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]
200spr154324 39% 0.49 PF00793 C5_S116 - (16)6 - / - / 6 2
201spr109024 51% 0.58 PF00485 C1_S149 - (36)14 5 / 8 / 7 5
202spr053024 49% 0.70 PF01116 C1_S129 - (21)11 - / - / 15 3
203spr050923 45% 0.51 PF01588 C1_S14 - (3)4 - / 1 / 2 3
204spr010223 51% 0.45 PF00764 C3_S121 - (18)8 - / - / 5 2
205spr016623 47% 0.59 PF03352 C4_S131 - (0)6 - / - / 14 1
206spr030723 53% 0.51 PF10431 C2_S118 - (0)6 - / 6 / 8 3
207spr161723 32% 0.41 PF00251 C3_S147 - (0)5 - / - / 6 1
208spr076923 48% 0.61 PF12170 C4_S136 - (0)2 - / - / 1 0
209spr188523 52% 0.43 PF00005 C1_S165 - (63)12 - / 8 / 2 2
210spr034423 74% 0.62 PF00072 C2_S124 - (0)3 - / - / 4 1
211spr149223 34% 0.55 PF00005 C1_S122 - (0)8 - / 3 / 6 2
212spr129323 34% 0.41 PF00005 C2_S121 - (0)6 - / 2 / 4 2
213spr145023 44% 0.53 PF08543 C3_S195 - (68)8 - / 13 / 2 2
214spr123123 69% 0.54 PF03201 C2_S146 - (0)6 - / 3 / 6 2
215spr023523 99% 0.45 PF13603 C1_S117 - (0)4 - / 3 / 2 1
216spr038223 99% 0.87 PF02801 C2_S145 - (2)7 - / - / 7 0
217spr125423 34% 0.47 PF00005 C1_S129 - (0)12 - / 7 / 7 5
218spr163123 98% 0.73 PF00290 C3_S157 - (23)20 - / 3 / 14 2
219spr034723 49% 0.57 PF12348 C2_S152 - (48)2 - / - / 21 0
220spr028622 100% 0.77 PF08124 C1_S133 - (0)9 1 / 1 / 11 4
221spr172522 42% 0.41 PF00106 C1_S1116 - (80)11 8 / - / 4 2
222spr040622 42% 0.43 PF00291 C3_S130 - (29)6 - / 3 / 10 1
223spr079322 49% 0.48 PF02863 C7_S194 - (0)5 - / - / 2 0
224spr199422 41% 0.55 PF01207 C2_S147 - (36)3 5 / 2 / - 1
225spr087122 47% 0.62 PF01926 C2_S130 - (0)4 5 / 7 / 1 2
226spr007122 35% 0.61 PF02254 58 - (0)0 - / - / - 0
227spr062922 43% 0.60 PF02110 C5_S124 - (20)4 - / - / 5 1
228spr118122 61% ? PF02812 C8_S17 - (5)1 - / - / 3 1
229spr098922 99% 0.56 PF00275 C8_S127 - (12)8 - / 4 / 4 3
230spr063022 41% 0.64 PF02581 C3_S150 - (39)15 - / 10 / 13 3
231spr061322 57% 0.65 PF00215 C2_S132 - (25)9 - / 13 / 2 3
232spr165722 44% 0.45 PF00005 C2_S164 - (62)7 - / 3 / 3 0
233spr023322 38% 0.52 PF00923 31 - (0)4 - / - / - 0
234spr192422 54% ? PF01336 C7_S133 - (22)6 - / 5 / 6 2
235spr131222 72% 0.53 PF07992 C1_S1154 - (141)10 15 / 5 / 2 1
236spr104822 41% 0.51 PF02852 C2_S162 - (54)7 3 / 1 / 2 1
237spr183322 53% 0.54 PF00232 C2_S189 - (65)20 - / - / 18 1
238spr024422 47% 0.53 PF00232 C2_S190 - (67)20 - / - / 19 2
239spr051522 34% 0.55 PF02219 C7_S171 - (57)10 2 / - / 6 0
240spr104722 98% 0.55 PF10437 C4_S137 - (26)14 2 / 7 / 7 3
241spr039422 57% 0.51 PF01425 C6_S153 - (0)5 - / - / 6 2
242spr085222 49% 0.27 PF05222 C3_S118 - (17)7 - / - / 1 0
243spr189022 41% 0.57 PF00750 C1_S120 - (9)2 - / - / 4 1
244spr043022 35% 0.41 PF08402 C2_S115 - (0)6 - / 2 / 4 2
245spr026922 40% 0.56 PF01288 C5_S1145 - (62)20 - / 8 / 13 1
246spr027622 86% 0.56 PF00232 C1_S183 - (57)11 - / 1 / 6 3
247spr038422 54% 0.55 PF07977 C2_S152 - (1)16 - / - / 12 0
248spr057722 62% 0.51 PF01641 C2_S110 - (0)5 - / - / 2 1
249spr141422 47% 0.56 PF01113 C1_S135 - (23)8 8 / 1 / - 3
250spr085322 54% 0.50 PF05222 C4_S139 - (33)4 - / - / 3 2

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