Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000000751 (Staphylococcus - Mars 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]
100SA12547 100% 0.144 PF01467 12 - (6)? - / - / - 0
101SA152215 100% 0.588 PF01039 2 - (0)? - / - / - 0
102SAP01819 100% 0.748 PF01451 C8_S113 - (2)1 - / - / 3 1
103SA053723 100% 0.563 PF08543 C2_S155 - (44)8 - / 14 / 3 2
104SA171621 100% 0.488 PF01425 C5_S149 - (0)3 - / - / 3 2
105SA004114 100% 0.579 PF00480 31 - (25)? - / - / - 0
106SA102820 100% 0.578 PF02491 17 - (0)? - / - / - 0
107SA097368 100% 0.577 PF01467 C2_S1112 - (89)20 - / 24 / 38 10
108SA032222 100% 0.537 PF01047 C2_S131 - (0)? - / 9 / 3 0
109SA248020 100% 0.629 PF08450 16 - (0)? - / - / - 0
110SA23948 100% 0.598 PF03306 9 - (0)4 - / - / - 0
111SA181919 100% 0.734 PF02876 5 - (0)? - / - / - 0
112SA002315 100% 0.715 PF02590 C2_S112 - (0)? - / 1 / - 0
113SA082023 100% 0.587 PF03009 C2_S124 - (17)3 - / - / 1 0
114SA025928 100% 0.537 PF05025 C5_S126 - (0)6 - / - / 13 1
115SA171710 100% 0.571 PF02686 2 - (0)? - / - / - 0
116SA093420 100% 0.385 PF00381 21 - (0)? - / - / - 0
117SA175812 100% 0.727 PF02821 6 - (6)? - / - / - 0
118SA207919 100% 0.603 PF01497 C2_S141 - (0)5 2 / 1 / 1 2
119SA091632 100% 0.679 PF00731 C9_S138 - (28)12 - / 1 / 16 4
120SA239313 100% 0.622 PF08546 C2_S138 - (23)4 5 / - / - 2
121SA044058 100% 0.734 PF01712 C2_S185 - (43)20 18 / 12 / 20 21
122SA1841_11 100% 0.400 PF00089 2 - (0)? - / - / - 0
123SA09613 100% 0.282 PF07408 0 - (0)? - / - / - 0
124SA057311 100% 0.651 PF01047 7 - (0)? - / - / - 0
125SA206623 100% 0.560 PF02391 C3_S118 - (0)6 - / - / 8 1
126SA20979 100% 0.550 PF03738 12 - (0)? - / - / - 0
127SA145315 100% 0.631 PF02082 C3_S15 - (0)? - / - / 1 0
128SA220720 100% 0.390 PF07968 5 - (0)? - / - / - 0
129SA04569 100% 0.707 PF00056 8 - (0)2 - / - / - 0
130SA080520 100% 0.494 PF03061 C1_S135 - (0)2 - / - / 2 1
131SA027512 100% 0.493 PF00069 0 - (0)? - / - / - 0
132SA110349 100% 0.596 PF01255 C8_S196 - (25)20 3 / 19 / 24 14
133SA170111 100% 0.700 PF07730 C2_S122 - (20)1 - / 1 / - 1
134SA10038 100% 0.694 PF12199 0 - (0)? - / - / - 0
135SA003924 100% 0.463 PF00905 C5_S137 - (0)15 - / - / 17 6
136SA16599 100% 0.573 PF00397 34 - (0)? - / - / - 0
137SA031019 100% 0.629 PF07859 39 - (1)? - / - / - 0
138SA1730106 100% 0.680 PF02898 C9_S1414 - (28)20 104 / - / 14 11
139SA231725 100% 0.599 PF00583 C1_S132 - (0)7 2 / - / 5 2
140SA058720 100% 0.627 PF01297 C9_S11 - (0)1 - / - / 1 1
141SA144219 100% 0.629 PF01596 34 - (24)1 - / - / - 0
142SA188757 100% 0.619 PF01820 C1_S181 - (57)11 - / 18 / 22 3
143SA172420 100% 0.517 PF00206 C2_S115 - (7)4 - / 1 / 3 2
144SA115918 100% 0.722 PF00072 6 - (0)1 - / - / - 0
145SA025411 100% 0.499 PF07702 8 - (0)? - / - / - 0
146SA098016 100% 0.646 PF01497 C1_S124 - (0)? 1 / - / - 0
147SA107118 100% 0.493 PF03061 C1_S113 - (0)2 - / 1 / 2 1
148SA016018 100% 0.545 PF03992 C5_S136 - (0)4 16 / - / - 2
149SA171520 100% 0.542 PF02637 0 - (0)? - / - / - 0
150SA170016 100% 0.594 PF00072 2 - (0)? - / - / - 0

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