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]
50bsu0051023 100% 0.595 PF13793 C7_S115 - (12)5 - / - / 8 3
51bsu2819018 100% 0.615 PF01926 C2_S138 - (0)3 - / 6 / - 2
52bsu179003 100% 0.514 PF10747 4 - (0)2 - / - / - 0
53bsu2207012 100% 0.606 PF00156 C1_S124 - (10)3 - / 2 / 2 2
54bsu3566019 100% 0.543 PF00534 C2_S130 - (19)4 5 / - / 1 1
55bsu2315019 100% 0.725 PF00578 C1_S117 - (0)1 - / - / 1 1
56bsu3933020 100% 0.697 PF04616 C1_S132 - (0)7 - / - / 8 2
57bsu243604 100% 0.634 PF12685 1 - (0)? - / - / - 0
58bsu042507 100% 0.605 PF01037 8 - (0)? - / - / - 0
59bsu0128020 100% 0.561 PF00673 0 - (0)? - / - / - 0
60bsu0798020 100% 0.643 PF01522 18 - (0)? - / - / - 0
61bsu0226011 100% 0.590 PF12697 16 - (0)? - / - / - 0
62bsu2913043 100% 0.868 PF00180 C7_S156 - (52)17 - / 13 / 23 5
63bsu1080018 100% 0.578 PF05163 C4_S114 - (0)2 - / - / 3 1
64bsu127603 100% 0.880 PF12937 13 - (0)? - / - / - 0
65bsu4040018 100% 0.563 PF00512 C3_S140 - (25)8 3 / 9 / 1 4
66bsu261206 100% 0.483 PF11436 2 - (0)? - / - / - 0
67bsu196807 100% 0.573 PF06855 0 - (0)? - / - / - 0
68bsu1673012 100% 0.594 PF02826 41 - (35)1 - / - / - 0
69bsu3455027 100% 0.673 PF13419 C1_S122 - (11)13 - / 5 / 12 8
70bsu3063014 100% 0.524 PF00293 C3_S116 - (0)2 - / 1 / 2 2
71bsu3754011 100% 0.751 PF01361 C2_S119 - (0)1 - / - / 2 1
72bsu2833014 100% 0.371 PF00583 18 - (16)? - / - / - 0
73bsu076409 100% 0.603 PF00708 C5_S19 - (7)2 - / - / 1 0
74bsu121506 100% 0.518 PF14172 C3_S17 - (0)1 - / - / 1 1
75bsu1549056 100% 0.625 PF02729 C8_S157 - (43)20 - / 20 / 13 8
76bsu0910019 100% 0.850 PF00313 C4_S139 - (0)4 2 / 2 / - 0
77bsu1142032 100% 0.575 PF00579 C4_S135 - (24)11 4 / 3 / 6 3
78bsu313907 100% 0.548 PF00575 4 - (0)? - / - / - 0
79bsu3092019 100% 0.590 PF01636 C1_S140 - (0)1 - / - / 2 1
80bsu2837024 100% 0.549 PF03725 C1_S18 - (0)3 - / 1 / 3 3
81bsu2949020 100% 0.593 PF08534 C1_S119 - (0)4 - / - / 1 1
82bsu3268020 100% 0.500 PF01592 4 - (0)? - / - / - 0
83bsu1529053 100% 0.623 PF00091 C3_S156 - (0)10 1 / 30 / 13 5
84bsu1823020 100% 0.576 PF00682 11 - (0)? - / - / - 0
85bsu0839016 100% 0.638 PF12867 7 - (0)? - / - / - 0
86bsu1920014 100% 0.607 PF00072 10 - (0)1 - / - / - 0
87bsu0660025 100% 0.692 PF01884 C2_S127 - (0)7 - / 2 / 6 3
88bsu1453020 100% 0.594 PF07521 C1_S129 - (0)6 5 / 4 / 6 3
89bsu263003 100% 0.300 PF01386 3 - (0)? - / - / - 0
90bsu0653020 100% 0.598 PF02844 C1_S127 - (17)2 - / 3 / 3 2
91bsu3492021 100% 0.568 PF01634 C5_S118 - (6)1 - / - / 2 1
92bsu3954024 100% 0.483 PF02275 C6_S115 - (10)8 - / - / 4 0
93bsu357909 100% 0.544 PF01238 12 - (0)1 - / - / - 0
94bsu3207011 100% 0.530 PF06725 C3_S18 - (0)5 - / - / 6 2
95bsu170206 100% 0.718 PF06133 6 - (6)? - / - / - 0
96bsu280007 100% 0.435 PF03775 1 - (0)? - / - / - 0
97bsu2564050 100% 0.636 PF01467 C1_S178 - (45)18 10 / 10 / 13 7
98bsu2898010 100% 0.374 PF01695 C5_S110 - (9)1 - / - / 2 1
99bsu4029018 100% 0.839 PF00583 10 - (0)? - / - / - 0
100bsu310403 100% 0.542 PF03473 0 - (0)? - / - / - 0

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