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]
100jhp_002231 46% 0.548 PF00285 C9_S115 - (11)7 - / 4 / 8 3
101jhp_074036 55% 0.391 PF00926 C9_S124 - (0)7 - / - / 19 3
102jhp_098026 40% 0.513 PF00275 C8_S136 - (21)7 2 / 2 / 6 4
103jhp_079030 79% 0.584 PF00478 C1_S155 - (40)7 - / 4 / 8 4
104jhp_014520 99% 0.694 PF01202 C2_S164 - (51)7 - / 2 / 4 3
105jhp_142821 54% 0.445 PF05222 C2_S169 - (68)7 4 / 4 / 3 2
106jhp_061533 45% 0.586 PF00155 C1_S144 - (37)7 - / 1 / 24 2
107jhp_077820 97% 0.463 PF02719 C1_S167 - (61)7 14 / 1 / 2 2
108jhp_098917 55% 0.452 PF07194 C3_S118 - (18)7 - / - / 13 4
109jhp_071424 99% 0.626 PF00696 C1_S126 - (17)7 - / 3 / 4 3
110jhp_031318 49% 0.506 PF07991 C6_S128 - (19)7 - / 4 / 3 3
111jhp_078226 49% 0.559 PF08543 C1_S168 - (53)7 - / - / 7 0
112jhp_141551 50% 0.524 PF03372 C1_S1121 - (2)7 - / 5 / 24 1
113jhp_012222 47% 0.592 PF01474 C4_S112 - (9)7 - / 2 / 5 3
114jhp_034332 39% 0.441 PF00005 C3_S176 - (76)7 - / 9 / 6 4
115jhp_124522 63% 0.529 PF00206 C3_S117 - (10)7 - / - / 7 2
116jhp_054729 34% 0.317 PF00005 C2_S127 - (26)6 - / 11 / 2 4
117jhp_056717 54% 0.484 PF08245 C1_S130 - (19)6 3 / 3 / - 2
118jhp_101521 91% 0.583 PF01041 C1_S150 - (29)6 - / - / 7 2
119jhp_073524 100% 0.455 PF00994 C5_S113 - (0)6 - / - / 5 2
120jhp_135425 49% 0.471 PF00034 C5_S146 - (35)6 15 / - / - 2
121jhp_137326 49% 0.442 PF00587 C1_S126 - (24)6 - / 9 / 7 4
122jhp_076424 98% 0.605 PF07992 C3_S197 - (84)6 9 / 3 / 1 2
123jhp_108621 94% 0.566 PF02661 C8_S124 - (0)6 5 / 2 / 3 3
124jhp_003720 95% 0.647 PF00483 C2_S153 - (39)6 - / 4 / 1 2
125jhp_113321 45% 0.627 PF00132 C2_S1114 - (72)6 - / - / 13 1
126jhp_149120 34% 0.476 PF00814 C4_S122 - (22)6 - / 6 / 1 3
127jhp_026844 40% 0.570 PF01202 C4_S165 - (62)6 5 / 16 / 14 2
128jhp_110527 45% 0.570 PF01676 C6_S115 - (2)6 - / - / 7 3
129jhp_038920 35% 0.541 PF02978 C6_S153 - (0)6 1 / 4 / 1 3
130jhp_104623 99% 0.611 PF01019 C1_S120 - (0)6 - / - / 2 0
131jhp_030425 45% 0.578 PF00625 C4_S145 - (32)6 - / 5 / 2 2
132jhp_010819 42% 0.429 PF01751 C4_S115 - (0)6 2 / - / 5 2
133jhp_024913 57% 0.604 PF10431 C4_S113 - (0)6 - / 11 / - 3
134jhp_148926 45% 0.573 PF03740 C10_S119 - (18)6 - / - / 10 3
135jhp_142920 62% 0.594 PF00107 C1_S146 - (34)6 8 / - / - 2
136jhp_056020 51% 0.574 PF01336 C5_S142 - (30)6 - / 5 / 3 2
137jhp_032320 49% 0.541 PF00117 C2_S113 - (9)6 - / - / 5 3
138jhp_059323 47% 0.533 PF00275 C6_S120 - (13)6 - / 4 / 4 3
139jhp_060720 51% 0.435 PF14622 C3_S122 - (0)6 - / - / 8 0
140jhp_016225 99% 0.662 PF01116 C5_S120 - (16)6 - / - / 15 4
141jhp_051920 52% 0.568 PF00156 C2_S140 - (30)6 - / 5 / 6 2
142jhp_035324 39% 0.337 PF00702 C3_S117 - (0)6 - / 6 / 2 3
143jhp_027524 97% 0.567 PF00278 C2_S129 - (22)6 - / 2 / 7 2
144jhp_089519 39% 0.533 PF01210 C1_S123 - (15)5 4 / 1 / 1 3
145jhp_129420 31% 0.478 PF03446 C2_S134 - (27)5 1 / 2 / 1 2
146jhp_079219 40% 0.507 PF00294 C1_S144 - (25)5 - / 3 / 5 2
147jhp_036620 69% 0.576 PF05496 C2_S121 - (0)5 4 / 5 / 4 3
148jhp_087622 35% 0.570 PF01168 C3_S145 - (34)5 - / 3 / 13 3
149jhp_063824 53% 0.500 PF00108 C7_S117 - (8)5 - / 2 / 3 2
150jhp_143925 43% 0.600 PF00834 C3_S116 - (7)5 - / - / 4 2

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