Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000000751 (Staphylococcus - Mars 2016)

Download : Data.csv | 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]
50SA005712 41% 0.501 PF00239 13 - (0)? - / - / - 0
51SA00589 30% 0.309 PF00239 18 - (0)? - / - / - 0
52SA00590 29% 0.322 PF05496 6 - (6)? - / - / - 0
53SA00600 41% 0.710 PF00071 13 - (0)? - / - / - 0
54SA00610 29% 0.199 PF00603 9 - (0)? - / - / - 0
55SA00625 22% 0.370 PF00098 3 - (0)? - / - / - 0
56SA006310 33% 0.683 PF00067 9 - (0)? - / - / - 0
57SA006414 59% 0.340 PF01498 12 - (0)? - / - / - 0
58SA00650 28% -0.061 PF00223 10 - (0)? - / - / - 0
59SA006612 46% 0.581 PF00486 4 - (0)1 - / - / - 0
60SA006711 28% 0.516 PF00512 24 - (20)? - / - / - 0
61SA00682 27% 0.332 PF02386 1 - (0)? - / - / - 0
62SA007019 46% 0.341 PF00702 8 - (0)1 - / - / - 0
63SA00710 30% 0.234 PF00149 2 - (2)? - / - / - 0
64SA00720 36% 0.136 PF01399 2 - (0)? - / - / - 0
65SA00739 37% 0.279 PF03193 13 - (12)? - / - / - 0
66SA0073_11 25% 0.452 PF11426 0 - (0)? - / - / - 0
67SA00740 42% 0.329 PF00069 0 - (0)? - / - / - 0
68SA00750 41% 0.368 PF02807 2 - (0)? - / - / - 0
69SA00760 34% 0.186 PF01152 1 - (0)? - / - / - 0
70SA007718 37% 0.320 PF00069 24 - (12)? - / - / - 0
71SA00780 28% 0.176 PF08512 3 - (0)? - / - / - 0
72SA00797 48% 0.441 PF01207 21 - (15)? - / - / - 0
73SA00800 45% 0.185 PF05371 5 - (0)? - / - / - 0
74SA00814 37% 0.497 PF08543 2 - (1)? - / - / - 0
75SA00826 41% 0.320 PF00581 13 - (0)1 - / - / - 0
76SA008317 75% 0.496 PF00753 C1_S113 - (6)1 - / - / 1 0
77SA008417 70% 0.394 PF07992 79 - (54)? - / - / - 0
78SA008519 35% 0.540 PF01207 C4_S130 - (19)2 1 / - / 1 1
79SA00860 33% 0.637 PF02038 1 - (0)? - / - / - 0
80SA00874 26% 0.436 PF01392 3 - (0)? - / - / - 0
81SA00880 24% 0.303 PF08441 0 - (0)? - / - / - 0
82SA00899 63% 0.200 PF09416 C3_S13 - (0)2 - / - / 2 0
83SA00900 30% 0.326 PF13520 3 - (0)? - / - / - 0
84SA009122 97% 0.487 PF00388 C5_S117 - (11)3 - / - / 8 2
85SA00925 75% 0.622 PF04507 0 - (0)? - / - / - 0
86SA00935 74% 0.620 PF04507 2 - (0)? - / - / - 0
87SA00945 76% 0.654 PF04507 0 - (0)? - / - / - 0
88SA00955 79% 0.619 PF04507 0 - (0)? - / - / - 0
89SA00965 73% 0.630 PF04507 0 - (0)? - / - / - 0
90SA00978 36% 0.400 PF01229 12 - (6)? - / - / - 0
91SA009820 98% 0.606 PF01546 6 - (0)? - / - / - 0
92SA009910 38% 0.305 PF07690 10 - (0)? - / - / - 0
93SA010012 25% 0.514 PF01895 0 - (0)? - / - / - 0
94SA01010 40% 0.338 PF10185 4 - (2)? - / - / - 0
95SA010216 61% 0.484 PF01593 29 - (18)1 - / - / - 0
96SA01030 33% 0.196 PF03911 0 - (0)? - / - / - 0
97SA010420 28% 0.526 PF00155 C1_S142 - (22)2 - / - / 2 1
98SA01050 26% 0.072 PF08671 2 - (2)? - / - / - 0
99SA01060 27% 0.143 PF01030 10 - (0)? - / - / - 0
100SA010719 100% 0.831 PF04650 1 - (0)? - / - / - 0

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