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]
1PA404357 100% 0.594 PF00348 C1_S176 - (62)20 - / 2 / 40 7
2PA473098 56% 0.628 PF02569 C6_S1262 - (191)20 7 / 37 / 30 23
3PA040257 39% 0.627 PF02729 C6_S161 - (47)20 - / 24 / 13 8
4PA365794 100% 0.535 PF00557 C2_S184 - (1)20 - / 9 / 63 35
5PA152930 57% 0.512 PF03119 C4_S151 - (28)20 - / 16 / 15 14
6PA214466 46% 0.507 PF00343 C7_S1119 - (35)20 - / 13 / 49 33
7PA362784 100% 0.557 PF02542 C8_S191 - (72)20 - / - / 66 8
8PA065042 59% 0.604 PF00591 C11_S175 - (1)20 - / 13 / 30 8
9PA397760 55% 0.620 PF00202 C1_S1122 - (55)20 - / - / 57 9
10PA362983 65% 0.602 PF00107 C1_S1151 - (99)20 46 / 31 / 7 5
11PA289150 62% 0.487 PF02786 C2_S159 - (26)20 1 / 19 / 22 18
12PA308336 50% 0.453 PF01433 C3_S1114 - (27)20 - / 8 / 21 20
13PA516373 100% 0.823 PF00483 C1_S153 - (13)20 - / 14 / 48 17
14PA001982 100% 0.732 PF01327 C5_S1109 - (26)20 - / 25 / 44 15
15PA087095 47% 0.605 PF00155 C1_S1151 - (112)20 15 / 22 / 59 14
16PA475068 60% 0.652 PF00809 C5_S186 - (33)20 - / 6 / 62 26
17PA382350 54% 0.593 PF01702 C4_S145 - (17)20 - / 10 / 23 21
18PA168778 60% 0.524 PF05175 C1_S1113 - (93)20 5 / 53 / 16 5
19PA075059 60% 0.572 PF03167 C8_S188 - (0)20 2 / 9 / 31 12
20PA473257 51% 0.562 PF00342 C3_S140 - (39)20 - / - / 39 11
21PA042051 41% 0.529 PF00202 C1_S1106 - (63)20 - / 6 / 42 8
22PA201245 100% 0.489 PF02786 C3_S160 - (27)20 - / 16 / 18 14
23PA336191 100% 0.751 PF00577 C9_S1100 - (0)20 - / - / 83 11
24PA083632 48% 0.540 PF00871 C2_S158 - (48)20 2 / 6 / 16 12
25PA049442 60% 0.620 PF02786 C1_S168 - (32)20 - / 18 / 22 16
26PA377452 49% 0.579 PF00850 C6_S136 - (0)20 - / 4 / 24 6
27PA440668 100% 0.532 PF03331 C8_S1107 - (0)20 1 / 39 / 20 21
28PA180675 100% 0.597 PF00106 C1_S1148 - (85)20 56 / 21 / 7 11
29PA371752 52% 0.599 PF00254 C3_S1111 - (0)20 - / 28 / 8 12
30PA112550 48% 0.550 PF02146 C3_S1157 - (42)20 13 / 21 / 19 7
31PA034294 79% 0.597 PF00303 C8_S1158 - (84)20 - / 12 / 57 12
32PA365253 57% 0.545 PF01255 C9_S1101 - (28)20 - / 29 / 20 14
33PA472861 59% 0.696 PF01288 C7_S1101 - (41)20 2 / 23 / 32 8
34PA428073 45% 0.549 PF08279 C6_S1109 - (93)20 13 / 32 / 13 13
35PA484835 100% 0.655 PF02786 C1_S160 - (33)20 2 / 17 / 11 12
36PA496763 76% 0.506 PF01751 C2_S166 - (0)20 6 / 24 / 23 20
37PA274887 57% 0.496 PF00557 C2_S183 - (1)20 - / 4 / 71 35
38PA379847 55% 0.651 PF00155 C1_S174 - (46)20 - / 5 / 28 6
39PA313993 73% 0.688 PF00155 C1_S1124 - (94)20 15 / 17 / 48 12
40PA296254 100% 0.561 PF01712 C2_S184 - (46)20 3 / 36 / 12 21
41PA400639 100% 0.577 PF01467 C3_S177 - (44)20 8 / 9 / 15 5
42PA365072 58% 0.584 PF13288 C1_S1122 - (57)20 35 / 18 / 20 16
43PA036365 61% 0.586 PF01467 C2_S1101 - (83)20 4 / 20 / 32 9
44PA494930 34% 0.503 PF03853 C3_S157 - (49)20 1 / 8 / 21 11
45PA411080 100% 0.579 PF00144 C1_S199 - (0)20 - / - / 58 32
46PA270965 71% 0.532 PF00291 C3_S188 - (59)20 - / 11 / 47 8
47PA457276 51% 0.533 PF00254 C4_S1119 - (0)20 - / 34 / 22 11
48PA035059 48% 0.527 PF00186 C3_S1121 - (74)20 14 / 28 / 15 15
49PA381088 42% 0.529 PF00012 C5_S1102 - (0)20 4 / 56 / 15 9
50PA296547 100% 0.534 PF02801 C3_S154 - (5)20 - / 7 / 16 9

<< Page / 112 >> - Show