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]
1bsu3872030 100% 0.655 PF03853 C2_S159 - (49)20 1 / 7 / 23 9
2bsu22420105 51% 0.626 PF02569 C4_S1308 - (241)20 13 / 44 / 26 6
3bsu1134045 100% 0.544 PF02801 C3_S153 - (5)20 - / 5 / 18 9
4bsu2267066 43% 0.504 PF00591 C7_S191 - (1)20 - / 22 / 33 8
5bsu2912067 85% 0.584 PF00056 C5_S1103 - (68)20 41 / 13 / 8 6
6bsu1963058 99% 0.595 PF01048 C3_S157 - (38)20 - / - / 50 17
7bsu0584066 50% 0.538 PF00232 C2_S195 - (73)20 - / - / 38 19
8bsu1884061 100% 0.890 PF00722 C8_S173 - (0)20 1 / 2 / 36 9
9bsu0763094 99% 0.574 PF02898 C7_S1335 - (0)20 90 / - / 10 7
10bsu3393061 81% 0.876 PF00162 C5_S192 - (80)20 - / 26 / 24 9
11bsu0073076 84% 0.600 PF00291 C2_S183 - (53)20 - / 8 / 60 9
12bsu1161022 59% 0.539 PF01513 C2_S141 - (32)20 - / 8 / 15 13
13bsu0091089 63% 0.585 PF02542 C10_S193 - (67)20 - / - / 68 7
14bsu2273081 72% 0.639 PF00334 C7_S177 - (76)20 - / 45 / 31 12
15bsu1549056 100% 0.625 PF02729 C8_S157 - (43)20 - / 20 / 13 8
16bsu1486068 82% 0.531 PF02786 C2_S160 - (28)20 2 / 17 / 28 19
17bsu1653053 58% 0.608 PF01255 C4_S1111 - (32)20 6 / 25 / 24 15
18bsu4042047 79% 0.592 PF00709 C5_S191 - (67)20 - / 31 / 19 8
19bsu0138079 51% 0.605 PF00557 C2_S180 - (0)20 - / - / 52 32
20bsu2181076 56% 0.668 PF00186 C4_S1117 - (73)20 42 / 19 / 13 11
21bsu0248031 95% 0.580 PF00150 C1_S154 - (39)20 - / 3 / 14 7
22bsu0077072 67% 0.658 PF00809 C3_S189 - (33)20 - / - / 61 26
23bsu1880082 72% 0.517 -C4_S1104 - (12)20 - / - / 52 23
24bsu2727077 73% 0.621 PF01048 C1_S1117 - (62)20 - / 52 / 19 16
25bsu2434050 68% 0.595 PF02786 C1_S163 - (31)20 1 / 15 / 31 19
26bsu1813032 99% 0.539 PF00150 C1_S159 - (42)20 - / 3 / 14 7
27bsu1760075 76% 0.568 PF01261 C3_S176 - (67)20 - / - / 40 15
28bsu0871052 51% 0.592 PF00202 C1_S192 - (38)20 - / - / 46 8
29bsu1502061 98% 0.501 PF01467 C2_S1138 - (86)20 - / 12 / 28 9
30bsu2387075 37% 0.528 PF11798 C3_S1316 - (294)20 - / 3 / 51 12
31bsu2547062 88% 0.592 PF00012 C2_S165 - (0)20 7 / 28 / 10 9
32bsu1613065 43% 0.616 PF00290 C1_S153 - (24)20 - / 4 / 41 16
33bsu0284066 57% 0.502 PF16657 C1_S1100 - (0)20 - / - / 44 8
34bsu3392056 69% 0.555 PF00121 C7_S153 - (30)20 - / - / 32 0
35bsu1824051 53% 0.589 PF02786 C1_S161 - (30)20 1 / 15 / 31 19
36bsu0769052 52% 0.628 PF00557 C2_S181 - (0)20 - / - / 32 11
37bsu3797056 100% 0.634 PF03167 C7_S193 - (0)20 - / 9 / 32 12
38bsu1655072 44% 0.472 PF13288 C3_S1118 - (55)20 7 / 41 / 28 18
39bsu3784066 54% 0.528 PF00483 C1_S180 - (72)20 - / 15 / 39 8
40bsu2771089 52% 0.600 PF01702 C5_S1102 - (37)20 2 / 27 / 45 44
41bsu1675036 58% 0.592 PF02774 C2_S169 - (35)20 12 / 12 / 14 9
42bsu2428054 48% 0.542 PF00348 C1_S179 - (68)20 - / 1 / 39 7
43bsu2954021 37% 0.458 PF01513 C1_S133 - (28)20 - / 3 / 22 15
44bsu2376054 49% 0.564 PF00485 C3_S1132 - (37)20 5 / 33 / 6 17
45bsu0028065 53% 0.613 PF01712 C2_S193 - (51)20 13 / 23 / 21 21
46bsu2971085 35% 0.543 PF00850 C2_S1145 - (0)20 - / 7 / 61 4
47bsu1456054 66% 0.601 PF01327 C5_S1112 - (23)20 - / 8 / 24 8
48bsu0239079 48% 0.576 PF01063 C6_S1222 - (150)20 - / 11 / 75 0
49bsu3456070 100% 0.535 PF16657 C1_S1101 - (0)20 - / - / 46 10
50bsu0781083 73% 0.563 PF16657 C1_S1110 - (0)20 - / - / 50 11

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