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]
100bsu2905091 100% 0.634 PF00248 C5_S1151 - (87)15 31 / 6 / 25 4
101bsu01370104 100% 0.604 PF05191 C3_S1153 - (137)15 76 / 27 / - 6
102bsu1818043 50% 0.478 PF00483 C1_S178 - (70)15 - / 14 / 22 5
103bsu3439029 97% 0.845 PF00135 C1_S1100 - (24)15 - / - / 11 0
104bsu0859020 44% 0.468 PF00561 C1_S158 - (7)15 - / 2 / 10 3
105bsu2997067 58% 0.555 PF00291 C3_S168 - (46)15 - / 5 / 48 6
106bsu2831022 47% 0.594 PF02776 C5_S182 - (38)15 12 / 4 / 10 4
107bsu3756037 52% 0.521 PF07973 C2_S127 - (11)15 4 / 15 / 4 8
108bsu2716083 67% 0.579 PF00067 C3_S1157 - (31)15 82 / 2 / 10 5
109bsu1595053 54% 0.586 PF02978 C8_S170 - (0)15 4 / 13 / 16 4
110bsu0456070 50% 0.572 PF01820 C1_S1109 - (82)15 2 / 35 / 21 4
111bsu2431034 53% 0.646 PF02882 C4_S144 - (32)15 2 / 15 / 15 6
112bsu3829020 100% 0.931 PF02581 C2_S153 - (40)15 - / 11 / 12 0
113bsu1568038 69% 0.564 PF00625 C3_S146 - (34)14 3 / 15 / 10 5
114bsu0743051 34% 0.613 PF00271 C4_S140 - (0)14 2 / 15 / 14 7
115bsu2741028 50% 0.437 PF07973 C1_S127 - (21)14 3 / 6 / 8 6
116bsu0082035 79% 0.534 PF01336 C5_S142 - (28)14 - / 11 / 6 6
117bsu0458072 48% 0.633 PF00271 C2_S169 - (0)14 7 / 22 / 29 7
118bsu2361027 55% 0.448 PF00293 C2_S1107 - (44)14 - / - / 18 4
119bsu2733025 54% 0.532 PF00485 C1_S148 - (35)14 4 / 9 / 8 7
120bsu2530039 100% 0.636 PF00383 C3_S135 - (23)14 - / - / 31 6
121bsu0651047 54% 0.595 PF00551 C2_S1144 - (20)14 - / 12 / 23 5
122bsu0725083 66% 0.549 PF00067 C3_S1157 - (29)14 82 / 1 / 11 5
123bsu0929043 74% 0.531 PF00370 C3_S164 - (64)14 - / 3 / 24 4
124bsu1125047 60% 0.581 PF02729 C5_S165 - (46)14 - / 9 / 22 6
125bsu1560054 54% 0.715 PF14306 C1_S1101 - (89)14 2 / 41 / 6 6
126bsu1784039 66% 0.636 PF00903 C1_S151 - (0)14 - / - / 27 4
127bsu3198025 99% 0.810 PF13193 C4_S162 - (18)14 3 / 9 / 3 7
128bsu0145061 53% 0.529 PF08402 C1_S146 - (0)13 - / 16 / 26 7
129bsu3252034 100% 0.589 PF00266 C1_S140 - (26)13 - / 1 / 11 2
130bsu1121040 44% 0.561 PF00696 C1_S179 - (66)13 - / 5 / 17 4
131bsu2289029 62% 0.687 PF02224 C2_S133 - (27)13 1 / 10 / 9 6
132bsu3502031 100% 0.656 PF01182 C4_S121 - (16)13 - / - / 18 7
133bsu1091051 54% 0.633 PF14306 C2_S183 - (76)13 2 / 36 / 5 8
134bsu3911066 100% 0.551 PF00271 C1_S157 - (0)13 3 / 17 / 29 7
135bsu0236034 50% 0.635 PF01182 C5_S122 - (17)13 - / - / 17 6
136bsu3455027 100% 0.673 PF13419 C1_S122 - (11)13 - / 5 / 12 8
137bsu1225048 35% 0.468 PF08402 C1_S145 - (0)13 - / 24 / 10 6
138bsu1467028 50% 0.529 PF00459 C6_S137 - (29)13 - / - / 10 3
139bsu1591044 73% 0.563 PF00106 C1_S164 - (36)13 14 / 3 / 10 2
140bsu2495046 38% 0.502 PF00005 C1_S146 - (0)13 - / 7 / 30 7
141bsu0400049 52% 0.528 PF00180 C6_S152 - (42)13 - / 4 / 26 3
142bsu3789032 44% 0.579 PF01041 C1_S167 - (0)13 - / 4 / 9 5
143bsu1188034 51% 0.605 PF01053 C1_S122 - (16)12 - / 1 / 16 5
144bsu0883039 40% 0.668 PF08402 C1_S125 - (0)12 - / 1 / 17 5
145bsu2566057 45% 0.553 PF08501 C6_S168 - (63)12 5 / 15 / 26 4
146bsu2396034 64% 0.544 PF08402 C1_S129 - (0)12 - / 16 / 9 5
147bsu1312020 49% 0.518 PF14850 C1_S134 - (26)12 6 / - / 8 5
148bsu3479043 71% 0.511 PF07992 C3_S1113 - (96)12 6 / 19 / 7 3
149bsu0006036 73% 0.601 PF01751 C3_S131 - (0)12 2 / 16 / 5 8
150bsu0822058 55% 0.482 PF00005 C2_S199 - (88)12 - / 27 / 12 5

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