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_103020 93% 0.562 PF00107 C1_S135 - (26)5 3 / - / 2 1
51jhp_062441 50% 0.547 PF12804 C1_S153 - (35)12 2 / 15 / 9 6
52jhp_004837 35% 0.355 PF00171 C3_S155 - (0)16 2 / 7 / 7 3
53jhp_108823 97% 0.595 PF00258 C4_S181 - (78)2 2 / 5 / - 1
54jhp_117033 94% 0.582 PF08501 C4_S159 - (54)9 2 / 3 / 20 4
55jhp_118021 47% 0.506 PF02146 C4_S1137 - (38)1 2 / 3 / - 0
56jhp_084033 50% 0.583 PF00871 C5_S154 - (44)20 2 / 2 / 18 12
57jhp_098026 40% 0.513 PF00275 C8_S136 - (21)7 2 / 2 / 6 4
58jhp_010819 42% 0.429 PF01751 C4_S115 - (0)6 2 / - / 5 2
59jhp_07557 100% 0.506 PF03966 C11_S115 - (0)2 2 / - / 4 0
60jhp_030120 96% 0.622 PF01243 C5_S19 - (0)3 2 / - / 2 1
61jhp_057316 61% 0.641 PF02525 C4_S118 - (12)3 2 / - / 1 1
62jhp_022320 44% 0.461 PF00587 C1_S121 - (16)? 2 / - / - 0
63jhp_019918 50% 0.513 PF13932 C4_S159 - (43)2 2 / - / - 1
64jhp_102022 38% 0.522 PF01370 C1_S185 - (71)1 2 / - / - 1
65jhp_096721 47% 0.526 PF01588 C3_S125 - (1)1 2 / - / - 1
66jhp_101147 66% 0.583 PF02786 C1_S175 - (36)20 1 / 16 / 27 18
67jhp_002337 71% 0.615 PF00180 C7_S157 - (53)16 1 / 14 / 22 5
68jhp_023247 44% 0.729 PF00271 C3_S161 - (0)12 1 / 13 / 23 6
69jhp_018837 47% 0.544 PF08541 C2_S153 - (32)17 1 / 10 / 9 3
70jhp_126650 45% 0.644 PF03167 C8_S180 - (0)20 1 / 8 / 29 11
71jhp_116225 52% 0.396 PF07973 C3_S138 - (21)13 1 / 4 / 7 6
72jhp_038920 35% 0.541 PF02978 C6_S153 - (0)6 1 / 4 / 1 3
73jhp_099310 37% 0.483 PF08241 C1_S131 - (16)3 1 / 4 / - 2
74jhp_129420 31% 0.478 PF03446 C2_S134 - (27)5 1 / 2 / 1 2
75jhp_093120 32% 0.446 PF01396 C3_S113 - (0)2 1 / - / 1 1
76jhp_140016 67% 0.527 PF03435 C2_S122 - (18)1 1 / - / - 1
77jhp_037367 44% 0.527 PF03331 C13_S1107 - (0)20 - / 38 / 23 21
78jhp_008267 100% 0.574 PF01048 C1_S195 - (50)20 - / 38 / 20 15
79jhp_023942 53% 0.506 PF00709 C4_S170 - (52)18 - / 31 / 10 7
80jhp_018469 73% 0.636 PF00334 C7_S160 - (51)20 - / 26 / 28 13
81jhp_119844 48% 0.724 PF00290 C2_S143 - (23)20 - / 24 / 16 17
82jhp_034158 39% 0.566 PF02729 C9_S155 - (43)19 - / 23 / 11 6
83jhp_132745 44% 0.465 PF00551 C5_S179 - (15)12 - / 23 / 4 8
84jhp_072968 95% 0.515 PF01327 C2_S176 - (12)20 - / 21 / 33 11
85jhp_126451 49% 0.588 PF00162 C7_S183 - (73)15 - / 21 / 25 8
86jhp_112939 44% 0.367 PF00005 C1_S168 - (67)5 - / 19 / - 3
87jhp_133445 48% 0.586 PF00160 C4_S1149 - (2)5 - / 18 / 4 2
88jhp_076849 61% 0.508 PF00478 C2_S168 - (47)20 - / 17 / 25 5
89jhp_096820 38% 0.420 PF02353 C2_S162 - (35)9 - / 16 / 5 0
90jhp_097737 100% 0.761 PF01230 C4_S174 - (0)16 - / 15 / 13 9
91jhp_014134 65% 0.564 PF00154 C1_S132 - (0)11 - / 15 / 9 5
92jhp_000527 54% 0.677 PF00215 C2_S140 - (28)10 - / 13 / 3 3
93jhp_054729 34% 0.317 PF00005 C2_S127 - (26)6 - / 11 / 2 4
94jhp_024913 57% 0.604 PF10431 C4_S113 - (0)6 - / 11 / - 3
95jhp_068545 39% 0.539 PF08402 C1_S141 - (0)12 - / 10 / 19 7
96jhp_107525 38% 0.490 PF01746 C4_S127 - (18)10 - / 10 / 11 5
97jhp_035633 98% 0.594 PF09336 C1_S126 - (25)3 - / 10 / 5 2
98jhp_052427 53% 0.571 PF02882 C7_S151 - (38)14 - / 9 / 10 4
99jhp_137326 49% 0.442 PF00587 C1_S126 - (24)6 - / 9 / 7 4
100jhp_034332 39% 0.441 PF00005 C3_S176 - (76)7 - / 9 / 6 4

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