Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000005269 (2017 - Enterococcus faecium - ENTFC: Enterococcus faecium (strain DO))

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]
1I3TYI894 48% 0.61 PF01702 C5_S1120 - (40)20 1 / 39 / 45 52
2I3U36854 48% 0.53 PF01746 C7_S163 - (22)20 1 / 21 / 29 33
3I3U49393 58% 0.64 PF00160 C8_S1124 - (7)20 1 / 13 / 37 26
4Q3XZC655 61% 0.59 PF00186 C5_S1151 - (79)20 3 / 20 / 17 21
5Q3XYV064 70% 0.53 PF02786 C3_S155 - (26)20 2 / 15 / 27 19
6Q3XWF944 46% 0.50 PF01513 C8_S172 - (32)20 - / 10 / 37 18
7I3U02572 51% 0.60 PF07931 C4_S1113 - (78)20 7 / 23 / 33 18
8Q3Y2D981 47% 0.68 PF01048 C1_S1127 - (69)20 - / 52 / 20 17
9Q3Y2R777 76% 0.65 PF00483 C1_S175 - (31)20 - / 16 / 57 17
10Q3XXS576 65% 0.55 PF01048 C2_S178 - (57)20 - / - / 66 17
11Q3XXS452 64% 0.65 PF01048 C4_S185 - (47)20 - / 4 / 31 17
12Q3XZ8035 75% 0.47 PF03119 C11_S158 - (27)20 - / 18 / 16 15
13Q3Y17698 74% 0.56 PF00156 C2_S1134 - (74)18 2 / 25 / 54 15
14I3U2R857 60% 0.65 PF01255 C6_S1130 - (44)20 6 / 21 / 25 15
15I3U1N370 51% 0.50 PF00160 C7_S1115 - (4)20 - / 7 / 26 15
16Q3XYZ742 59% 0.63 PF00232 C4_S187 - (68)20 - / - / 28 13
17Q3XXF936 100% 0.59 PF01327 C4_S1124 - (25)20 - / 5 / 23 13
18I3U2N791 81% 0.61 PF00012 C2_S1106 - (0)20 11 / 45 / 18 12
19Q3XZC797 83% 0.63 PF00303 C5_S1146 - (99)20 - / 8 / 67 12
20Q3Y30134 54% 0.54 PF00871 C8_S166 - (55)20 2 / 13 / 17 12
21Q3XZ0256 46% 0.59 PF00485 C2_S1133 - (47)20 - / 41 / 6 12
22I3TZW153 63% 0.60 PF03167 C8_S187 - (0)20 5 / 5 / 26 11
23I3U5B651 58% 0.57 PF12804 C1_S159 - (37)20 2 / 25 / 16 11
24Q3XXC333 64% 0.62 PF01588 C2_S134 - (0)16 5 / 11 / 1 11
25I3U18242 88% 0.53 PF01751 C2_S138 - (0)14 7 / 15 / 8 10
26Q3XX0785 67% 0.53 PF00121 C6_S182 - (59)20 - / - / 49 10
27Q3XZ2855 42% 0.56 PF01487 C5_S159 - (44)20 - / - / 44 10
28Q3XZD452 75% 0.52 PF00709 C10_S195 - (69)20 - / 35 / 15 9
29Q3Y19965 47% 0.50 PF01327 C7_S1128 - (30)20 - / 15 / 34 9
30Q3XX0875 99% 0.56 PF03952 C2_S159 - (45)15 - / 2 / 49 9
31Q3XZW132 76% 0.49 PF01409 C3_S127 - (15)11 2 / 4 / 8 9
32I3U3V257 68% 0.68 PF00162 C7_S193 - (82)20 - / 27 / 23 9
33I3U217108 74% 0.57 PF01180 C2_S1491 - (207)20 - / 104 / 12 9
34I3U03129 41% 0.47 PF11798 C1_S1129 - (120)18 - / 5 / 24 9
35Q3Y0S730 62% 0.53 PF08541 C2_S142 - (21)20 6 / 12 / 7 9
36Q3XWG832 44% 0.55 PF01451 C7_S130 - (2)13 - / 3 / 21 8
37Q3Y2T026 66% 0.63 PF13419 C2_S129 - (18)13 - / 5 / 12 8
38Q3XZS028 46% 0.63 PF13419 C1_S135 - (16)13 - / 5 / 12 8
39Q3Y29138 43% 0.55 PF01263 C2_S144 - (39)17 - / - / 27 7
40Q3XZX437 61% 0.49 PF01259 C3_S171 - (55)14 - / 18 / 17 7
41I3TZ8437 41% 0.53 PF01263 C3_S142 - (38)17 - / - / 26 7
42Q3Y0E241 53% 0.57 PF07670 C6_S161 - (0)12 5 / 23 / 8 7
43Q3XYF876 55% 0.58 PF02729 C10_S177 - (43)20 - / 24 / 24 7
44Q3XZE244 85% 0.58 PF01751 C3_S138 - (0)13 8 / 17 / 5 7
45Q3Y0S034 59% 0.59 PF02786 C1_S166 - (32)20 - / 16 / 14 7
46Q3XX9230 64% 0.65 PF00005 C1_S160 - (0)15 - / 11 / 16 6
47Q3Y0Q425 67% 0.45 PF07973 C2_S130 - (10)15 1 / 7 / 8 6
48Q3XWK424 52% 0.47 PF00485 C1_S167 - (49)14 7 / 7 / 7 6
49Q3XXN440 47% 0.68 PF00005 C1_S153 - (0)17 - / 13 / 12 6
50Q3XWZ721 63% 0.55 PF01807 C4_S117 - (0)10 - / 7 / 6 6

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