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]
1I3U217108 74% 0.57 PF01180 C2_S1491 - (207)20 - / 104 / 12 9
2Q3Y17698 74% 0.56 PF00156 C2_S1134 - (74)18 2 / 25 / 54 15
3Q3XZC797 83% 0.63 PF00303 C5_S1146 - (99)20 - / 8 / 67 12
4I3TYI894 48% 0.61 PF01702 C5_S1120 - (40)20 1 / 39 / 45 52
5I3U49393 58% 0.64 PF00160 C8_S1124 - (7)20 1 / 13 / 37 26
6I3U2N791 81% 0.61 PF00012 C2_S1106 - (0)20 11 / 45 / 18 12
7Q3XYW885 66% 0.60 PF05191 C2_S1157 - (141)15 57 / 26 / 1 3
8Q3XX0785 67% 0.53 PF00121 C6_S182 - (59)20 - / - / 49 10
9Q3Y0A082 62% 0.52 PF00232 C4_S1110 - (46)20 - / - / 29 3
10Q3Y2D981 47% 0.68 PF01048 C1_S1127 - (69)20 - / 52 / 20 17
11I3U2E881 59% 0.59 PF00476 C4_S1183 - (0)7 58 / 8 / 9 1
12Q3Y2R777 76% 0.65 PF00483 C1_S175 - (31)20 - / 16 / 57 17
13Q3XXS576 65% 0.55 PF01048 C2_S178 - (57)20 - / - / 66 17
14Q3XYF876 55% 0.58 PF02729 C10_S177 - (43)20 - / 24 / 24 7
15Q3XX0875 99% 0.56 PF03952 C2_S159 - (45)15 - / 2 / 49 9
16I3U02572 51% 0.60 PF07931 C4_S1113 - (78)20 7 / 23 / 33 18
17I3U18370 71% 0.53 PF00521 C8_S1120 - (0)10 - / 3 / 45 1
18I3U1N370 51% 0.50 PF00160 C7_S1115 - (4)20 - / 7 / 26 15
19Q3XZG569 51% 0.43 PF06827 C9_S1172 - (0)6 6 / 48 / 9 1
20I3U4H466 68% 0.60 PF03709 C1_S1102 - (50)15 - / 2 / 58 3
21Q3Y19965 47% 0.50 PF01327 C7_S1128 - (30)20 - / 15 / 34 9
22Q3XYV064 70% 0.53 PF02786 C3_S155 - (26)20 2 / 15 / 27 19
23I3TZB463 48% 0.62 PF00701 C5_S1152 - (126)16 - / - / 18 1
24Q3Y2I162 70% 0.66 PF00091 C1_S171 - (0)10 - / 25 / 32 4
25I3U1P962 56% 0.45 PF00291 C4_S171 - (54)17 - / 2 / 43 3
26Q3XZE162 75% 0.57 PF00521 C5_S1115 - (0)9 - / 2 / 42 0
27Q3XZW862 100% 0.64 PF01177 C2_S162 - (50)8 - / 1 / 48 4
28Q3Y2W962 52% 0.51 PF16657 C1_S1119 - (0)20 - / - / 42 4
29Q3Y05662 52% 0.62 PF02978 C6_S198 - (0)17 4 / 23 / 20 4
30I3U1N062 72% 0.52 PF01063 C6_S1224 - (154)20 - / - / 40 5
31Q3XWZ661 74% 0.68 PF04545 C4_S174 - (0)2 30 / - / 6 0
32I3TZ1261 64% 0.58 PF16657 C1_S1106 - (0)20 - / - / 42 6
33Q3Y3B860 48% 0.51 PF16657 C1_S1108 - (0)20 - / - / 51 5
34I3U5K259 86% 0.45 PF04560 C2_S1103 - (0)2 - / - / 42 0
35I3TY4157 77% 0.60 PF03143 C2_S182 - (0)10 15 / 25 / 10 2
36I3U2R857 60% 0.65 PF01255 C6_S1130 - (44)20 6 / 21 / 25 15
37I3U3V257 68% 0.68 PF00162 C7_S193 - (82)20 - / 27 / 23 9
38I3U1N156 49% 0.59 PF00106 C1_S1171 - (95)20 39 / 19 / 10 4
39Q3XZ0256 46% 0.59 PF00485 C2_S1133 - (47)20 - / 41 / 6 12
40Q3Y1W756 58% 0.62 PF03372 C1_S1151 - (1)12 - / 12 / 23 2
41Q3XZC655 61% 0.59 PF00186 C5_S1151 - (79)20 3 / 20 / 17 21
42Q3XZ2855 42% 0.56 PF01487 C5_S159 - (44)20 - / - / 44 10
43I3U36854 48% 0.53 PF01746 C7_S163 - (22)20 1 / 21 / 29 33
44I3TZW153 63% 0.60 PF03167 C8_S187 - (0)20 5 / 5 / 26 11
45Q3XX2352 75% 0.61 PF03143 C2_S165 - (0)9 15 / 27 / 4 3
46Q3XZD452 75% 0.52 PF00709 C10_S195 - (69)20 - / 35 / 15 9
47Q3XXS452 64% 0.65 PF01048 C4_S185 - (47)20 - / 4 / 31 17
48I3U5B651 58% 0.57 PF12804 C1_S159 - (37)20 2 / 25 / 16 11
49Q3Y3C851 42% 0.55 PF00005 C1_S154 - (51)15 - / 11 / 28 6
50Q3XYJ850 81% 0.54 PF00478 C2_S171 - (52)20 - / 12 / 33 5

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