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]
100spr062235 52% 0.62 PF00005 C1_S151 - (0)13 - / 10 / 22 6
101spr037735 99% 0.52 PF08541 C2_S167 - (36)20 3 / 17 / 4 9
102spr040835 56% 0.60 PF00005 C1_S161 - (0)14 - / 16 / 17 5
103spr112134 64% 0.63 PF00005 C1_S157 - (0)14 - / 13 / 10 5
104spr102434 100% 0.52 PF03119 C7_S158 - (27)20 2 / 16 / 18 14
105spr133234 52% 0.66 PF00248 C8_S1187 - (107)19 14 / - / 3 4
106spr069434 53% 0.55 PF00005 C1_S157 - (0)12 - / 9 / 12 5
107spr159233 47% 0.66 PF01467 C2_S183 - (54)18 10 / 9 / 7 5
108spr062633 62% 0.55 PF01336 C6_S139 - (23)12 - / 8 / 7 5
109spr077333 61% 0.62 PF00266 C2_S168 - (47)12 - / - / 31 0
110spr067033 53% 0.56 PF00271 C3_S145 - (0)12 2 / 6 / 13 3
111spr122833 40% 0.60 PF01202 C2_S177 - (64)13 - / 2 / 18 4
112spr185432 51% 0.53 PF00871 C7_S159 - (50)20 2 / 11 / 14 12
113spr125332 37% 0.53 PF00005 C1_S164 - (61)12 - / 8 / 14 4
114spr050732 73% 0.50 PF01409 C2_S127 - (14)11 2 / 4 / 8 9
115spr142532 85% 0.53 PF01042 C5_S138 - (0)10 - / - / 14 1
116spr074632 55% 0.65 PF00383 C3_S143 - (30)14 - / - / 26 5
117spr091832 100% 0.58 PF02774 C3_S166 - (0)9 13 / 11 / 2 3
118spr158332 62% 0.54 PF00625 C4_S143 - (34)14 6 / 11 / 8 5
119spr141332 43% 0.55 PF12627 C4_S128 - (17)8 - / - / 17 3
120spr024531 59% 0.53 PF01380 C2_S116 - (14)10 - / - / 12 5
121spr145631 100% 0.69 PF02224 C3_S138 - (32)13 - / 11 / 15 6
122spr016231 100% 0.56 PF00926 C4_S130 - (0)8 - / - / 19 3
123spr118831 48% 0.54 PF00383 C5_S139 - (28)16 - / - / 28 5
124spr072931 52% 0.69 PF02882 C5_S154 - (43)16 7 / 11 / 12 5
125spr154031 53% 0.62 PF01168 C2_S141 - (25)14 - / 6 / 22 4
126spr137731 43% 0.59 PF01053 C1_S127 - (22)12 - / 2 / 16 6
127spr139930 44% 0.57 PF00155 C1_S141 - (36)6 - / 1 / 23 1
128spr153630 100% 0.58 PF04650 C5_S161 - (27)15 - / 4 / 18 5
129spr202630 55% ? PF00005 C1_S153 - (0)10 - / 9 / 4 4
130spr089130 100% 0.82 PF12804 C2_S178 - (49)12 - / - / 10 2
131spr180130 37% 0.48 PF00005 C1_S165 - (0)14 - / 4 / 11 4
132spr131430 49% 0.50 PF08402 C1_S158 - (0)13 - / 18 / 7 6
133spr033530 73% 0.61 PF03446 C2_S134 - (20)10 - / 3 / 10 4
134spr004330 65% ? PF00005 C2_S158 - (58)11 - / 14 / 1 3
135spr073830 82% 0.54 PF01048 C1_S176 - (54)20 - / - / 24 5
136spr165630 45% 0.44 PF00005 C2_S158 - (56)12 - / 11 / 3 1
137spr063829 50% 0.57 PF08543 C1_S170 - (57)10 - / 2 / 7 1
138spr100129 38% 0.56 PF00266 C1_S151 - (0)11 - / - / 25 1
139spr032229 91% 0.76 PF16363 C1_S172 - (68)4 27 / - / - 1
140spr000529 64% 0.53 PF01195 C6_S120 - (0)11 - / 1 / 8 4
141spr084528 83% 0.61 PF00696 C1_S129 - (18)8 - / 3 / 7 3
142spr064228 69% 0.49 PF02776 C4_S178 - (63)2 5 / 22 / - 1
143spr122928 97% 0.55 PF00275 C7_S123 - (16)7 3 / 2 / 6 3
144spr121728 100% 0.52 PF01641 12 - (1)7 - / - / - 0
145spr053628 48% 0.41 PF00005 C1_S160 - (0)10 - / 9 / 8 5
146spr010028 37% 0.51 PF00005 C1_S143 - (0)13 - / 1 / 18 5
147spr053528 61% 0.50 PF00005 C1_S141 - (0)6 - / - / 7 2
148spr038028 100% 0.62 PF00698 C1_S121 - (11)8 - / - / 9 2
149spr078328 40% 0.53 PF00266 C1_S152 - (0)10 - / - / 22 1
150spr038528 60% 0.53 PF02786 C1_S166 - (32)20 - / 14 / 11 3

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