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]
100bsu2997067 58% 0.555 PF00291 C3_S168 - (46)15 - / 5 / 48 6
101bsu2431034 53% 0.646 PF02882 C4_S144 - (32)15 2 / 15 / 15 6
102bsu1734072 100% 0.514 PF01423 C5_S187 - (0)15 - / - / 48 4
103bsu1818043 50% 0.478 PF00483 C1_S178 - (70)15 - / 14 / 22 5
104bsu3829020 100% 0.931 PF02581 C2_S153 - (40)15 - / 11 / 12 0
105bsu3692030 55% 0.527 PF02502 C9_S150 - (37)15 - / - / 9 3
106bsu2831022 47% 0.594 PF02776 C5_S182 - (38)15 12 / 4 / 10 4
107bsu3439029 97% 0.845 PF00135 C1_S1100 - (24)15 - / - / 11 0
108bsu2716083 67% 0.579 PF00067 C3_S1157 - (31)15 82 / 2 / 10 5
109bsu3756037 52% 0.521 PF07973 C2_S127 - (11)15 4 / 15 / 4 8
110bsu2895032 72% 0.527 PF07973 C1_S127 - (9)15 1 / 6 / 15 7
111bsu0456070 50% 0.572 PF01820 C1_S1109 - (82)15 2 / 35 / 21 4
112bsu01370104 100% 0.604 PF05191 C3_S1153 - (137)15 76 / 27 / - 6
113bsu0743051 34% 0.613 PF00271 C4_S140 - (0)14 2 / 15 / 14 7
114bsu1568038 69% 0.564 PF00625 C3_S146 - (34)14 3 / 15 / 10 5
115bsu0725083 66% 0.549 PF00067 C3_S1157 - (29)14 82 / 1 / 11 5
116bsu0458072 48% 0.633 PF00271 C2_S169 - (0)14 7 / 22 / 29 7
117bsu0651047 54% 0.595 PF00551 C2_S1144 - (20)14 - / 12 / 23 5
118bsu2361027 55% 0.448 PF00293 C2_S1107 - (44)14 - / - / 18 4
119bsu0082035 79% 0.534 PF01336 C5_S142 - (28)14 - / 11 / 6 6
120bsu3198025 99% 0.810 PF13193 C4_S162 - (18)14 3 / 9 / 3 7
121bsu0929043 74% 0.531 PF00370 C3_S164 - (64)14 - / 3 / 24 4
122bsu1560054 54% 0.715 PF14306 C1_S1101 - (89)14 2 / 41 / 6 6
123bsu2733025 54% 0.532 PF00485 C1_S148 - (35)14 4 / 9 / 8 7
124bsu1784039 66% 0.636 PF00903 C1_S151 - (0)14 - / - / 27 4
125bsu2530039 100% 0.636 PF00383 C3_S135 - (23)14 - / - / 31 6
126bsu1125047 60% 0.581 PF02729 C5_S165 - (46)14 - / 9 / 22 6
127bsu2741028 50% 0.437 PF07973 C1_S127 - (21)14 3 / 6 / 8 6
128bsu2495046 38% 0.502 PF00005 C1_S146 - (0)13 - / 7 / 30 7
129bsu3455027 100% 0.673 PF13419 C1_S122 - (11)13 - / 5 / 12 8
130bsu3789032 44% 0.579 PF01041 C1_S167 - (0)13 - / 4 / 9 5
131bsu1591044 73% 0.563 PF00106 C1_S164 - (36)13 14 / 3 / 10 2
132bsu0145061 53% 0.529 PF08402 C1_S146 - (0)13 - / 16 / 26 7
133bsu3252034 100% 0.589 PF00266 C1_S140 - (26)13 - / 1 / 11 2
134bsu3502031 100% 0.656 PF01182 C4_S121 - (16)13 - / - / 18 7
135bsu0236034 50% 0.635 PF01182 C5_S122 - (17)13 - / - / 17 6
136bsu3911066 100% 0.551 PF00271 C1_S157 - (0)13 3 / 17 / 29 7
137bsu1225048 35% 0.468 PF08402 C1_S145 - (0)13 - / 24 / 10 6
138bsu1091051 54% 0.633 PF14306 C2_S183 - (76)13 2 / 36 / 5 8
139bsu2289029 62% 0.687 PF02224 C2_S133 - (27)13 1 / 10 / 9 6
140bsu1121040 44% 0.561 PF00696 C1_S179 - (66)13 - / 5 / 17 4
141bsu0400049 52% 0.528 PF00180 C6_S152 - (42)13 - / 4 / 26 3
142bsu1467028 50% 0.529 PF00459 C6_S137 - (29)13 - / - / 10 3
143bsu0283036 55% 0.557 PF00106 C1_S1110 - (73)12 19 / 11 / 3 4
144bsu1188034 51% 0.605 PF01053 C1_S122 - (16)12 - / 1 / 16 5
145bsu0642036 80% 0.612 PF00731 C7_S133 - (26)12 - / 1 / 16 4
146bsu1025023 47% 0.584 PF03099 C2_S127 - (17)12 3 / 2 / 13 3
147bsu0822058 55% 0.482 PF00005 C2_S199 - (88)12 - / 27 / 12 5
148bsu3423030 47% 0.571 PF01041 C1_S145 - (0)12 1 / 2 / 13 6
149bsu2566057 45% 0.553 PF08501 C6_S168 - (63)12 5 / 15 / 26 4
150bsu0588020 77% 0.551 PF02156 C1_S146 - (22)12 - / - / 5 2

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