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]
1SA098220 99% 0.807 -C2_S118 - (1)5 - / - / 6 1
2SA10160 46% 0.240 -8 - (0)? - / - / - 0
3SA15920 17% 0.149 -0 - (0)? - / - / - 0
4SA17404 21% 0.256 -6 - (0)? - / - / - 0
5SA17680 50% 0.353 -0 - (0)? - / - / - 0
6SA196610 28% 0.468 -0 - (0)? - / - / - 0
7SA20106 18% 0.320 -6 - (0)? - / - / - 0
8SA211617 99% 0.526 -3 - (0)? - / - / - 0
9SA217232 37% 0.412 -C15_S123 - (0)4 - / - / 14 2
10SAP0191 31% 0.309 -0 - (0)? - / - / - 0
11SA03290 30% -0.184 -23 - (0)? - / - / - 0
12SA06630 33% 0.157 -27 - (18)? - / - / - 0
13SA07790 22% 0.235 -0 - (0)? - / - / - 0
14SA08860 35% 0.373 -1 - (0)? - / - / - 0
15SA09300 19% 0.490 -2 - (0)? - / - / - 0
16SA24010 35% 0.208 PF00001 0 - (0)? - / - / - 0
17SA01530 34% 0.086 PF00001 6 - (0)? - / - / - 0
18SA05610 37% 0.248 PF00001 6 - (0)? - / - / - 0
19SA16761 37% 0.160 PF00001 18 - (0)? - / - / - 0
20SA23571 31% 0.020 PF00001 15 - (0)? - / - / - 0
21SA18281 31% 0.277 PF00004 3 - (0)? - / - / - 0
22SA230220 37% 0.620 PF00005 7 - (0)? - / - / - 0
23SA165520 56% 0.552 PF00005 C1_S116 - (0)4 - / 3 / - 2
24SA067519 41% 0.491 PF00005 C1_S15 - (0)2 - / - / 2 2
25SA174520 31% 0.572 PF00005 C1_S112 - (0)1 - / 1 / - 1
26SA115620 30% 0.481 PF00005 C1_S16 - (0)3 - / 2 / 1 2
27SA059315 38% 0.436 PF00005 4 - (0)? - / - / - 0
28SA195820 95% 0.547 PF00005 C1_S111 - (0)3 - / - / 3 2
29SA121220 32% 0.477 PF00005 C1_S115 - (0)2 - / - / 1 1
30SA213220 35% 0.475 PF00005 C1_S110 - (0)1 - / - / 1 1
31SA077423 63% 0.596 PF00005 C1_S116 - (0)6 - / 2 / 3 3
32SA185219 32% 0.513 PF00005 C1_S16 - (0)1 - / 1 / - 1
33SA033918 30% 0.570 PF00005 C1_S111 - (0)4 - / 3 / 1 4
34SA03400 35% 0.197 PF00005 0 - (0)? - / - / - 0
35SA18380 38% 0.456 PF00005 1 - (0)? - / - / - 0
36SA122419 34% 0.407 PF00005 C1_S19 - (0)2 - / - / 1 1
37SA168813 42% 0.389 PF00005 26 - (0)? - / - / - 0
38SA121122 31% 0.529 PF00005 C1_S116 - (0)4 - / 1 / 3 2
39SA092826 41% 0.348 PF00005 C1_S118 - (0)5 - / - / 10 3
40SA084731 40% 0.482 PF00005 C1_S129 - (0)10 - / 3 / 14 5
41SA107712 73% 0.600 PF00005 4 - (0)? - / - / - 0
42SA058920 32% 0.519 PF00005 C1_S115 - (0)3 - / - / 3 2
43SA09072 99% 0.467 PF00005 2 - (0)? - / - / - 0
44SA085141 37% 0.472 PF00005 C1_S142 - (0)6 - / - / 21 4
45SA085251 38% 0.479 PF00005 C1_S147 - (0)8 - / 2 / 31 5
46SA225140 35% 0.597 PF00005 C1_S131 - (0)12 - / 12 / 12 5
47SAP02231 38% 0.589 PF00005 C1_S122 - (0)10 - / - / 19 5
48SA088836 38% 0.460 PF00005 C1_S145 - (0)10 - / 1 / 23 5
49SA060238 35% 0.517 PF00005 C1_S138 - (0)12 - / 7 / 22 5
50SA249241 41% 0.530 PF00005 C1_S131 - (0)10 - / 18 / 8 5

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