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]
50SA044058 100% 0.734 PF01712 C2_S185 - (43)20 18 / 12 / 20 21
51SA094241 100% 0.778 PF01327 C7_S149 - (15)16 - / 6 / 19 7
52SA130535 100% 0.652 PF00216 C9_S159 - (0)2 4 / 2 / 12 0
53SA233420 100% 0.508 PF08541 C4_S121 - (13)5 - / - / 3 3
54SA014820 100% 0.484 PF02719 C1_S161 - (58)7 16 / 1 / 2 2
55SA044120 100% 0.544 PF00543 C1_S128 - (0)2 - / 7 / - 1
56SA20979 100% 0.550 PF03738 12 - (0)? - / - / - 0
57SA003820 100% 0.516 PF00905 C2_S118 - (0)5 - / 2 / 3 5
58SA067420 100% 0.556 PF00884 C3_S111 - (4)3 - / - / 3 1
59SA025411 100% 0.499 PF07702 8 - (0)? - / - / - 0
60SA184312 100% 0.603 PF00183 14 - (8)1 - / - / - 0
61SA093420 100% 0.385 PF00381 21 - (0)? - / - / - 0
62SA004016 100% 0.556 PF03965 C3_S116 - (0)2 - / - / 4 0
63SA072321 100% 0.606 PF00574 59 - (0)1 - / - / - 0
64SA235518 100% 0.598 PF00583 48 - (16)1 - / - / - 0
65SA100720 100% 0.596 PF07968 54 - (0)1 - / - / - 0
66SA096363 100% 0.538 PF02786 C2_S157 - (24)20 2 / 19 / 21 18
67SA17198 100% 0.450 PF08719 C4_S15 - (0)2 - / - / 4 1
68SA002315 100% 0.715 PF02590 C2_S112 - (0)? - / 1 / - 0
69SA184416 100% 0.570 PF00072 C3_S19 - (0)2 - / - / 3 0
70SA107914 100% 0.657 PF04297 2 - (0)? - / - / - 0
71SA086932 100% 0.614 PF00106 C3_S148 - (30)6 15 / 1 / - 4
72SA051626 100% 0.605 PF00383 C4_S144 - (11)6 2 / 3 / 5 1
73SA072855 100% 0.536 PF00162 C9_S181 - (71)18 - / 21 / 23 9
74SA091632 100% 0.679 PF00731 C9_S138 - (28)12 - / 1 / 16 4
75SA152215 100% 0.588 PF01039 2 - (0)? - / - / - 0
76SA130168 100% 0.582 PF00334 C8_S167 - (64)20 - / 34 / 29 14
77SA19002 100% 0.660 PF00046 2 - (0)? - / - / - 0
78SA155231 100% 0.526 PF04650 C4_S147 - (0)10 6 / - / 9 4
79SA157220 100% 0.573 PF01546 C1_S110 - (1)? - / - / 1 0
80SA188757 100% 0.619 PF01820 C1_S181 - (57)11 - / 18 / 22 3
81SA134319 100% 0.645 PF04151 C1_S130 - (5)2 - / - / 2 0
82SA155030 100% 0.795 PF00579 C3_S145 - (35)8 - / 9 / 10 4
83SA098016 100% 0.646 PF01497 C1_S124 - (0)? 1 / - / - 0
84SA058720 100% 0.627 PF01297 C9_S11 - (0)1 - / - / 1 1
85SA239313 100% 0.622 PF08546 C2_S138 - (23)4 5 / - / - 2
86SA118949 100% 0.484 PF00521 C3_S192 - (0)8 - / 3 / 37 0
87SA152319 100% 0.551 PF01039 6 - (0)? - / - / - 0
88SA187315 100% 0.646 PF02452 C2_S12 - (0)? 1 / - / - 0
89SA026519 100% 0.645 PF01551 C6_S13 - (0)2 - / - / 2 1
90SA084351 100% 0.542 PF02801 C4_S152 - (5)20 - / 7 / 19 9
91SA104420 100% 0.594 PF01979 C1_S112 - (3)1 - / - / 1 1
92SA200619 100% 0.581 PF01123 3 - (0)? - / - / - 0
93SA171520 100% 0.542 PF02637 0 - (0)? - / - / - 0
94SA170016 100% 0.594 PF00072 2 - (0)? - / - / - 0
95SA011120 100% 0.606 PF01497 C1_S139 - (0)1 - / 1 / 1 1
96SA075915 100% 0.635 PF03960 C2_S116 - (0)1 - / - / 1 0
97SA194125 100% 0.550 PF00210 C3_S18 - (0)4 - / - / 1 0
98SA16599 100% 0.573 PF00397 34 - (0)? - / - / - 0
99SA171710 100% 0.571 PF02686 2 - (0)? - / - / - 0
100SAP01217 100% 0.561 PF03965 C3_S114 - (0)2 - / 1 / 2 0

<< Page / 52 >> - Show