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
2I3U1N062 72% 0.52 PF01063 C6_S1224 - (154)20 - / - / 40 5
3Q3Y29415 48% 0.69 PF02525 210 - (108)1 - / - / - 0
4Q3XXH541 51% 0.60 PF00248 C7_S1196 - (101)20 16 / 1 / 9 3
5I3U2E881 59% 0.59 PF00476 C4_S1183 - (0)7 58 / 8 / 9 1
6I3U5D924 57% 0.56 PF12464 C2_S1179 - (149)6 - / - / 9 1
7Q3XZG569 51% 0.43 PF06827 C9_S1172 - (0)6 6 / 48 / 9 1
8I3U1N156 49% 0.59 PF00106 C1_S1171 - (95)20 39 / 19 / 10 4
9Q3XXU024 67% 0.51 PF07992 C2_S1167 - (146)9 15 / 4 / 3 1
10Q3Y0P725 51% 0.56 PF02852 C1_S1165 - (135)6 11 / 1 / 6 1
11Q3XZS720 35% 0.58 PF01596 159 - (43)? - / - / - 0
12Q3XYW885 66% 0.60 PF05191 C2_S1157 - (141)15 57 / 26 / 1 3
13Q3XZY037 53% 0.64 PF00551 C5_S1155 - (29)11 1 / 1 / 21 1
14I3TZB463 48% 0.62 PF00701 C5_S1152 - (126)16 - / - / 18 1
15Q3XZC655 61% 0.59 PF00186 C5_S1151 - (79)20 3 / 20 / 17 21
16Q3Y1W756 58% 0.62 PF03372 C1_S1151 - (1)12 - / 12 / 23 2
17Q3XZC797 83% 0.63 PF00303 C5_S1146 - (99)20 - / 8 / 67 12
18I3U23818 55% 0.61 PF07992 C2_S1143 - (122)2 2 / - / 1 0
19I3U2V120 45% 0.47 PF00186 C6_S1141 - (74)20 4 / 4 / 10 0
20Q3XWK916 42% 0.42 PF08282 141 - (0)1 - / - / - 0
21Q3XY7439 58% 0.62 PF02852 C1_S1137 - (99)7 17 / - / 5 2
22Q3Y17698 74% 0.56 PF00156 C2_S1134 - (74)18 2 / 25 / 54 15
23Q3Y2D721 51% 0.43 PF00293 C3_S1134 - (62)15 - / - / 13 0
24I3U2T842 64% 0.58 PF16363 C1_S1133 - (116)9 27 / 4 / - 3
25Q3XZ0256 46% 0.59 PF00485 C2_S1133 - (47)20 - / 41 / 6 12
26Q3Y1Q640 53% 0.52 PF01070 C4_S1133 - (92)12 7 / 1 / 11 3
27I3U2R857 60% 0.65 PF01255 C6_S1130 - (44)20 6 / 21 / 25 15
28Q3Y14522 47% 0.63 PF00106 C1_S1129 - (94)15 9 / 1 / 5 2
29I3U03129 41% 0.47 PF11798 C1_S1129 - (120)18 - / 5 / 24 9
30Q3Y19965 47% 0.50 PF01327 C7_S1128 - (30)20 - / 15 / 34 9
31Q3Y2D981 47% 0.68 PF01048 C1_S1127 - (69)20 - / 52 / 20 17
32I3TYE245 59% 0.64 PF12464 C2_S1125 - (61)14 - / - / 30 3
33Q3XXF936 100% 0.59 PF01327 C4_S1124 - (25)20 - / 5 / 23 13
34I3U49393 58% 0.64 PF00160 C8_S1124 - (7)20 1 / 13 / 37 26
35Q3XYK920 39% 0.58 PF00106 C1_S1123 - (94)3 - / - / 1 0
36Q3Y14421 50% 0.67 PF12464 C1_S1122 - (92)4 - / - / 3 0
37Q3XY845 57% 0.42 PF00137 122 - (0)? - / - / - 0
38I3U18370 71% 0.53 PF00521 C8_S1120 - (0)10 - / 3 / 45 1
39I3TYI894 48% 0.61 PF01702 C5_S1120 - (40)20 1 / 39 / 45 52
40Q3Y2W962 52% 0.51 PF16657 C1_S1119 - (0)20 - / - / 42 4
41Q3XZ5529 62% 0.57 PF00106 C1_S1117 - (80)11 25 / - / 3 2
42Q3XZE162 75% 0.57 PF00521 C5_S1115 - (0)9 - / 2 / 42 0
43I3U2G20 34% 0.34 PF03104 115 - (109)? - / - / - 0
44I3U1N370 51% 0.50 PF00160 C7_S1115 - (4)20 - / 7 / 26 15
45I3U50118 54% 0.44 PF01230 C7_S1114 - (0)7 - / 1 / 3 0
46Q3XYF322 75% 0.57 PF01180 C1_S1114 - (66)12 - / 6 / 10 1
47I3U02572 51% 0.60 PF07931 C4_S1113 - (78)20 7 / 23 / 33 18
48Q3Y2807 62% 0.61 PF00132 112 - (89)1 - / - / - 0
49Q3Y0W217 45% 0.42 PF08282 C2_S1112 - (0)3 - / - / 2 0
50Q3XXK848 56% 0.53 PF01820 C1_S1112 - (87)11 - / 12 / 24 3

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