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]
50jhp_002337 71% 0.615 PF00180 C7_S157 - (53)16 1 / 14 / 22 5
51jhp_028633 38% 0.467 PF00005 C1_S183 - (0)10 - / 2 / 14 5
52jhp_120126 41% 0.590 PF00591 C2_S131 - (1)9 - / 4 / 8 5
53jhp_142022 41% 0.495 PF01380 C2_S114 - (13)10 - / - / 11 5
54jhp_055827 47% 0.457 PF03119 C3_S151 - (32)10 - / 5 / 10 5
55jhp_029133 49% 0.543 PF00202 C1_S175 - (29)14 - / - / 33 5
56jhp_120023 50% 0.503 PF00218 C6_S119 - (5)11 - / 5 / 4 5
57jhp_002517 96% 0.545 PF02706 C3_S145 - (36)10 - / 5 / 4 5
58jhp_076849 61% 0.508 PF00478 C2_S168 - (47)20 - / 17 / 25 5
59jhp_100550 33% 0.532 PF00762 C6_S1150 - (0)10 18 / 3 / 23 4
60jhp_091347 46% 0.642 PF00091 C3_S155 - (0)8 - / 3 / 29 4
61jhp_128121 32% 0.523 PF03853 C4_S157 - (46)11 - / 4 / 7 4
62jhp_078122 40% 0.660 PF02581 C3_S151 - (40)14 - / 8 / 13 4
63jhp_009831 95% 0.553 PF01053 C1_S119 - (13)11 - / - / 9 4
64jhp_056125 39% 0.589 PF05191 C1_S183 - (68)7 3 / 2 / 5 4
65jhp_052427 53% 0.571 PF02882 C7_S151 - (38)14 - / 9 / 10 4
66jhp_137326 49% 0.442 PF00587 C1_S126 - (24)6 - / 9 / 7 4
67jhp_111224 99% 0.528 PF00194 C8_S123 - (2)9 - / - / 6 4
68jhp_054729 34% 0.317 PF00005 C2_S127 - (26)6 - / 11 / 2 4
69jhp_117033 94% 0.582 PF08501 C4_S159 - (54)9 2 / 3 / 20 4
70jhp_079030 79% 0.584 PF00478 C1_S155 - (40)7 - / 4 / 8 4
71jhp_139025 48% 0.478 PF01195 C2_S122 - (0)12 - / 1 / 8 4
72jhp_050633 63% 0.863 PF00550 C5_S125 - (0)12 - / - / 10 4
73jhp_098917 55% 0.452 PF07194 C3_S118 - (18)7 - / - / 13 4
74jhp_021529 40% 0.513 PF02348 C1_S148 - (36)10 - / 8 / 7 4
75jhp_052122 45% 0.547 PF02502 C7_S124 - (0)11 - / - / 5 4
76jhp_016225 99% 0.662 PF01116 C5_S120 - (16)6 - / - / 15 4
77jhp_066138 99% 0.606 PF00710 C10_S129 - (29)14 - / - / 20 4
78jhp_070040 49% 0.516 PF02978 C8_S156 - (0)9 4 / 14 / 7 4
79jhp_079964 46% 0.542 PF00692 C2_S1119 - (92)11 - / - / 34 4
80jhp_098026 40% 0.513 PF00275 C8_S136 - (21)7 2 / 2 / 6 4
81jhp_034332 39% 0.441 PF00005 C3_S176 - (76)7 - / 9 / 6 4
82jhp_107945 48% 0.578 PF02978 C5_S160 - (0)13 3 / 13 / 13 4
83jhp_031318 49% 0.506 PF07991 C6_S128 - (19)7 - / 4 / 3 3
84jhp_148926 45% 0.573 PF03740 C10_S119 - (18)6 - / - / 10 3
85jhp_041055 55% 0.546 PF00701 C5_S1105 - (102)13 - / - / 16 3
86jhp_112939 44% 0.367 PF00005 C1_S168 - (67)5 - / 19 / - 3
87jhp_009517 97% 0.553 PF00015 C2_S112 - (0)8 - / - / 6 3
88jhp_038920 35% 0.541 PF02978 C6_S153 - (0)6 1 / 4 / 1 3
89jhp_108621 94% 0.566 PF02661 C8_S124 - (0)6 5 / 2 / 3 3
90jhp_024913 57% 0.604 PF10431 C4_S113 - (0)6 - / 11 / - 3
91jhp_000527 54% 0.677 PF00215 C2_S140 - (28)10 - / 13 / 3 3
92jhp_036620 69% 0.576 PF05496 C2_S121 - (0)5 4 / 5 / 4 3
93jhp_087622 35% 0.570 PF01168 C3_S145 - (34)5 - / 3 / 13 3
94jhp_062125 39% 0.412 PF00317 C6_S130 - (30)5 - / 2 / 8 3
95jhp_086330 46% 0.598 PF01227 C13_S126 - (2)8 - / - / 22 3
96jhp_110527 45% 0.570 PF01676 C6_S115 - (2)6 - / - / 7 3
97jhp_028728 37% 0.589 PF08402 C1_S142 - (0)5 - / 1 / 7 3
98jhp_037718 63% 0.470 PF04760 C1_S139 - (0)3 - / 3 / 1 3
99jhp_089519 39% 0.533 PF01210 C1_S123 - (15)5 4 / 1 / 1 3
100jhp_117431 53% 0.596 PF00579 C5_S132 - (24)11 6 / 1 / 6 3

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