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]
150spr060219 37% 0.55 PF00005 C1_S144 - (0)11 - / 2 / 10 1
151spr050732 73% 0.50 PF01409 C2_S127 - (14)11 2 / 4 / 8 9
152spr109524 44% 0.58 PF01053 C1_S134 - (27)11 - / - / 7 2
153spr000529 64% 0.53 PF01195 C6_S120 - (0)11 - / 1 / 8 4
154spr203420 56% 0.56 PF00579 C4_S142 - (33)11 - / - / 9 2
155spr053024 49% 0.70 PF01116 C1_S129 - (21)11 - / - / 15 3
156spr005724 99% 0.61 PF04650 C3_S140 - (8)11 - / 3 / 7 4
157spr027622 86% 0.56 PF00232 C1_S183 - (57)11 - / 1 / 6 3
158spr040325 62% 0.51 PF07991 C3_S135 - (0)11 5 / 6 / 8 3
159spr175746 65% 0.53 PF00154 C2_S144 - (0)11 - / 22 / 6 5
160spr022227 40% 0.49 PF08402 C1_S133 - (0)11 - / 11 / 5 2
161spr178321 42% 0.62 PF01467 C1_S1142 - (74)11 - / 2 / 4 1
162spr146048 58% 0.65 PF16363 C1_S1122 - (110)10 46 / 6 / - 2
163spr075761 100% 0.54 PF00521 C6_S1111 - (0)10 - / 3 / 43 1
164spr051522 34% 0.55 PF02219 C7_S171 - (57)10 2 / - / 6 0
165spr142532 85% 0.53 PF01042 C5_S138 - (0)10 - / - / 14 1
166spr189421 35% ? PF00512 C2_S142 - (40)10 3 / 14 / - 2
167spr013119 44% 0.56 PF00814 C2_S136 - (28)10 - / 9 / 4 4
168spr163425 42% 0.49 PF00218 C6_S127 - (7)10 - / 6 / 5 4
169spr053628 48% 0.41 PF00005 C1_S160 - (0)10 - / 9 / 8 5
170spr195220 99% 0.59 PF01204 C3_S132 - (0)10 - / 1 / 8 4
171spr078328 40% 0.53 PF00266 C1_S152 - (0)10 - / - / 22 1
172spr126020 43% 0.61 PF00459 C5_S127 - (21)10 - / - / 6 2
173spr070620 34% 0.48 PF01433 C2_S125 - (0)10 - / - / 8 0
174spr016113 54% 0.57 PF00885 C5_S175 - (59)10 - / - / 1 0
175spr102520 36% 0.40 PF02922 C1_S134 - (0)10 - / 1 / 8 3
176spr131222 72% 0.53 PF07992 C1_S1154 - (141)10 15 / 5 / 2 1
177spr149719 42% 0.54 PF00005 C1_S157 - (53)10 - / 4 / 6 2
178spr202630 55% ? PF00005 C1_S153 - (0)10 - / 9 / 4 4
179spr110627 69% ? PF00512 C2_S142 - (37)10 6 / 13 / - 4
180spr024531 59% 0.53 PF01380 C2_S116 - (14)10 - / - / 12 5
181spr064619 67% 0.37 PF00232 C8_S176 - (51)10 - / - / 2 1
182spr026224 67% 0.60 PF00107 C1_S154 - (32)10 1 / 1 / 3 0
183spr107419 63% 0.57 PF00294 C1_S141 - (36)10 - / 4 / 5 2
184spr151065 67% 0.66 PF00091 C3_S168 - (0)10 - / 17 / 36 5
185spr164747 60% 0.62 PF16363 C1_S1132 - (118)10 46 / 5 / - 2
186spr169663 73% 0.63 PF01177 C2_S161 - (50)10 - / 1 / 49 4
187spr149120 34% 0.47 PF05649 C6_S123 - (0)10 - / 3 / 8 1
188spr063829 50% 0.57 PF08543 C1_S170 - (57)10 - / 2 / 7 1
189spr033530 73% 0.61 PF03446 C2_S134 - (20)10 - / 3 / 10 4
190spr165419 35% 0.52 PF01041 C1_S150 - (21)10 - / 1 / 7 2
191spr030419 100% ? PF00905 C1_S122 - (0)9 - / 1 / 8 3
192spr032112 89% 0.51 PF00908 C3_S154 - (30)9 - / 3 / 9 3
193spr014921 46% 0.51 PF00005 C1_S158 - (0)9 - / 3 / 8 1
194spr003292 51% 0.59 PF00476 C3_S1235 - (173)9 68 / 8 / 10 1
195spr121921 43% 0.54 PF03447 C2_S139 - (19)9 - / - / 6 1
196spr171520 32% 0.54 PF08279 C4_S130 - (22)9 5 / 1 / 3 0
197spr168720 98% 0.60 PF01497 C2_S136 - (0)9 - / 3 / 5 1
198spr190324 47% 0.55 PF00483 C1_S144 - (33)9 - / 11 / 5 3
199spr191035 59% 0.58 PF00579 C3_S136 - (26)9 - / 12 / 8 4
200spr139725 44% 0.46 PF01336 C8_S187 - (49)9 - / 12 / - 5

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