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]
100SA234931 98% 0.543 PF00494 C6_S148 - (7)20 3 / 18 / 8 17
101SA108039 54% 0.540 PF02978 C4_S161 - (0)13 3 / 13 / 15 4
102SA149415 59% 0.660 PF03900 C4_S18 - (0)4 3 / 11 / - 2
103SA001813 53% 0.614 PF02518 C5_S156 - (45)8 3 / 11 / - 4
104SA151122 34% 0.577 PF01121 C4_S125 - (19)6 3 / 3 / 2 3
105SA193216 99% 0.544 PF03630 C4_S131 - (27)4 3 / 3 / - 2
106SA088423 43% 0.564 PF03099 C4_S132 - (20)12 3 / 2 / 13 3
107SA186120 63% 0.419 PF07991 C4_S127 - (18)8 3 / 2 / 5 4
108SA249422 71% 0.731 PF00313 C6_S139 - (0)4 3 / 2 / - 0
109SA099523 33% 0.444 PF02910 C3_S114 - (12)2 3 / - / - 1
110SA226023 38% 0.446 PF00106 C1_S159 - (49)2 3 / - / - 1
111SA015820 98% 0.586 PF03721 C1_S133 - (16)3 3 / - / - 1
112SA096363 100% 0.538 PF02786 C2_S157 - (24)20 2 / 19 / 21 18
113SA091527 49% 0.672 PF02882 C5_S149 - (41)14 2 / 18 / 8 5
114SA151742 79% 0.621 PF00180 C6_S156 - (52)16 2 / 13 / 23 5
115SA151522 41% 0.400 PF00512 C2_S133 - (30)7 2 / 13 / - 4
116SA197423 36% 0.481 PF01704 C5_S142 - (32)8 2 / 12 / 3 3
117SA153329 57% 0.610 PF00871 C4_S156 - (46)20 2 / 10 / 12 12
118SA143924 63% 0.501 PF00485 C1_S175 - (59)15 2 / 10 / 9 8
119SA132222 49% 0.439 PF00512 C2_S136 - (32)5 2 / 10 / - 3
120SA234633 38% 0.555 PF02826 C2_S153 - (37)11 2 / 9 / 9 4
121SA098529 93% 0.454 PF01409 C3_S120 - (13)11 2 / 6 / 6 9
122SA231226 37% 0.539 PF02826 C1_S152 - (44)5 2 / 3 / 7 1
123SA051626 100% 0.605 PF00383 C4_S144 - (11)6 2 / 3 / 5 1
124SA165120 62% 0.575 PF00762 C2_S124 - (4)7 2 / 2 / 2 4
125SA119719 39% 0.484 PF03446 C2_S132 - (25)4 2 / 2 / - 2
126SA012223 58% 0.634 PF00106 C1_S177 - (59)6 2 / 1 / 1 1
127SA207919 100% 0.603 PF01497 C2_S141 - (0)5 2 / 1 / 1 2
128SA156113 36% 0.549 PF08245 C1_S130 - (16)3 2 / 1 / - 3
129SA109320 45% 0.552 PF01751 C4_S113 - (0)6 2 / - / 5 2
130SA231725 100% 0.599 PF00583 C1_S132 - (0)7 2 / - / 5 2
131SA205120 37% 0.445 PF01751 C3_S118 - (0)4 2 / - / 2 1
132SA194619 35% 0.520 PF05368 C1_S139 - (31)1 2 / - / - 1
133SA237020 98% 0.637 PF02852 C5_S142 - (29)1 2 / - / - 1
134SA240522 34% 0.497 PF00732 C3_S151 - (40)2 2 / - / - 1
135SA250017 52% 0.449 PF01266 C5_S189 - (77)2 2 / - / - 1
136SA091221 50% 0.391 PF00115 C1_S122 - (0)2 2 / - / - 1
137SA102949 100% 0.668 PF00091 C6_S158 - (0)10 1 / 31 / 12 5
138SA047457 100% 0.523 PF01288 C11_S188 - (36)20 1 / 25 / 28 11
139SA234145 59% 0.556 PF00171 C4_S165 - (0)19 1 / 20 / 9 4
140SA142458 72% 0.659 PF08501 C4_S175 - (70)13 1 / 19 / 28 4
141SA135744 100% 0.560 PF02786 C2_S168 - (32)20 1 / 15 / 26 18
142SA130932 100% 0.575 PF02224 C1_S134 - (31)12 1 / 13 / 10 6
143SA209829 46% 0.601 PF02826 C1_S175 - (58)14 1 / 10 / 4 4
144SA150623 43% 0.521 PF07973 C1_S125 - (9)14 1 / 8 / 9 7
145SA051412 35% 0.643 PF01712 C1_S173 - (48)5 1 / 7 / 2 3
146SA014315 35% 0.524 PF00465 C2_S120 - (18)6 1 / 7 / - 3
147SA188616 39% 0.527 PF08245 C2_S141 - (20)11 1 / 6 / - 4
148SA110620 56% 0.581 PF00587 C1_S137 - (26)4 1 / 5 / - 2
149SA144625 50% 0.443 PF07973 C2_S122 - (19)13 1 / 4 / 7 6
150SA081728 39% 0.558 PF00724 C3_S171 - (39)2 1 / 4 / 5 1

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