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]
100spr133320 99% 0.54 PF01522 15 - (0)2 - / - / - 0
101spr024717 99% 0.49 PF02922 C2_S115 - (0)3 - / - / 4 1
102spr182521 99% 0.47 PF00044 C6_S17 - (0)1 - / 1 / - 1
103spr126419 99% 0.69 PF13344 C1_S114 - (0)2 - / - / 2 0
104spr195220 99% 0.59 PF01204 C3_S132 - (0)10 - / 1 / 8 4
105spr196913 99% 0.63 PF14805 11 - (8)? - / - / - 0
106spr032920 99% 0.53 PF00905 C1_S127 - (0)7 - / - / 6 3
107spr016820 99% 0.65 PF02016 C2_S134 - (0)3 - / - / 3 1
108spr077620 99% 0.56 PF00768 C1_S132 - (0)7 - / - / 2 0
109spr169017 99% 0.60 PF00069 6 - (0)? - / - / - 0
110spr025410 99% 0.61 PF00905 C2_S19 - (0)4 - / - / 3 1
111spr037920 99% 0.63 PF03060 C6_S161 - (42)4 - / 7 / - 2
112spr058314 99% 0.44 PF01183 C4_S118 - (0)? - / - / 1 0
113spr182946 99% 0.62 PF02749 C6_S146 - (27)11 - / - / 17 3
114spr143820 99% 0.53 PF00857 C4_S132 - (0)4 - / - / 5 1
115spr038223 99% 0.87 PF02801 C2_S145 - (2)7 - / - / 7 0
116spr065619 99% 0.49 PF00574 43 - (0)1 - / - / - 0
117spr031418 99% 0.55 PF03816 C2_S116 - (0)4 - / 3 / 5 3
118spr135320 99% 0.56 PF00497 C3_S142 - (0)1 - / - / 2 1
119spr171220 99% 0.52 PF03567 C1_S132 - (0)2 - / 2 / - 1
120spr169416 99% 0.57 PF12850 C4_S12 - (0)1 - / - / 2 1
121spr004535 99% 0.46 PF01259 C2_S162 - (48)13 - / 17 / 15 9
122spr154120 99% 0.57 PF01648 C5_S139 - (26)4 - / - / 7 1
123spr112012 99% 0.59 PF00497 C1_S119 - (0)2 - / - / 2 1
124spr037735 99% 0.52 PF08541 C2_S167 - (36)20 3 / 17 / 4 9
125spr034121 99% 0.54 PF01070 C4_S142 - (30)3 2 / 3 / - 2
126spr050625 99% 0.56 PF00232 C1_S151 - (40)11 - / 1 / 7 4
127spr196520 99% 0.65 -C2_S129 - (0)4 - / - / 2 1
128spr140920 99% 0.57 PF02798 C1_S18 - (0)2 - / - / 1 0
129spr12309 99% 0.66 PF06133 0 - (0)? - / - / - 0
130spr194921 99% 0.54 PF04650 C5_S157 - (11)8 - / - / 9 3
131spr200513 99% 0.57 PF01910 3 - (0)? - / - / - 0
132spr19708 99% 0.65 PF03830 5 - (0)? - / - / - 0
133spr023523 99% 0.45 PF13603 C1_S117 - (0)4 - / 3 / 2 1
134spr146314 99% 0.56 PF08704 3 - (0)? - / - / - 0
135spr083918 99% 0.58 PF05163 C6_S116 - (0)4 - / - / 2 1
136spr111015 99% 0.60 PF02441 27 - (17)1 - / - / - 0
137spr146818 99% 0.59 PF13460 36 - (25)? - / - / - 0
138spr177912 99% 0.49 PF01223 6 - (0)? - / - / - 0
139spr189512 99% 0.53 PF12849 C4_S17 - (0)1 - / - / 3 1
140spr101311 99% 0.68 PF00022 3 - (0)2 - / - / - 0
141spr095218 99% 0.59 PF06414 C5_S130 - (22)1 - / - / 1 0
142spr098922 99% 0.56 PF00275 C8_S127 - (12)8 - / 4 / 4 3
143spr169114 99% 0.45 PF02616 2 - (0)? - / - / - 0
144spr053917 99% 0.69 PF00756 C1_S124 - (0)1 - / - / 1 0
145spr090420 99% 0.77 PF00578 C1_S133 - (0)5 - / - / 5 1
146spr153145 99% 0.56 PF02973 C2_S166 - (25)20 - / 6 / 34 23
147spr204521 99% 0.57 PF13180 C1_S14 - (0)2 - / - / 2 0
148spr01744 99% 0.42 PF06998 0 - (0)? - / - / - 0
149spr064315 99% 0.72 PF00903 23 - (0)? - / - / - 0
150spr204111 99% 0.07 PF00072 46 - (0)? - / - / - 0

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