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]
50bsu2954021 37% 0.458 PF01513 C1_S133 - (28)20 - / 3 / 22 15
51bsu3599045 44% 0.673 PF02525 C1_S1153 - (70)20 - / 6 / 8 1
52bsu1675036 58% 0.592 PF02774 C2_S169 - (35)20 12 / 12 / 14 9
53bsu2308051 55% 0.652 PF01487 C4_S157 - (40)20 - / - / 40 9
54bsu2376054 49% 0.564 PF00485 C3_S1132 - (37)20 5 / 33 / 6 17
55bsu2263066 43% 0.589 PF00290 C3_S157 - (27)20 - / 4 / 41 16
56bsu1653053 58% 0.608 PF01255 C4_S1111 - (32)20 6 / 25 / 24 15
57bsu1824051 53% 0.589 PF02786 C1_S161 - (30)20 1 / 15 / 31 19
58bsu4032074 71% 0.595 PF00491 C7_S151 - (22)20 - / - / 32 12
59bsu3129068 54% 0.515 PF16657 C1_S1100 - (0)20 - / - / 51 9
60bsu2434050 68% 0.595 PF02786 C1_S163 - (31)20 1 / 15 / 31 19
61bsu0073076 84% 0.600 PF00291 C2_S183 - (53)20 - / 8 / 60 9
62bsu1456054 66% 0.601 PF01327 C5_S1112 - (23)20 - / 8 / 24 8
63bsu1572095 67% 0.552 PF01327 C5_S1109 - (15)20 - / 23 / 52 10
64bsu0781083 73% 0.563 PF16657 C1_S1110 - (0)20 - / - / 50 11
65bsu0138079 51% 0.605 PF00557 C2_S180 - (0)20 - / - / 52 32
66bsu2516063 39% 0.542 PF02401 C9_S1124 - (0)20 - / 3 / 76 14
67bsu0009050 80% 0.573 PF00478 C2_S172 - (50)19 - / 18 / 26 7
68bsu23360105 75% 0.570 PF00160 C5_S1151 - (1)19 2 / 45 / 24 5
69bsu2264085 61% 0.590 PF00291 C3_S184 - (75)19 7 / 13 / 44 10
70bsu3750043 100% 0.775 PF00891 C1_S194 - (52)19 4 / 27 / 18 7
71bsu2813038 51% 0.641 PF00490 C8_S139 - (22)18 - / 1 / 27 2
72bsu3778051 70% 0.554 PF00171 C4_S153 - (0)18 - / 17 / 15 6
73bsu1768055 100% 0.716 PF00303 C8_S172 - (38)18 - / 9 / 30 7
74bsu2182058 98% 0.702 PF00303 C8_S175 - (41)18 - / 9 / 32 7
75bsu1017040 45% 0.509 PF08541 C2_S152 - (31)18 - / 3 / 15 4
76bsu2564050 100% 0.636 PF01467 C1_S178 - (45)18 10 / 10 / 13 7
77bsu3637038 52% 0.593 PF07977 C2_S123 - (0)18 - / - / 13 0
78bsu1809039 73% 0.555 PF01751 C3_S136 - (0)17 4 / 13 / 11 13
79bsu1110040 55% 0.470 PF02868 C9_S139 - (0)17 - / 1 / 7 5
80bsu2274038 41% 0.619 PF00348 C1_S151 - (32)17 - / - / 23 6
81bsu0046031 37% 0.507 PF00288 C1_S166 - (46)17 - / 6 / 13 6
82bsu0662032 69% 0.522 PF03119 C6_S134 - (20)17 - / 11 / 12 0
83bsu2812049 99% 0.673 PF00202 C1_S1102 - (40)17 - / - / 48 7
84bsu2913043 100% 0.868 PF00180 C7_S156 - (52)17 - / 13 / 23 5
85bsu1133037 58% 0.542 PF08541 C2_S151 - (31)17 - / 6 / 13 3
86bsu0321049 90% 0.555 PF00171 C4_S153 - (0)17 - / 16 / 13 6
87bsu1470040 55% 0.470 PF02868 C8_S139 - (0)17 - / 1 / 7 5
88bsu0050049 51% 0.534 PF12804 C1_S158 - (37)16 - / 22 / 18 9
89bsu0166025 100% 0.558 PF01915 C1_S134 - (15)16 - / - / 14 4
90bsu0745043 48% 0.589 PF00107 C2_S172 - (51)16 25 / 2 / 9 3
91bsu2726069 53% 0.627 PF00291 C2_S181 - (52)16 - / 4 / 50 6
92bsu2244053 37% 0.517 PF03099 C5_S170 - (22)16 17 / 13 / 17 8
93bsu3213041 88% 0.640 PF00478 C2_S146 - (28)16 - / 3 / 17 3
94bsu3690065 80% 0.849 PF00464 C1_S1101 - (50)16 - / 1 / 60 4
95bsu2997067 58% 0.555 PF00291 C3_S168 - (46)15 - / 5 / 48 6
96bsu2716083 67% 0.579 PF00067 C3_S1157 - (31)15 82 / 2 / 10 5
97bsu3692030 55% 0.527 PF02502 C9_S150 - (37)15 - / - / 9 3
98bsu2831022 47% 0.594 PF02776 C5_S182 - (38)15 12 / 4 / 10 4
99bsu2895032 72% 0.527 PF07973 C1_S127 - (9)15 1 / 6 / 15 7
100bsu1734072 100% 0.514 PF01423 C5_S187 - (0)15 - / - / 48 4

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