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]
150PA529814 68% 0.695 PF00156 C2_S137 - (29)3 - / 2 / 2 2
151PA527410 56% 0.695 PF03449 0 - (0)? - / - / - 0
152PA507212 48% 0.695 PF00015 4 - (0)? - / - / - 0
153PA39004 52% 0.695 PF02788 0 - (0)? - / - / - 0
154PA13815 28% 0.694 -0 - (0)? - / - / - 0
155PA17204 100% 0.694 PF00873 2 - (0)? - / - / - 0
156PA18226 36% 0.694 PF01627 0 - (0)? - / - / - 0
157PA310516 99% 0.694 PF03958 1 - (0)? - / - / - 0
158PA477815 48% 0.694 PF13411 0 - (0)? - / - / - 0
159PA36883 59% 0.694 PF01869 5 - (0)? - / - / - 0
160PA20169 37% 0.693 PF13411 20 - (0)? - / - / - 0
161PA354214 99% 0.693 PF07238 C6_S114 - (0)2 4 / 2 / - 1
162PA21860 28% 0.692 PF03719 0 - (0)? - / - / - 0
163PA396820 64% 0.692 PF01479 C4_S120 - (0)6 - / - / 5 1
164PA204712 38% 0.692 PF12833 28 - (0)? - / - / - 0
165PA484621 99% 0.692 PF01220 C8_S138 - (0)1 - / - / 1 1
166PA05415 57% 0.692 PF01322 20 - (0)? - / - / - 0
167PA430318 98% 0.691 PF01656 0 - (0)? - / - / - 0
168PA47537 46% 0.691 PF01985 4 - (0)2 - / - / - 0
169PA226019 99% 0.691 PF01261 13 - (0)? - / - / - 0
170PA533120 70% 0.690 PF00156 C2_S132 - (23)6 - / 1 / 8 3
171PA35308 98% 0.689 PF05793 C3_S15 - (0)2 - / - / 4 1
172PA31028 59% 0.689 PF00494 6 - (0)1 - / - / - 0
173PA083820 48% 0.688 PF00255 6 - (0)? - / - / - 0
174PA313993 73% 0.688 PF00155 C1_S1124 - (94)20 15 / 17 / 48 12
175PA098213 93% 0.687 PF01323 11 - (0)? - / - / - 0
176PA42890 23% 0.687 PF08920 0 - (0)? - / - / - 0
177PA34134 54% 0.686 PF03810 5 - (0)? - / - / - 0
178PA28632 42% 0.685 PF00005 0 - (0)? - / - / - 0
179PA094116 59% 0.685 PF00462 3 - (0)? - / - / - 0
180PA285910 56% 0.685 PF03449 0 - (0)? - / - / - 0
181PA172310 39% 0.685 PF01514 1 - (0)? - / - / - 0
182PA12280 43% 0.684 PF02335 72 - (0)? - / - / - 0
183PA354021 100% 0.684 PF03721 C2_S129 - (18)6 1 / 3 / 2 3
184PA122911 34% 0.684 PF12833 23 - (0)? - / - / - 0
185PA520813 52% 0.684 PF01895 0 - (0)? - / - / - 0
186PA336319 97% 0.683 PF00072 0 - (0)? - / - / - 0
187PA05785 55% 0.683 PF01596 6 - (6)? - / - / - 0
188PA30178 45% 0.682 PF00582 C1_S130 - (0)2 - / 2 / 1 1
189PA467026 68% 0.682 PF13793 C9_S129 - (24)6 - / - / 16 4
190PA44527 39% 0.681 PF06406 8 - (0)? - / - / - 0
191PA374810 54% 0.681 PF01595 C1_S121 - (0)1 - / 3 / - 1
192PA296827 58% 0.681 PF00698 C1_S119 - (14)9 - / 1 / 3 1
193PA11053 40% 0.681 PF03104 15 - (0)? - / - / - 0
194PA06480 39% 0.680 PF00012 0 - (0)? - / - / - 0
195PA013920 59% 0.680 PF00578 5 - (0)? - / - / - 0
196PA427520 82% 0.679 PF02357 4 - (0)? - / - / - 0
197PA273815 84% 0.679 PF00216 C10_S158 - (0)2 2 / 5 / 5 1
198PA421714 100% 0.679 PF01494 C1_S156 - (30)2 3 / - / - 1
199PA42967 44% 0.679 PF00072 19 - (0)? - / - / - 0
200PA14507 39% 0.679 PF04536 2 - (0)? - / - / - 0

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