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]
150spr200016 59% 0.41 PF10431 C3_S117 - (0)6 - / 5 / 9 3
151spr106520 50% 0.46 PF00317 C1_S18 - (8)3 - / - / 5 3
152spr058824 46% 0.49 PF01715 C3_S139 - (11)8 - / - / 8 3
153spr157120 53% 0.50 PF01154 C2_S121 - (13)8 2 / 3 / 3 3
154spr032112 89% 0.51 PF00908 C3_S154 - (30)9 - / 3 / 9 3
155spr127638 76% 0.54 PF02540 C6_S167 - (61)13 - / 16 / 13 3
156spr040325 62% 0.51 PF07991 C3_S135 - (0)11 5 / 6 / 8 3
157spr084528 83% 0.61 PF00696 C1_S129 - (18)8 - / 3 / 7 3
158spr016231 100% 0.56 PF00926 C4_S130 - (0)8 - / - / 19 3
159spr004330 65% ? PF00005 C2_S158 - (58)11 - / 14 / 1 3
160spr000418 57% 0.53 PF07670 C5_S162 - (0)7 - / 5 / 2 3
161spr032920 99% 0.53 PF00905 C1_S127 - (0)7 - / - / 6 3
162spr061322 57% 0.65 PF00215 C2_S132 - (25)9 - / 13 / 2 3
163spr112824 74% 0.56 PF00478 C1_S144 - (27)15 - / 3 / 14 3
164spr050923 45% 0.51 PF01588 C1_S14 - (3)4 - / 1 / 2 3
165spr018311 53% 0.46 PF13597 C3_S19 - (6)3 - / - / 3 3
166spr190324 47% 0.55 PF00483 C1_S144 - (33)9 - / 11 / 5 3
167spr091832 100% 0.58 PF02774 C3_S166 - (0)9 13 / 11 / 2 3
168spr141332 43% 0.55 PF12627 C4_S128 - (17)8 - / - / 17 3
169spr026825 54% ? PF01227 C9_S126 - (0)8 - / - / 23 3
170spr151553 73% 0.61 PF01820 C1_S199 - (73)14 - / 13 / 30 3
171spr122928 97% 0.55 PF00275 C7_S123 - (16)7 3 / 2 / 6 3
172spr027622 86% 0.56 PF00232 C1_S183 - (57)11 - / 1 / 6 3
173spr133627 35% 0.59 PF00271 C2_S144 - (0)13 - / 9 / 10 3
174spr092872 81% 0.59 PF01041 C1_S1105 - (51)15 - / 2 / 58 3
175spr001239 72% 0.49 PF09336 C2_S125 - (0)5 - / 15 / 7 3
176spr196320 46% 0.59 PF00465 C5_S137 - (33)6 3 / 6 / - 2
177spr192422 54% ? PF01336 C7_S133 - (22)6 - / 5 / 6 2
178spr029024 89% 0.56 PF00106 C1_S178 - (51)7 1 / 2 / 6 2
179spr016019 48% 0.53 PF08676 C1_S125 - (0)4 8 / 1 / 1 2
180spr025020 79% 0.52 PF03144 C3_S116 - (0)3 - / 9 / 1 2
181spr129323 34% 0.41 PF00005 C2_S121 - (0)6 - / 2 / 4 2
182spr110921 62% 0.58 PF01268 C6_S136 - (0)7 - / 5 / 7 2
183spr069236 61% 0.57 PF02852 C1_S189 - (72)8 15 / - / 7 2
184spr107419 63% 0.57 PF00294 C1_S141 - (36)10 - / 4 / 5 2
185spr187815 40% 0.54 PF00291 C2_S119 - (9)5 - / - / 7 2
186spr163572 42% 0.55 PF00591 C6_S1114 - (0)20 - / 30 / 28 2
187spr189421 35% ? PF00512 C2_S142 - (40)10 3 / 14 / - 2
188spr159413 58% 0.58 PF01926 C2_S138 - (0)4 - / 3 / 4 2
189spr123447 43% 0.55 PF08501 C5_S181 - (77)13 - / 6 / 29 2
190spr195520 84% 0.46 PF04371 C3_S113 - (9)5 - / - / 6 2
191spr191726 46% 0.54 PF02446 C4_S1106 - (17)12 - / 1 / 8 2
192spr145023 44% 0.53 PF08543 C3_S195 - (68)8 - / 13 / 2 2
193spr126020 43% 0.61 PF00459 C5_S127 - (21)10 - / - / 6 2
194spr039422 57% 0.51 PF01425 C6_S153 - (0)5 - / - / 6 2
195spr004715 60% 0.54 PF00156 C1_S125 - (1)3 - / 1 / 5 2
196spr123123 69% 0.54 PF03201 C2_S146 - (0)6 - / 3 / 6 2
197spr103218 44% 0.52 PF00534 C1_S148 - (21)8 - / 5 / 4 2
198spr029214 75% 0.55 PF07470 C3_S125 - (0)8 - / 1 / 4 2
199spr038028 100% 0.62 PF00698 C1_S121 - (11)8 - / - / 9 2
200spr112612 63% 0.57 PF00005 C2_S122 - (0)3 - / 4 / - 2

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