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_102920 41% 0.545 PF00480 C2_S128 - (20)3 - / - / 4 2
151jhp_009718 100% 0.603 PF02664 C3_S15 - (3)3 - / - / 3 2
152jhp_094012 100% 0.568 PF00613 C5_S113 - (10)4 - / 5 / 3 2
153jhp_015034 51% 0.587 PF00490 C6_S130 - (18)14 - / - / 14 2
154jhp_063824 53% 0.500 PF00108 C7_S117 - (8)5 - / 2 / 3 2
155jhp_056020 51% 0.574 PF01336 C5_S142 - (30)6 - / 5 / 3 2
156jhp_046614 66% 0.363 PF01926 C1_S155 - (0)3 6 / 1 / - 2
157jhp_01248 38% 0.585 PF00578 C1_S112 - (0)4 - / - / 4 2
158jhp_059431 56% 0.531 PF00206 C4_S117 - (10)5 - / - / 8 2
159jhp_019614 48% 0.464 PF00183 C2_S19 - (0)3 - / - / 8 2
160jhp_090820 44% 0.551 PF01676 C4_S112 - (9)4 - / 5 / 2 2
161jhp_055122 46% 0.601 PF01208 C5_S113 - (10)5 8 / - / - 2
162jhp_058524 37% 0.535 PF03446 C1_S120 - (16)3 4 / 1 / - 2
163jhp_085546 45% 0.533 PF00044 C4_S153 - (35)8 12 / 16 / 4 2
164jhp_099310 37% 0.483 PF08241 C1_S131 - (16)3 1 / 4 / - 2
165jhp_03638 38% 0.478 PF02547 C6_S18 - (0)3 - / - / 6 2
166jhp_022215 46% 0.501 PF03900 C4_S125 - (7)4 3 / 7 / 1 2
167jhp_061533 45% 0.586 PF00155 C1_S144 - (37)7 - / 1 / 24 2
168jhp_016617 33% 0.538 PF00793 C5_S115 - (7)4 - / - / 4 2
169jhp_101521 91% 0.583 PF01041 C1_S150 - (29)6 - / - / 7 2
170jhp_143925 43% 0.600 PF00834 C3_S116 - (7)5 - / - / 4 2
171jhp_038819 35% 0.625 PF01288 C11_S192 - (40)2 - / - / 3 2
172jhp_059120 97% 0.566 PF12804 C2_S145 - (28)4 - / 6 / 4 2
173jhp_135820 40% 0.519 PF00005 C1_S138 - (0)4 - / 7 / 1 2
174jhp_003820 59% 0.479 PF01370 C1_S155 - (51)4 3 / 2 / - 2
175jhp_136713 33% 0.541 PF01712 C3_S128 - (20)2 - / 2 / 1 2
176jhp_056717 54% 0.484 PF08245 C1_S130 - (19)6 3 / 3 / - 2
177jhp_130814 55% 0.472 PF14489 C2_S124 - (0)4 - / - / 7 2
178jhp_079219 40% 0.507 PF00294 C1_S144 - (25)5 - / 3 / 5 2
179jhp_126545 48% 0.463 PF00044 C4_S139 - (30)4 10 / 14 / 2 2
180jhp_111820 71% 0.546 PF03143 C1_S148 - (0)3 - / 8 / 1 2
181jhp_067921 57% 0.634 PF13793 C10_S128 - (23)4 - / - / 7 2
182jhp_059611 88% 0.524 PF00534 C4_S116 - (13)4 - / 6 / 2 2
183jhp_040440 46% 0.463 PF02542 C6_S176 - (50)17 - / - / 20 2
184jhp_129038 99% 0.524 PF07977 C4_S126 - (1)19 - / - / 18 2
185jhp_041255 42% 0.504 PF01180 C4_S1176 - (112)8 49 / 4 / 6 2
186jhp_102524 51% 0.659 PF01081 C1_S130 - (26)4 - / - / 5 2
187jhp_073524 100% 0.455 PF00994 C5_S113 - (0)6 - / - / 5 2
188jhp_076424 98% 0.605 PF07992 C3_S197 - (84)6 9 / 3 / 1 2
189jhp_146420 36% 0.384 PF00905 C1_S135 - (0)3 - / 1 / 1 2
190jhp_056820 91% 0.541 PF00155 C1_S145 - (30)5 - / - / 3 2
191jhp_102325 50% 0.450 PF00106 C1_S150 - (38)4 9 / - / - 2
192jhp_109825 52% 0.579 PF08402 C1_S121 - (0)4 - / 3 / 2 2
193jhp_003720 95% 0.647 PF00483 C2_S153 - (39)6 - / 4 / 1 2
194jhp_003022 100% 0.704 PF02261 C1_S139 - (6)2 3 / - / 2 2
195jhp_007020 48% 0.519 PF00408 C1_S114 - (13)2 - / - / 2 2
196jhp_083719 98% 0.602 PF02492 C2_S123 - (0)3 - / 5 / - 2
197jhp_002918 58% 0.500 PF10431 C4_S122 - (21)4 - / 8 / 1 2
198jhp_026844 40% 0.570 PF01202 C4_S165 - (62)6 5 / 16 / 14 2
199jhp_142920 62% 0.594 PF00107 C1_S146 - (34)6 8 / - / - 2
200jhp_129420 31% 0.478 PF03446 C2_S134 - (27)5 1 / 2 / 1 2

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