Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000001570 (Bacillus subtilis - May 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]
150bsu1818043 50% 0.478 PF00483 C1_S178 - (70)15 - / 14 / 22 5
151bsu3479043 71% 0.511 PF07992 C3_S1113 - (96)12 6 / 19 / 7 3
152bsu2913043 100% 0.868 PF00180 C7_S156 - (52)17 - / 13 / 23 5
153bsu0929043 74% 0.531 PF00370 C3_S164 - (64)14 - / 3 / 24 4
154bsu2248041 59% 0.467 PF02142 C3_S137 - (26)6 - / - / 28 2
155bsu2902041 74% 0.627 PF00044 C1_S137 - (19)3 4 / 11 / 2 2
156bsu3213041 88% 0.640 PF00478 C2_S146 - (28)16 - / 3 / 17 3
157bsu3526041 40% 0.554 PF08402 C1_S123 - (0)10 - / 14 / 7 5
158bsu3076040 35% 0.578 PF00005 C1_S133 - (0)11 - / 1 / 21 5
159bsu1110040 55% 0.470 PF02868 C9_S139 - (0)17 - / 1 / 7 5
160bsu1470040 55% 0.470 PF02868 C8_S139 - (0)17 - / 1 / 7 5
161bsu1017040 45% 0.509 PF08541 C2_S152 - (31)18 - / 3 / 15 4
162bsu1121040 44% 0.561 PF00696 C1_S179 - (66)13 - / 5 / 17 4
163bsu1766040 100% 0.502 PF00692 C7_S1135 - (89)7 - / - / 24 3
164bsu0078040 63% 0.593 PF02152 C5_S137 - (25)12 - / - / 22 8
165bsu1809039 73% 0.555 PF01751 C3_S136 - (0)17 4 / 13 / 11 13
166bsu2743039 62% 0.613 PF08402 C1_S142 - (0)12 - / 21 / 7 5
167bsu0108039 53% 0.421 PF04998 69 - (0)0 - / - / - 0
168bsu1784039 66% 0.636 PF00903 C1_S151 - (0)14 - / - / 27 4
169bsu2270039 40% 0.518 PF01202 C3_S154 - (49)6 7 / 14 / 10 2
170bsu0883039 40% 0.668 PF08402 C1_S125 - (0)12 - / 1 / 17 5
171bsu2416039 56% 0.612 PF02737 C2_S139 - (34)6 3 / 12 / 8 2
172bsu2530039 100% 0.636 PF00383 C3_S135 - (23)14 - / - / 31 6
173bsu0359038 59% 0.553 PF08402 C1_S131 - (0)10 - / 16 / 14 5
174bsu2274038 41% 0.619 PF00348 C1_S151 - (32)17 - / - / 23 6
175bsu0346038 44% 0.639 PF00215 126 - (118)3 - / - / - 0
176bsu3942038 61% 0.640 PF01791 C2_S137 - (9)8 - / - / 14 2
177bsu0869038 61% 0.408 PF00005 C2_S132 - (0)9 - / 18 / 4 6
178bsu2415038 55% 0.547 PF02771 C2_S134 - (34)6 8 / 15 / - 4
179bsu0809038 40% 0.542 PF02852 C2_S191 - (71)5 26 / - / 1 1
180bsu2813038 51% 0.641 PF00490 C8_S139 - (22)18 - / 1 / 27 2
181bsu3637038 52% 0.593 PF07977 C2_S123 - (0)18 - / - / 13 0
182bsu1568038 69% 0.564 PF00625 C3_S146 - (34)14 3 / 15 / 10 5
183bsu3155038 34% 0.383 PF00005 C5_S138 - (0)8 - / - / 20 5
184bsu1187038 50% 0.586 PF01053 C1_S121 - (15)10 - / 2 / 15 4
185bsu2759037 55% 0.552 PF02580 C10_S123 - (0)11 - / 3 / 9 1
186bsu3717037 57% 0.452 PF02771 C1_S135 - (35)7 7 / 11 / 5 3
187bsu1133037 58% 0.542 PF08541 C2_S151 - (31)17 - / 6 / 13 3
188bsu1311037 58% 0.546 PF02844 C7_S159 - (7)12 - / 23 / - 8
189bsu3756037 52% 0.521 PF07973 C2_S127 - (11)15 4 / 15 / 4 8
190bsu0090037 38% 0.512 PF01128 C1_S142 - (32)9 - / 19 / 5 3
191bsu1002037 59% 0.613 PF00266 C1_S152 - (41)3 - / - / 35 1
192bsu1530036 99% 0.731 PF00082 C2_S134 - (0)2 - / - / 8 1
193bsu3948036 54% 0.638 PF08402 C1_S120 - (0)7 - / 15 / 1 4
194bsu1030036 99% 0.755 PF00082 C1_S134 - (0)2 - / - / 8 1
195bsu0048036 100% 0.623 PF01042 C6_S122 - (0)5 - / - / 7 0
196bsu1136036 37% 0.497 PF00005 C1_S137 - (0)9 - / 2 / 6 4
197bsu0006036 73% 0.601 PF01751 C3_S131 - (0)12 2 / 16 / 5 8
198bsu1675036 58% 0.592 PF02774 C2_S169 - (35)20 12 / 12 / 14 9
199bsu3282036 75% 0.460 PF02771 C2_S145 - (38)5 9 / 9 / 8 2
200bsu3327036 51% 0.588 PF08402 C1_S118 - (0)8 - / 12 / 2 4

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