Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000000586 (2017 - Streptococcus pneumoniae - STRR6: Streptococcus pneumoniae (strain ATCC BAA-255 / R6))

Download : Data.csv | 3D Common Core | 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]
200spr202543 56% 0.59 PF00005 C1_S155 - (0)14 - / 1 / 23 5
201spr067620 38% 0.54 PF04055 C3_S155 - (4)4 - / - / 6 1
202spr164424 56% 0.56 PF08402 C1_S155 - (0)15 - / 7 / 8 3
203spr065537 71% 0.57 PF00156 C3_S155 - (45)13 - / 5 / 22 3
204spr043614 48% 0.52 PF00583 55 - (25)? - / - / - 0
205spr099220 100% 0.58 PF00557 C4_S154 - (0)13 - / 1 / 13 1
206spr032112 89% 0.51 PF00908 C3_S154 - (30)9 - / 3 / 9 3
207spr072931 52% 0.69 PF02882 C5_S154 - (43)16 7 / 11 / 12 5
208spr03452 47% 0.49 PF08614 C1_S154 - (0)2 - / - / 2 0
209spr181320 58% 0.56 PF00356 C2_S154 - (0)2 - / 2 / 7 0
210spr010621 44% ? PF00005 C2_S154 - (54)12 - / 9 / 2 1
211spr026224 67% 0.60 PF00107 C1_S154 - (32)10 1 / 1 / 3 0
212spr051813 42% 0.47 PF00583 53 - (25)? - / - / - 0
213spr039422 57% 0.51 PF01425 C6_S153 - (0)5 - / - / 6 2
214spr202630 55% ? PF00005 C1_S153 - (0)10 - / 9 / 4 4
215spr096619 32% 0.42 PF13193 C3_S153 - (18)3 - / 1 / 2 0
216spr195744 73% 0.71 PF02729 C7_S152 - (42)16 - / 7 / 23 5
217spr078328 40% 0.53 PF00266 C1_S152 - (0)10 - / - / 22 1
218spr124647 50% 0.55 PF00005 C2_S152 - (0)14 - / 8 / 11 6
219spr12370 40% 0.19 PF00005 52 - (0)? - / - / - 0
220spr016420 47% 0.53 PF01872 C4_S152 - (0)2 - / - / 2 0
221spr034723 49% 0.57 PF12348 C2_S152 - (48)2 - / - / 21 0
222spr092712 48% 0.64 PF00583 52 - (30)0 - / - / - 0
223spr188714 39% ? PF00005 C2_S152 - (50)5 - / 3 / 2 0
224spr052526 40% 0.59 PF00005 C1_S152 - (0)13 - / 2 / 17 4
225spr038422 54% 0.55 PF07977 C2_S152 - (1)16 - / - / 12 0
226spr039712 39% 0.54 PF01501 C3_S152 - (29)1 - / - / 1 0
227spr19293 39% 0.84 PF01381 C3_S151 - (0)1 - / - / 1 0
228spr032321 80% 0.56 PF01370 C1_S151 - (47)5 3 / 3 / - 1
229spr073145 75% 0.51 PF06026 C9_S151 - (21)18 - / - / 27 6
230spr050625 99% 0.56 PF00232 C1_S151 - (40)11 - / 1 / 7 4
231spr100129 38% 0.56 PF00266 C1_S151 - (0)11 - / - / 25 1
232spr156820 28% 0.42 PF00251 C1_S151 - (26)8 - / - / 5 0
233spr166618 100% 0.49 PF03061 C1_S151 - (0)2 - / - / 13 1
234spr062235 52% 0.62 PF00005 C1_S151 - (0)13 - / 10 / 22 6
235spr063022 41% 0.64 PF02581 C3_S150 - (39)15 - / 10 / 13 3
236spr107520 55% 0.56 PF02502 C11_S150 - (38)9 - / - / 3 1
237spr145914 39% 0.36 PF00535 C2_S150 - (22)2 - / - / 8 1
238spr170321 36% 0.57 PF08402 C1_S150 - (0)16 - / 5 / 8 0
239spr049013 38% 0.59 PF13302 50 - (0)? - / - / - 0
240spr186620 36% 0.56 PF00107 C1_S150 - (30)4 - / 2 / 1 0
241spr165419 35% 0.52 PF01041 C1_S150 - (21)10 - / 1 / 7 2
242spr061019 41% 0.49 PF00005 50 - (0)? - / - / - 0
243spr19044 26% 0.34 PF12122 50 - (0)? - / - / - 0
244spr199020 69% 0.51 PF01266 C3_S150 - (30)3 2 / 1 / 1 1
245spr12695 54% 0.28 PF12950 50 - (17)? - / - / - 0
246spr053820 38% 0.56 PF00753 C1_S149 - (0)1 - / - / 1 0
247spr142618 68% 0.58 PF01926 C1_S149 - (0)4 - / 8 / - 2
248spr109024 51% 0.58 PF00485 C1_S149 - (36)14 5 / 8 / 7 5
249spr153415 33% 0.48 PF01547 49 - (0)? - / - / - 0
250spr093417 100% 0.65 PF01497 C2_S149 - (0)6 3 / 2 / 2 2

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