300497_tIV_RICCO14 48% 0.559 0.515 PF00234 C3_S11 - (0)- - / - / 1 -
301496_tIV_RICCO15 48% 0.562 0.502 PF00234 C1_S11 - (0)- - / - / 1 -
302495_tII_RICCO11 33% 0.412 0.429 PF00234 0 - (0)- - / - / - -
303494_tIV_RICCO11 48% 0.504 0.581 PF00234 C3_S12 - (0)- - / - / 2 -
304493_tVI_RICCO9 32% 0.513 0.527 PF00234 0 - (0)- - / - / - -
305492_tVI_RICCO11 28% 0.391 0.391 PF00234 0 - (0)- - / - / - -
306491_tIV_RICCO13 41% 0.503 0.517 PF00234 0 - (0)- - / - / - -
307490_tVI_RICCO10 28% 0.438 0.463 PF00234 0 - (0)- - / - / - -
308489_tVI_RICCO9 29% 0.621 0.609 PF00234 0 - (0)- - / - / - -
309488_tVI_RICCO9 31% 0.580 0.566 PF00234 0 - (0)- - / - / - -
310487_tVI_POPTR11 30% 0.370 0.457 PF00234 0 - (0)- - / - / - -
311486_tIV_POPTR13 50% 0.471 0.459 PF00234 C1_S12 - (0)- - / - / 2 -
312485_tXI_POPTR15 34% 0.493 0.423 PF00234 0 - (0)- - / - / - -
313484_tIV_POPTR15 41% 0.503 0.496 PF00234 0 - (0)- - / - / - -
314483_tVI_POPTR9 30% 0.584 0.585 PF00234 0 - (0)- - / - / - -
315482_tVI_POPTR11 33% 0.423 0.455 PF00234 0 - (0)- - / - / - -
316481_tVI_POPTR9 33% 0.401 0.394 PF00234 0 - (0)- - / - / - -
317480_tXI_POPTR13 34% 0.542 0.545 PF00234 0 - (0)- - / - / - -
318479_tXI_POPTR11 30% 0.400 0.410 PF00234 0 - (0)- - / - / - -
319478_tXI_POPTR9 33% 0.519 0.557 PF00234 0 - (0)- - / - / - -
320477_tVI_POPTR10 26% 0.582 0.581 PF00234 0 - (0)- - / - / - -
321476_tVI_POPTR8 31% 0.472 0.472 PF00234 0 - (0)- - / - / - -
322475_tV_PICSI9 33% 0.440 0.435 PF00234 0 - (0)- - / - / - -
323474_tIV_PICSI11 40% 0.497 0.476 PF00234 0 - (0)- - / - / - -
324473_tIX_PHYPA10 36% 0.548 0.549 PF00234 0 - (0)- - / - / - -
325472_t0_PHYPA12 34% 0.471 0.486 PF00234 0 - (0)- - / - / - -
326471_tIV_POPTR10 50% 0.464 0.479 PF00234 C3_S12 - (0)- - / - / 2 -
327470_tIV_POPTR16 50% 0.468 0.482 PF00234 C2_S12 - (0)- - / - / 2 -
328469_tVI_PICSI12 34% 0.603 0.607 PF00234 0 - (0)- - / - / - -
329468_tIV_PICSI15 43% 0.445 0.515 PF00234 C4_S11 - (0)- - / 1 / - -
330467_tIV_VITVI13 55% 0.540 0.541 PF00234 C4_S12 - (0)- - / - / 2 -
331466_tVI_VITVI11 27% 0.369 0.351 PF00234 0 - (0)- - / - / - -
332465_tIV_VITVI14 49% 0.667 0.669 PF00234 C3_S11 - (0)- - / - / 1 -
333464_tVI_VITVI12 28% 0.403 0.364 PF00234 0 - (0)- - / - / - -
334463_tVI_VITVI10 28% 0.355 0.390 PF00234 0 - (0)- - / - / - -
335462_tV_SONAL10 32% 0.569 0.566 PF00234 0 - (0)- - / - / - -
336461_tV_PICSI10 32% 0.418 0.462 PF00234 0 - (0)- - / - / - -
337460_tV_PICSI9 33% 0.514 0.504 PF00234 0 - (0)- - / - / - -
338459_tV_PICSI8 34% 0.417 0.463 PF00234 0 - (0)- - / - / - -
339458_tII_ZINEL12 45% 0.623 0.718 PF00234 0 - (0)- - / - / - -
340457_tII_MAIZE12 48% 0.624 0.625 PF14368 C2_S11 - (0)- - / - / 1 -
341456_tII_MAIZE12 53% 0.714 0.714 PF00234 0 - (0)- - / - / - -
342455_tII_MAIZE12 50% 0.660 0.660 PF00234 0 - (0)- - / - / - -
343454_tII_MAIZE13 42% 0.784 0.762 PF14368 0 - (0)- - / - / - -
344453_tII_MAIZE12 38% 0.511 0.664 PF14368 0 - (0)- - / - / - -
345452_tII_MAIZE12 64% 0.598 0.664 PF00234 C3_S11 - (0)- - / 1 / - -
346451_tII_MAIZE12 68% 0.688 0.689 PF00234 C1_S11 - (0)- - / 1 / - -
347450_tII_MAIZE12 53% 0.495 0.477 PF14368 0 - (0)- - / - / - -
348449_tII_MAIZE13 53% 0.645 0.603 PF14368 0 - (0)- - / - / - -
349448_tII_VIGUN12 44% 0.557 0.560 PF00234 0 - (0)- - / - / - -
350447_tII_TAMAN12 46% 0.674 0.675 PF00234 0 - (0)- - / - / - -

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