Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000001584 (Mycobacterium tuberculosis April 2016)

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]
150Rv2461c20 100% 0.497 PF00574 77 - (0)0 - / - / - 0
151Rv2878c13 100% 0.571 PF00578 3 - (0)? - / - / - 0
152Rv1542c24 100% 0.610 PF01152 C6_S1105 - (0)8 19 / - / 3 2
153Rv0948c18 100% 0.537 PF01817 C4_S110 - (7)2 - / - / 2 1
154Rv0470c22 100% 0.789 PF02353 C1_S154 - (28)11 3 / 18 / 3 4
155Rv0045c15 100% 0.557 PF12697 26 - (0)? - / - / - 0
156Rv3800c20 100% 0.490 PF00975 C2_S18 - (0)1 - / - / 7 0
157Rv3671c17 100% 0.620 PF13180 13 - (0)? - / - / - 0
158Rv2109c20 100% 0.563 PF00227 34 - (0)1 - / - / - 0
159Rv000999 100% 0.662 PF00160 C6_S1140 - (0)20 - / 43 / 26 5
160Rv0844c12 100% 0.746 PF00072 25 - (0)0 - / - / - 0
161Rv167715 100% 0.759 PF00578 5 - (0)? - / - / - 0
162Rv3624c71 100% 0.692 PF00156 C4_S1117 - (57)20 2 / 20 / 39 9
163Rv0858c45 100% 0.666 PF00155 C1_S171 - (47)20 - / 4 / 31 6
164Rv2460c20 100% 0.514 PF00574 77 - (0)0 - / - / - 0
165Rv2883c29 100% 0.629 PF00696 C1_S129 - (19)7 - / 3 / 5 3
166Rv030118 100% 0.690 PF01850 1 - (0)? - / - / - 0
167Rv286512 100% 0.620 PF02604 1 - (0)? - / - / - 0
168Rv224321 100% 0.625 PF00698 C2_S118 - (14)9 - / 1 / 3 2
169Rv073387 100% 0.697 PF05191 C1_S1157 - (144)13 40 / 39 / 3 4
170Rv104914 100% 0.562 PF01047 C1_S154 - (0)1 - / 1 / - 0
171Rv2377c15 100% 0.474 PF03621 4 - (0)? - / - / - 0
172Rv165320 100% 0.635 PF01960 66 - (0)? - / - / - 0
173Rv3778c17 100% 0.629 PF00266 45 - (33)? - / - / - 0
174Rv062313 100% 0.435 PF07704 2 - (0)? - / - / - 0
175Rv0020c13 100% 0.756 PF00498 C1_S18 - (0)? - / 1 / - 0
176Rv2438c19 100% 0.600 PF02540 C2_S134 - (31)1 - / - / 1 1
177Rv1886c20 100% 0.857 PF00756 C2_S112 - (0)2 - / - / 2 0
178Rv168931 100% 0.630 PF00579 C3_S136 - (22)7 - / 8 / 13 5
179Rv3597c8 100% 0.844 PF11774 7 - (0)? - / - / - 0
180Rv3290c31 100% 0.568 PF00202 C2_S142 - (20)6 - / 1 / 12 3
181Rv2976c52 100% 0.615 PF03167 C9_S185 - (0)20 4 / 8 / 27 12
182Rv006220 100% 0.629 PF01341 C4_S163 - (49)13 - / 1 / 10 4
183Rv0014c23 100% 0.510 PF00069 C2_S130 - (2)3 - / - / 3 1
184Rv143859 100% 0.618 PF00121 C7_S153 - (35)19 - / - / 32 12
185Rv093420 100% 0.550 PF12849 2 - (0)? - / - / - 0
186Rv2140c13 100% 0.624 PF01161 6 - (0)1 - / - / - 0
187Rv182624 100% 0.566 PF01597 C1_S116 - (0)7 - / - / 3 0
188Rv2523c13 100% 0.530 PF01648 C6_S130 - (27)1 - / 1 / - 1
189Rv38777 100% 0.755 PF11976 0 - (0)? - / - / - 0
190Rv1985c16 100% 0.581 PF03466 C3_S110 - (0)1 - / - / 1 0
191Rv247028 100% 0.629 PF01152 C5_S155 - (0)4 5 / - / 3 2
192Rv129521 100% 0.406 PF00291 C2_S139 - (33)4 - / 2 / 7 2
193Rv3588c18 100% 0.635 PF00484 C6_S113 - (0)2 - / - / 1 0
194Rv18732 100% 0.646 PF13344 1 - (0)? - / - / - 0
195Rv2779c12 100% 0.428 PF01037 10 - (0)? - / - / - 0
196Rv330773 100% 0.865 PF01048 C5_S186 - (54)20 - / 8 / 60 24
197Rv2764c99 100% 0.654 PF00303 C8_S1162 - (95)20 - / 8 / 70 9
198Rv1445c21 100% 0.684 PF01182 C6_S18 - (5)1 - / - / 1 1
199Rv114320 100% 0.491 PF02515 14 - (12)? - / - / - 0
200Rv18113 100% 0.624 PF07925 0 - (0)? - / - / - 0

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