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]
50bsu2971085 35% 0.543 PF00850 C2_S1145 - (0)20 - / 7 / 61 4
51bsu0079062 52% 0.626 PF01288 C6_S1102 - (43)20 2 / 27 / 30 9
52bsu1760075 76% 0.568 PF01261 C3_S176 - (67)20 - / - / 40 15
53bsu0284066 57% 0.502 PF16657 C1_S1100 - (0)20 - / - / 44 8
54bsu2434050 68% 0.595 PF02786 C1_S163 - (31)20 1 / 15 / 31 19
55bsu0073076 84% 0.600 PF00291 C2_S183 - (53)20 - / 8 / 60 9
56bsu3797056 100% 0.634 PF03167 C7_S193 - (0)20 - / 9 / 32 12
57bsu2263066 43% 0.589 PF00290 C3_S157 - (27)20 - / 4 / 41 16
58bsu0584066 50% 0.538 PF00232 C2_S195 - (73)20 - / - / 38 19
59bsu1572095 67% 0.552 PF01327 C5_S1109 - (15)20 - / 23 / 52 10
60bsu2273081 72% 0.639 PF00334 C7_S177 - (76)20 - / 45 / 31 12
61bsu2947035 58% 0.647 PF00871 C6_S157 - (51)20 2 / 15 / 12 12
62bsu3129068 54% 0.515 PF16657 C1_S1100 - (0)20 - / - / 51 9
63bsu1486068 82% 0.531 PF02786 C2_S160 - (28)20 2 / 17 / 28 19
64bsu1880082 72% 0.517 -C4_S1104 - (12)20 - / - / 52 23
65bsu2516063 39% 0.542 PF02401 C9_S1124 - (0)20 - / 3 / 76 14
66bsu2349075 57% 0.580 PF01048 C3_S182 - (43)20 - / 7 / 53 20
67bsu23360105 75% 0.570 PF00160 C5_S1151 - (1)19 2 / 45 / 24 5
68bsu2264085 61% 0.590 PF00291 C3_S184 - (75)19 7 / 13 / 44 10
69bsu0009050 80% 0.573 PF00478 C2_S172 - (50)19 - / 18 / 26 7
70bsu3750043 100% 0.775 PF00891 C1_S194 - (52)19 4 / 27 / 18 7
71bsu1768055 100% 0.716 PF00303 C8_S172 - (38)18 - / 9 / 30 7
72bsu3778051 70% 0.554 PF00171 C4_S153 - (0)18 - / 17 / 15 6
73bsu2564050 100% 0.636 PF01467 C1_S178 - (45)18 10 / 10 / 13 7
74bsu2813038 51% 0.641 PF00490 C8_S139 - (22)18 - / 1 / 27 2
75bsu1017040 45% 0.509 PF08541 C2_S152 - (31)18 - / 3 / 15 4
76bsu2182058 98% 0.702 PF00303 C8_S175 - (41)18 - / 9 / 32 7
77bsu3637038 52% 0.593 PF07977 C2_S123 - (0)18 - / - / 13 0
78bsu0046031 37% 0.507 PF00288 C1_S166 - (46)17 - / 6 / 13 6
79bsu1133037 58% 0.542 PF08541 C2_S151 - (31)17 - / 6 / 13 3
80bsu2913043 100% 0.868 PF00180 C7_S156 - (52)17 - / 13 / 23 5
81bsu1110040 55% 0.470 PF02868 C9_S139 - (0)17 - / 1 / 7 5
82bsu0662032 69% 0.522 PF03119 C6_S134 - (20)17 - / 11 / 12 0
83bsu2812049 99% 0.673 PF00202 C1_S1102 - (40)17 - / - / 48 7
84bsu1470040 55% 0.470 PF02868 C8_S139 - (0)17 - / 1 / 7 5
85bsu2274038 41% 0.619 PF00348 C1_S151 - (32)17 - / - / 23 6
86bsu0321049 90% 0.555 PF00171 C4_S153 - (0)17 - / 16 / 13 6
87bsu1809039 73% 0.555 PF01751 C3_S136 - (0)17 4 / 13 / 11 13
88bsu2244053 37% 0.517 PF03099 C5_S170 - (22)16 17 / 13 / 17 8
89bsu0745043 48% 0.589 PF00107 C2_S172 - (51)16 25 / 2 / 9 3
90bsu0166025 100% 0.558 PF01915 C1_S134 - (15)16 - / - / 14 4
91bsu2726069 53% 0.627 PF00291 C2_S181 - (52)16 - / 4 / 50 6
92bsu0050049 51% 0.534 PF12804 C1_S158 - (37)16 - / 22 / 18 9
93bsu3213041 88% 0.640 PF00478 C2_S146 - (28)16 - / 3 / 17 3
94bsu3690065 80% 0.849 PF00464 C1_S1101 - (50)16 - / 1 / 60 4
95bsu0859020 44% 0.468 PF00561 C1_S158 - (7)15 - / 2 / 10 3
96bsu1734072 100% 0.514 PF01423 C5_S187 - (0)15 - / - / 48 4
97bsu2905091 100% 0.634 PF00248 C5_S1151 - (87)15 31 / 6 / 25 4
98bsu2716083 67% 0.579 PF00067 C3_S1157 - (31)15 82 / 2 / 10 5
99bsu2827051 77% 0.622 PF00180 C5_S155 - (46)15 - / 6 / 31 4
100bsu2831022 47% 0.594 PF02776 C5_S182 - (38)15 12 / 4 / 10 4

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