Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000000823 (STRA3: Streptococcus agalactiae serotype III - Nov 2015)

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]
50gbs103321 38% 0.546 PF01509 C3_S139 - (0)1 3 / 1 / 1 0
51gbs056920 58% 0.639 PF00106 C1_S1143 - (70)2 3 / 1 / - 1
52gbs169428 71% 0.606 PF02733 C11_S147 - (25)8 3 / - / 7 0
53gbs193010 60% 0.602 PF00258 C3_S138 - (35)2 3 / - / - 1
54gbs118044 47% 0.630 PF01288 C7_S188 - (37)18 2 / 21 / 16 9
55gbs094744 68% 0.621 PF00056 C7_S140 - (30)5 2 / 14 / 7 2
56gbs079751 47% 0.615 PF00271 C6_S153 - (0)11 2 / 12 / 16 6
57gbs084132 67% 0.533 PF00171 C4_S120 - (0)8 2 / 10 / 1 4
58gbs194722 43% 0.624 PF00512 C3_S132 - (30)5 2 / 10 / - 3
59gbs016730 52% 0.528 PF00871 C8_S153 - (44)20 2 / 8 / 15 12
60gbs088629 72% 0.466 PF01409 C4_S120 - (13)11 2 / 6 / 6 9
61gbs084422 50% 0.538 PF00485 C2_S137 - (21)10 2 / 5 / 5 6
62gbs167123 35% 0.483 PF00512 C3_S129 - (24)6 2 / 4 / 1 3
63gbs101919 38% 0.543 PF00512 C3_S130 - (23)4 2 / 3 / - 3
64gbs061028 67% 0.538 PF00275 C8_S126 - (15)9 2 / 2 / 7 4
65gbs152311 57% 0.522 PF00534 C7_S15 - (0)2 2 / 2 / - 1
66gbs078817 69% 0.539 PF08245 C1_S142 - (19)5 2 / 2 / - 4
67gbs208219 36% 0.461 PF00512 C1_S129 - (25)4 2 / 1 / 1 2
68gbs104020 45% 0.481 PF01751 C2_S113 - (0)6 2 / - / 6 2
69gbs017120 70% 0.523 PF14748 C1_S120 - (12)3 2 / - / 3 1
70gbs169224 54% 0.588 PF02733 C6_S141 - (23)6 2 / - / 3 0
71gbs076412 82% 0.377 PF03830 C6_S18 - (0)5 2 / - / 2 2
72gbs044220 42% 0.537 PF01210 C1_S122 - (16)2 2 / - / 1 2
73gbs210117 50% 0.442 PF13932 C1_S124 - (19)2 2 / - / - 1
74gbs150318 42% 0.476 PF02852 C2_S144 - (30)1 2 / - / - 1
75gbs17966 79% 0.545 PF02852 C3_S150 - (45)2 2 / - / - 1
76gbs159450 79% 0.606 PF12804 C4_S150 - (33)20 1 / 27 / 15 12
77gbs028633 63% 0.539 PF02540 C6_S156 - (50)11 1 / 11 / 13 5
78gbs145527 75% 0.674 PF02224 C3_S132 - (29)11 1 / 10 / 8 6
79gbs186918 58% 0.526 PF10431 C2_S117 - (0)6 1 / 10 / 1 3
80gbs068430 64% 0.533 PF07973 C3_S126 - (10)14 1 / 8 / 9 7
81gbs058320 29% 0.497 PF00962 C2_S131 - (5)13 1 / 7 / 5 12
82gbs027927 52% 0.547 PF00271 C5_S142 - (0)4 1 / 4 / 4 3
83gbs082923 48% 0.430 PF07973 C2_S122 - (20)7 1 / 4 / 4 5
84gbs043019 37% 0.565 PF00512 C3_S133 - (26)4 1 / 3 / - 3
85gbs088326 62% 0.516 PF00275 C6_S119 - (11)6 1 / 2 / 6 3
86gbs166417 36% 0.460 PF08245 C2_S124 - (13)4 1 / 2 / 1 3
87gbs139320 69% 0.643 PF01070 C3_S142 - (31)3 1 / 2 / - 2
88gbs127023 98% 0.777 PF08124 C1_S129 - (0)10 1 / 1 / 9 3
89gbs005426 65% 0.614 PF00107 C1_S158 - (33)8 1 / 1 / 2 2
90gbs189124 99% 0.528 PF00106 C1_S161 - (46)5 1 / - / 3 1
91gbs088715 62% 0.453 PF00583 C2_S144 - (24)2 1 / - / 2 1
92gbs161921 55% 0.549 PF01842 C1_S145 - (37)2 1 / - / 1 1
93gbs137020 48% 0.443 PF02008 C3_S199 - (33)? 1 / - / - 0
94gbs159167 73% 0.628 PF01048 C1_S191 - (49)20 - / 37 / 17 13
95gbs093944 42% 0.563 PF00485 C3_S1122 - (39)20 - / 35 / 7 12
96gbs001490 62% 0.598 PF00156 C4_S1123 - (50)19 - / 31 / 42 12
97gbs031158 57% 0.623 PF00160 C1_S1128 - (5)14 - / 29 / 9 2
98gbs155466 57% 0.524 PF06827 C5_S1161 - (0)5 - / 27 / 40 2
99gbs185944 74% 0.523 PF00709 C3_S171 - (54)18 - / 27 / 14 7
100gbs180951 63% 0.603 PF00162 C8_S182 - (72)18 - / 25 / 20 8

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