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]
150PA01506 32% 0.442 PF00440 1 - (0)? - / - / - 0
151PA015120 31% 0.220 PF00593 65 - (0)? - / - / - 0
152PA015215 50% 0.418 PF03466 19 - (0)? - / - / - 0
153PA015320 80% 0.489 PF12391 0 - (0)? - / - / - 0
154PA015420 81% 0.506 PF00775 15 - (13)? - / - / - 0
155PA015514 43% 0.474 PF01614 3 - (0)? - / - / - 0
156PA015610 35% 0.433 PF00529 0 - (0)? - / - / - 0
157PA015710 34% 0.460 PF00529 0 - (0)? - / - / - 0
158PA015820 39% 0.340 PF00873 6 - (0)? - / - / - 0
159PA015920 34% 0.489 PF03466 2 - (0)? - / - / - 0
160PA01600 28% ? PF02507 0 - (0)? - / - / - 0
161PA01610 50% 0.540 PF00293 0 - (0)? - / - / - 0
162PA016223 99% 0.283 PF00267 C7_S172 - (0)2 - / - / 4 0
163PA016312 39% 0.481 PF12833 22 - (0)? - / - / - 0
164PA016420 61% 0.610 PF01019 21 - (0)? - / - / - 0
165PA01652 28% 0.141 PF03502 3 - (0)? - / - / - 0
166PA01663 36% 0.239 PF05552 8 - (0)? - / - / - 0
167PA016719 44% 0.533 PF00440 25 - (0)? - / - / - 0
168PA01687 53% 0.462 PF03144 C7_S12 - (0)1 - / - / 2 1
169PA016920 40% 0.481 PF00072 45 - (0)? - / - / - 0
170PA01700 36% 0.519 PF06623 37 - (0)? - / - / - 0
171PA01710 35% 0.429 PF01433 12 - (0)? - / - / - 0
172PA017217 20% 0.424 PF07228 2 - (0)? - / - / - 0
173PA017310 63% 0.677 PF00072 5 - (0)? - / - / - 0
174PA01742 38% 0.388 PF00067 3 - (0)? - / - / - 0
175PA017519 58% 0.501 PF03705 C5_S118 - (14)2 - / 3 / - 0
176PA017611 100% 0.615 PF02203 0 - (0)? - / - / - 0
177PA017710 65% 0.458 PF01584 3 - (0)? - / - / - 0
178PA017820 51% 0.439 PF07194 C1_S123 - (22)7 - / 3 / 10 4
179PA017925 53% 0.634 PF00072 C2_S120 - (0)2 - / - / 1 0
180PA01805 55% 0.481 PF06013 4 - (2)? - / - / - 0
181PA018119 31% 0.413 PF03466 7 - (0)? - / - / - 0
182PA018224 54% 0.663 PF00106 129 - (73)4 - / - / - 0
183PA018317 98% 0.837 PF00884 C4_S120 - (4)6 - / - / 3 2
184PA018420 42% 0.499 PF08402 26 - (0)? - / - / - 0
185PA01858 19% 0.338 PF00528 1 - (0)? - / - / - 0
186PA018620 59% 0.533 PF09084 36 - (1)? - / - / - 0
187PA018715 43% 0.335 PF02668 61 - (32)? - / - / - 0
188PA01880 29% 0.133 PF02046 1 - (0)? - / - / - 0
189PA018922 42% 0.232 PF00267 C4_S175 - (0)2 - / - / 1 0
190PA019011 50% 0.538 PF00998 2 - (0)? - / - / - 0
191PA019115 43% 0.409 PF03466 12 - (0)? - / - / - 0
192PA019213 32% 0.088 PF00593 20 - (0)? - / - / - 0
193PA019337 81% 0.597 PF02668 C7_S162 - (42)8 - / - / 24 4
194PA019420 31% 0.509 PF02668 51 - (33)? - / - / - 0
195PA019521 53% 0.537 PF05222 C3_S144 - (30)1 - / - / 1 0
196PA0195_10 48% 0.118 PF05371 6 - (0)? - / - / - 0
197PA019634 67% 0.360 PF02776 C6_S147 - (38)10 30 / - / - 4
198PA01976 30% 0.585 PF07311 21 - (0)? - / - / - 0
199PA01980 37% 0.238 PF07650 1 - (0)? - / - / - 0
200PA01994 39% 0.756 PF00561 0 - (0)? - / - / - 0

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