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]
100spr169416 99% 0.57 PF12850 C4_S12 - (0)1 - / - / 2 1
101spr196520 99% 0.65 -C2_S129 - (0)4 - / - / 2 1
102spr154120 99% 0.57 PF01648 C5_S139 - (26)4 - / - / 7 1
103spr169114 99% 0.45 PF02616 2 - (0)? - / - / - 0
104spr171220 99% 0.52 PF03567 C1_S132 - (0)2 - / 2 / - 1
105spr005920 99% 0.57 PF01301 74 - (0)1 - / - / - 0
106spr133320 99% 0.54 PF01522 15 - (0)2 - / - / - 0
107spr098922 99% 0.56 PF00275 C8_S127 - (12)8 - / 4 / 4 3
108spr197918 99% 0.51 PF13472 7 - (0)? - / - / - 0
109spr095218 99% 0.59 PF06414 C5_S130 - (22)1 - / - / 1 0
110spr005724 99% 0.61 PF04650 C3_S140 - (8)11 - / 3 / 7 4
111spr146314 99% 0.56 PF08704 3 - (0)? - / - / - 0
112spr111015 99% 0.60 PF02441 27 - (17)1 - / - / - 0
113spr01744 99% 0.42 PF06998 0 - (0)? - / - / - 0
114spr097520 99% 0.58 PF00356 C3_S119 - (0)2 - / - / 3 1
115spr112012 99% 0.59 PF00497 C1_S119 - (0)2 - / - / 2 1
116spr177912 99% 0.49 PF01223 6 - (0)? - / - / - 0
117spr012212 99% 0.60 PF00764 C1_S124 - (15)2 - / - / 2 1
118spr077620 99% 0.56 PF00768 C1_S132 - (0)7 - / - / 2 0
119spr037920 99% 0.63 PF03060 C6_S161 - (42)4 - / 7 / - 2
120spr064315 99% 0.72 PF00903 23 - (0)? - / - / - 0
121spr19708 99% 0.65 PF03830 5 - (0)? - / - / - 0
122spr016820 99% 0.65 PF02016 C2_S134 - (0)3 - / - / 3 1
123spr204111 99% 0.07 PF00072 46 - (0)? - / - / - 0
124spr023523 99% 0.45 PF13603 C1_S117 - (0)4 - / 3 / 2 1
125spr004535 99% 0.46 PF01259 C2_S162 - (48)13 - / 17 / 15 9
126spr090420 99% 0.77 PF00578 C1_S133 - (0)5 - / - / 5 1
127spr101311 99% 0.68 PF00022 3 - (0)2 - / - / - 0
128spr031418 99% 0.55 PF03816 C2_S116 - (0)4 - / 3 / 5 3
129spr071417 99% 0.63 PF13419 13 - (0)? - / - / - 0
130spr038223 99% 0.87 PF02801 C2_S145 - (2)7 - / - / 7 0
131spr037735 99% 0.52 PF08541 C2_S167 - (36)20 3 / 17 / 4 9
132spr028914 99% 0.54 PF02502 C1_S120 - (9)2 - / - / 1 1
133spr153145 99% 0.56 PF02973 C2_S166 - (25)20 - / 6 / 34 23
134spr065619 99% 0.49 PF00574 43 - (0)1 - / - / - 0
135spr053917 99% 0.69 PF00756 C1_S124 - (0)1 - / - / 1 0
136spr083918 99% 0.58 PF05163 C6_S116 - (0)4 - / - / 2 1
137spr169017 99% 0.60 PF00069 6 - (0)? - / - / - 0
138spr050625 99% 0.56 PF00232 C1_S151 - (40)11 - / 1 / 7 4
139spr182521 99% 0.47 PF00044 C6_S17 - (0)1 - / 1 / - 1
140spr004920 99% 0.66 PF00551 C4_S1162 - (29)6 - / - / 3 0
141spr140920 99% 0.57 PF02798 C1_S18 - (0)2 - / - / 1 0
142spr200513 99% 0.57 PF01910 3 - (0)? - / - / - 0
143spr024717 99% 0.49 PF02922 C2_S115 - (0)3 - / - / 4 1
144spr204521 99% 0.57 PF13180 C1_S14 - (0)2 - / - / 2 0
145spr182946 99% 0.62 PF02749 C6_S146 - (27)11 - / - / 17 3
146spr034121 99% 0.54 PF01070 C4_S142 - (30)3 2 / 3 / - 2
147spr196913 99% 0.63 PF14805 11 - (8)? - / - / - 0
148spr189512 99% 0.53 PF12849 C4_S17 - (0)1 - / - / 3 1
149spr014820 99% 0.60 PF01546 C1_S121 - (2)2 - / - / 1 0
150spr12309 99% 0.66 PF06133 0 - (0)? - / - / - 0

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