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]
1SA130535 100% 0.652 PF00216 C9_S159 - (0)2 4 / 2 / 12 0
2SA19002 100% 0.660 PF00046 2 - (0)? - / - / - 0
3SA031120 100% 0.544 PF00724 42 - (25)? - / - / - 0
4SA181720 100% 0.678 PF01123 1 - (0)? - / - / - 0
5SA217420 100% 0.532 PF01047 C1_S144 - (0)4 - / - / 5 1
6SA072321 100% 0.606 PF00574 59 - (0)1 - / - / - 0
7SA002315 100% 0.715 PF02590 C2_S112 - (0)? - / 1 / - 0
8SA173111 100% 0.588 PF00351 C5_S19 - (0)2 - / - / 3 1
9SA011120 100% 0.606 PF01497 C1_S139 - (0)1 - / 1 / 1 1
10SA100720 100% 0.596 PF07968 54 - (0)1 - / - / - 0
11SA027512 100% 0.493 PF00069 0 - (0)? - / - / - 0
12SA192515 100% 0.648 PF00996 C2_S110 - (0)2 - / - / 3 0
13SA100417 100% 0.630 PF11546 3 - (0)? - / - / - 0
14SA181919 100% 0.734 PF02876 5 - (0)? - / - / - 0
15SA072855 100% 0.536 PF00162 C9_S181 - (71)18 - / 21 / 23 9
16SA223520 100% 0.529 PF04069 C3_S130 - (0)8 - / - / 1 1
17SA014820 100% 0.484 PF02719 C1_S161 - (58)7 16 / 1 / 2 2
18SA097368 100% 0.577 PF01467 C2_S1112 - (89)20 - / 24 / 38 10
19SA091632 100% 0.679 PF00731 C9_S138 - (28)12 - / 1 / 16 4
20SA084120 100% 0.450 PF01123 2 - (0)? - / - / - 0
21SA02217 100% 0.800 PF11546 0 - (0)? - / - / - 0
22SA16599 100% 0.573 PF00397 34 - (0)? - / - / - 0
23SA042222 100% 0.569 PF09084 C2_S112 - (0)1 - / - / 11 0
24SA24570 100% 0.568 PF00584 5 - (0)? - / - / - 0
25SA144219 100% 0.629 PF01596 34 - (24)1 - / - / - 0
26SA172033 100% 0.523 PF03119 C6_S149 - (30)20 - / 18 / 13 14
27SA107523 100% 0.833 PF00550 C5_S14 - (0)3 - / - / 2 2
28SA145315 100% 0.631 PF02082 C3_S15 - (0)? - / - / 1 0
29SAP00114 100% 0.654 PF02295 C6_S16 - (0)2 - / - / 1 1
30SA231725 100% 0.599 PF00583 C1_S132 - (0)7 2 / - / 5 2
31SA194125 100% 0.550 PF00210 C3_S18 - (0)4 - / - / 1 0
32SA026519 100% 0.645 PF01551 C6_S13 - (0)2 - / - / 2 1
33SA003820 100% 0.516 PF00905 C2_S118 - (0)5 - / 2 / 3 5
34SA192726 100% 0.593 PF01116 C3_S121 - (18)7 - / - / 15 5
35SA155231 100% 0.526 PF04650 C4_S147 - (0)10 6 / - / 9 4
36SA200619 100% 0.581 PF01123 3 - (0)? - / - / - 0
37SA1841_11 100% 0.400 PF00089 2 - (0)? - / - / - 0
38SA172420 100% 0.517 PF00206 C2_S115 - (7)4 - / 1 / 3 2
39SA115918 100% 0.722 PF00072 6 - (0)1 - / - / - 0
40SA187427 100% 0.573 PF01168 C1_S151 - (40)6 - / 5 / 15 3
41SA171621 100% 0.488 PF01425 C5_S149 - (0)3 - / - / 3 2
42SA194712 100% 0.699 PF01022 13 - (0)? - / - / - 0
43SA18043 100% 0.759 PF00717 8 - (0)? - / - / - 0
44SA003924 100% 0.463 PF00905 C5_S137 - (0)15 - / - / 17 6
45SA058720 100% 0.627 PF01297 C9_S11 - (0)1 - / - / 1 1
46SA099243 100% 0.718 PF00085 C1_S134 - (0)6 - / - / 8 0
47SA126090 100% 0.650 PF00303 C5_S1130 - (85)20 - / 4 / 75 9
48SA080520 100% 0.494 PF03061 C1_S135 - (0)2 - / - / 2 1
49SA14239 100% 0.564 PF01985 5 - (0)? - / - / - 0
50SA059820 100% 0.480 PF00768 C3_S140 - (0)7 - / - / 2 1

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