Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000000804 (Helicobacter pylori - Dec 2015)

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]
150jhp_010819 42% 0.429 PF01751 C4_S115 - (0)6 2 / - / 5 2
151jhp_026844 40% 0.570 PF01202 C4_S165 - (62)6 5 / 16 / 14 2
152jhp_022215 46% 0.501 PF03900 C4_S125 - (7)4 3 / 7 / 1 2
153jhp_112845 75% 0.590 PF03143 C3_S166 - (0)4 14 / 20 / 4 2
154jhp_063824 53% 0.500 PF00108 C7_S117 - (8)5 - / 2 / 3 2
155jhp_072714 38% 0.366 PF08282 C3_S123 - (0)4 - / 6 / 1 2
156jhp_100211 90% 0.543 PF00534 C6_S116 - (13)4 - / 6 / 2 2
157jhp_040440 46% 0.463 PF02542 C6_S176 - (50)17 - / - / 20 2
158jhp_041255 42% 0.504 PF01180 C4_S1176 - (112)8 49 / 4 / 6 2
159jhp_003820 59% 0.479 PF01370 C1_S155 - (51)4 3 / 2 / - 2
160jhp_009718 100% 0.603 PF02664 C3_S15 - (3)3 - / - / 3 2
161jhp_128718 51% 0.599 PF00012 C1_S135 - (0)3 - / 3 / - 2
162jhp_01248 38% 0.585 PF00578 C1_S112 - (0)4 - / - / 4 2
163jhp_019614 48% 0.464 PF00183 C2_S19 - (0)3 - / - / 8 2
164jhp_056820 91% 0.541 PF00155 C1_S145 - (30)5 - / - / 3 2
165jhp_124522 63% 0.529 PF00206 C3_S117 - (10)7 - / - / 7 2
166jhp_059120 97% 0.566 PF12804 C2_S145 - (28)4 - / 6 / 4 2
167jhp_056717 54% 0.484 PF08245 C1_S130 - (19)6 3 / 3 / - 2
168jhp_027128 52% 0.560 PF09336 C3_S123 - (23)3 - / 5 / 3 2
169jhp_132319 41% 0.572 PF07521 C1_S118 - (0)3 4 / - / 2 2
170jhp_109825 52% 0.579 PF08402 C1_S121 - (0)4 - / 3 / 2 2
171jhp_076424 98% 0.605 PF07992 C3_S197 - (84)6 9 / 3 / 1 2
172jhp_130814 55% 0.472 PF14489 C2_S124 - (0)4 - / - / 7 2
173jhp_079219 40% 0.507 PF00294 C1_S144 - (25)5 - / 3 / 5 2
174jhp_046614 66% 0.363 PF01926 C1_S155 - (0)3 6 / 1 / - 2
175jhp_126545 48% 0.463 PF00044 C4_S139 - (30)4 10 / 14 / 2 2
176jhp_061533 45% 0.586 PF00155 C1_S144 - (37)7 - / 1 / 24 2
177jhp_085546 45% 0.533 PF00044 C4_S153 - (35)8 12 / 16 / 4 2
178jhp_058524 37% 0.535 PF03446 C1_S120 - (16)3 4 / 1 / - 2
179jhp_090820 44% 0.551 PF01676 C4_S112 - (9)4 - / 5 / 2 2
180jhp_102325 50% 0.450 PF00106 C1_S150 - (38)4 9 / - / - 2
181jhp_129420 31% 0.478 PF03446 C2_S134 - (27)5 1 / 2 / 1 2
182jhp_111820 71% 0.546 PF03143 C1_S148 - (0)3 - / 8 / 1 2
183jhp_133445 48% 0.586 PF00160 C4_S1149 - (2)5 - / 18 / 4 2
184jhp_076920 53% 0.451 PF01425 C6_S151 - (0)3 - / - / 3 2
185jhp_132220 37% 0.527 PF00398 C1_S119 - (12)3 - / 2 / 3 2
186jhp_056020 51% 0.574 PF01336 C5_S142 - (30)6 - / 5 / 3 2
187jhp_106712 39% 0.464 PF01656 C2_S140 - (0)3 - / 5 / 1 2
188jhp_077820 97% 0.463 PF02719 C1_S167 - (61)7 14 / 1 / 2 2
189jhp_027524 97% 0.567 PF00278 C2_S129 - (22)6 - / 2 / 7 2
190jhp_03638 38% 0.478 PF02547 C6_S18 - (0)3 - / - / 6 2
191jhp_099310 37% 0.483 PF08241 C1_S131 - (16)3 1 / 4 / - 2
192jhp_102920 41% 0.545 PF00480 C2_S128 - (20)3 - / - / 4 2
193jhp_136713 33% 0.541 PF01712 C3_S128 - (20)2 - / 2 / 1 2
194jhp_030425 45% 0.578 PF00625 C4_S145 - (32)6 - / 5 / 2 2
195jhp_059611 88% 0.524 PF00534 C4_S116 - (13)4 - / 6 / 2 2
196jhp_135820 40% 0.519 PF00005 C1_S138 - (0)4 - / 7 / 1 2
197jhp_073524 100% 0.455 PF00994 C5_S113 - (0)6 - / - / 5 2
198jhp_015034 51% 0.587 PF00490 C6_S130 - (18)14 - / - / 14 2
199jhp_002918 58% 0.500 PF10431 C4_S122 - (21)4 - / 8 / 1 2
200jhp_059431 56% 0.531 PF00206 C4_S117 - (10)5 - / - / 8 2

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