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_056820 91% 0.541 PF00155 C1_S145 - (30)5 - / - / 3 2
151jhp_023522 37% 0.498 PF00005 C3_S138 - (0)5 - / - / 5 3
152jhp_028728 37% 0.589 PF08402 C1_S142 - (0)5 - / 1 / 7 3
153jhp_087622 35% 0.570 PF01168 C3_S145 - (34)5 - / 3 / 13 3
154jhp_133445 48% 0.586 PF00160 C4_S1149 - (2)5 - / 18 / 4 2
155jhp_143925 43% 0.600 PF00834 C3_S116 - (7)5 - / - / 4 2
156jhp_112939 44% 0.367 PF00005 C1_S168 - (67)5 - / 19 / - 3
157jhp_042724 39% 0.442 PF08402 C1_S139 - (0)5 - / - / 4 2
158jhp_129420 31% 0.478 PF03446 C2_S134 - (27)5 1 / 2 / 1 2
159jhp_036620 69% 0.576 PF05496 C2_S121 - (0)5 4 / 5 / 4 3
160jhp_055122 46% 0.601 PF01208 C5_S113 - (10)5 8 / - / - 2
161jhp_100015 43% 0.484 PF05175 C1_S131 - (0)5 - / 2 / 2 1
162jhp_059431 56% 0.531 PF00206 C4_S117 - (10)5 - / - / 8 2
163jhp_016617 33% 0.538 PF00793 C5_S115 - (7)4 - / - / 4 2
164jhp_035018 97% 0.467 PF04952 C4_S113 - (0)4 - / 1 / 4 2
165jhp_134512 44% 0.482 PF10396 C4_S16 - (0)4 - / 5 / 1 2
166jhp_01248 38% 0.585 PF00578 C1_S112 - (0)4 - / - / 4 2
167jhp_102524 51% 0.659 PF01081 C1_S130 - (26)4 - / - / 5 2
168jhp_072714 38% 0.366 PF08282 C3_S123 - (0)4 - / 6 / 1 2
169jhp_065321 55% 0.593 PF00005 C1_S124 - (0)4 - / 4 / 3 2
170jhp_059611 88% 0.524 PF00534 C4_S116 - (13)4 - / 6 / 2 2
171jhp_094012 100% 0.568 PF00613 C5_S113 - (10)4 - / 5 / 3 2
172jhp_105420 42% 0.396 PF00691 C4_S159 - (0)4 - / - / 3 3
173jhp_056920 44% 0.538 PF04551 C7_S122 - (0)4 - / - / 5 3
174jhp_002918 58% 0.500 PF10431 C4_S122 - (21)4 - / 8 / 1 2
175jhp_021024 61% 0.502 PF01641 C4_S113 - (0)4 - / - / 6 0
176jhp_078316 38% 0.489 PF02110 C2_S148 - (41)4 - / - / 2 0
177jhp_112421 100% 0.551 PF00687 C2_S17 - (0)4 - / - / 3 0
178jhp_084122 48% 0.543 PF01515 C9_S122 - (9)4 - / - / 4 1
179jhp_003820 59% 0.479 PF01370 C1_S155 - (51)4 3 / 2 / - 2
180jhp_145220 45% 0.492 PF13603 C2_S125 - (0)4 - / 4 / 1 1
181jhp_130814 55% 0.472 PF14489 C2_S124 - (0)4 - / - / 7 2
182jhp_090820 44% 0.551 PF01676 C4_S112 - (9)4 - / 5 / 2 2
183jhp_109825 52% 0.579 PF08402 C1_S121 - (0)4 - / 3 / 2 2
184jhp_120719 96% 0.535 PF03070 C1_S137 - (14)4 - / - / 4 2
185jhp_020629 44% 0.528 PF00266 C2_S153 - (40)4 - / - / 17 1
186jhp_126545 48% 0.463 PF00044 C4_S139 - (30)4 10 / 14 / 2 2
187jhp_038720 42% 0.496 PF00557 C1_S118 - (1)4 - / - / 2 0
188jhp_022826 98% 0.688 PF00210 C3_S111 - (0)4 - / - / 2 0
189jhp_100211 90% 0.543 PF00534 C6_S116 - (13)4 - / 6 / 2 2
190jhp_067921 57% 0.634 PF13793 C10_S128 - (23)4 - / - / 7 2
191jhp_033721 59% 0.540 PF00456 C1_S111 - (7)4 - / - / 5 1
192jhp_102325 50% 0.450 PF00106 C1_S150 - (38)4 9 / - / - 2
193jhp_059120 97% 0.566 PF12804 C2_S145 - (28)4 - / 6 / 4 2
194jhp_031414 50% 0.625 PF01656 C2_S143 - (0)4 - / 5 / - 0
195jhp_112845 75% 0.590 PF03143 C3_S166 - (0)4 14 / 20 / 4 2
196jhp_135820 40% 0.519 PF00005 C1_S138 - (0)4 - / 7 / 1 2
197jhp_022215 46% 0.501 PF03900 C4_S125 - (7)4 3 / 7 / 1 2
198jhp_083719 98% 0.602 PF02492 C2_S123 - (0)3 - / 5 / - 2
199jhp_101620 31% 0.532 PF00268 C3_S17 - (1)3 - / - / 2 0
200jhp_043520 34% 0.445 PF05958 C4_S170 - (22)3 - / 2 / 1 1

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