Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000002438 (Pseudomonas aeruginosa - Jan 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]
1PA475068 60% 0.652 PF00809 C5_S186 - (33)20 - / 6 / 62 26
2PA516373 100% 0.823 PF00483 C1_S153 - (13)20 - / 14 / 48 17
3PA040257 39% 0.627 PF02729 C6_S161 - (47)20 - / 24 / 13 8
4PA168778 60% 0.524 PF05175 C1_S1113 - (93)20 5 / 53 / 16 5
5PA382350 54% 0.593 PF01702 C4_S145 - (17)20 - / 10 / 23 21
6PA371752 52% 0.599 PF00254 C3_S1111 - (0)20 - / 28 / 8 12
7PA457276 51% 0.533 PF00254 C4_S1119 - (0)20 - / 34 / 22 11
8PA476189 81% 0.604 PF00012 C4_S1104 - (0)20 11 / 55 / 12 9
9PA087095 47% 0.605 PF00155 C1_S1151 - (112)20 15 / 22 / 59 14
10PA473098 56% 0.628 PF02569 C6_S1262 - (191)20 7 / 37 / 30 23
11PA049442 60% 0.620 PF02786 C1_S168 - (32)20 - / 18 / 22 16
12PA474867 52% 0.580 PF00121 C5_S151 - (43)20 - / - / 40 10
13PA214466 46% 0.507 PF00343 C7_S1119 - (35)20 - / 13 / 49 33
14PA201245 100% 0.489 PF02786 C3_S160 - (27)20 - / 16 / 18 14
15PA035059 48% 0.527 PF00186 C3_S1121 - (74)20 14 / 28 / 15 15
16PA473257 51% 0.562 PF00342 C3_S140 - (39)20 - / - / 39 11
17PA440668 100% 0.532 PF03331 C8_S1107 - (0)20 1 / 39 / 20 21
18PA411080 100% 0.579 PF00144 C1_S199 - (0)20 - / - / 58 32
19PA455760 67% 0.630 PF02401 C9_S1117 - (0)20 - / 3 / 72 11
20PA042051 41% 0.529 PF00202 C1_S1106 - (63)20 - / 6 / 42 8
21PA397760 55% 0.620 PF00202 C1_S1122 - (55)20 - / - / 57 9
22PA372486 100% 0.760 PF02868 C12_S1159 - (0)20 - / 21 / 28 36
23PA381088 42% 0.529 PF00012 C5_S1102 - (0)20 4 / 56 / 15 9
24PA180675 100% 0.597 PF00106 C1_S1148 - (85)20 56 / 21 / 7 11
25PA428073 45% 0.549 PF08279 C6_S1109 - (93)20 13 / 32 / 13 13
26PA379847 55% 0.651 PF00155 C1_S174 - (46)20 - / 5 / 28 6
27PA065042 59% 0.604 PF00591 C11_S175 - (1)20 - / 13 / 30 8
28PA494930 34% 0.503 PF03853 C3_S157 - (49)20 1 / 8 / 21 11
29PA365794 100% 0.535 PF00557 C2_S184 - (1)20 - / 9 / 63 35
30PA001982 100% 0.732 PF01327 C5_S1109 - (26)20 - / 25 / 44 15
31PA496763 76% 0.506 PF01751 C2_S166 - (0)20 6 / 24 / 23 20
32PA152930 57% 0.512 PF03119 C4_S151 - (28)20 - / 16 / 15 14
33PA365072 58% 0.584 PF13288 C1_S1122 - (57)20 35 / 18 / 20 16
34PA362784 100% 0.557 PF02542 C8_S191 - (72)20 - / - / 66 8
35PA036365 61% 0.586 PF01467 C2_S1101 - (83)20 4 / 20 / 32 9
36PA000474 74% 0.594 PF01751 C3_S174 - (0)20 6 / 33 / 19 23
37PA313993 73% 0.688 PF00155 C1_S1124 - (94)20 15 / 17 / 48 12
38PA296547 100% 0.534 PF02801 C3_S154 - (5)20 - / 7 / 16 9
39PA472861 59% 0.696 PF01288 C7_S1101 - (41)20 2 / 23 / 32 8
40PA289150 62% 0.487 PF02786 C2_S159 - (26)20 1 / 19 / 22 18
41PA484835 100% 0.655 PF02786 C1_S160 - (33)20 2 / 17 / 11 12
42PA075059 60% 0.572 PF03167 C8_S188 - (0)20 2 / 9 / 31 12
43PA140053 53% 0.486 PF02786 C2_S155 - (23)20 - / 16 / 24 16
44PA112550 48% 0.550 PF02146 C3_S1157 - (42)20 13 / 21 / 19 7
45PA274887 57% 0.496 PF00557 C2_S183 - (1)20 - / 4 / 71 35
46PA377452 49% 0.579 PF00850 C6_S136 - (0)20 - / 4 / 24 6
47PA400639 100% 0.577 PF01467 C3_S177 - (44)20 8 / 9 / 15 5
48PA365253 57% 0.545 PF01255 C9_S1101 - (28)20 - / 29 / 20 14
49PA404357 100% 0.594 PF00348 C1_S176 - (62)20 - / 2 / 40 7
50PA308336 50% 0.453 PF01433 C3_S1114 - (27)20 - / 8 / 21 20

<< Page / 112 >> - Show