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]
200SA084829 35% 0.415 PF08402 C1_S122 - (0)8 - / - / 8 4
201SA114140 99% 0.510 PF00370 C4_S159 - (59)14 - / 1 / 19 4
202SA071939 97% 0.634 PF07992 C2_S1113 - (100)13 6 / 12 / 8 4
203SA139420 48% 0.374 PF00587 C1_S121 - (18)4 - / 2 / 2 4
204SA011615 32% 0.391 PF14860 C3_S112 - (0)4 1 / 1 / 2 3
205SA199520 99% 0.543 PF00294 C2_S141 - (32)8 - / 5 / 4 3
206SA011320 99% 0.545 PF02423 C2_S141 - (24)5 4 / - / - 3
207SA187427 100% 0.573 PF01168 C1_S151 - (40)6 - / 5 / 15 3
208SA105420 41% 0.528 PF02441 C3_S121 - (16)6 5 / - / 7 3
209SA048314 75% 0.536 PF10431 C2_S117 - (0)6 - / 13 / - 3
210SA022620 30% 0.558 PF13193 C2_S150 - (20)3 1 / 1 / 1 3
211SA048625 42% 0.541 PF00749 C4_S135 - (32)4 - / 3 / 5 3
212SA152124 61% 0.588 PF00365 C6_S116 - (4)6 - / - / 10 3
213SA130620 43% 0.553 PF01210 C2_S119 - (14)5 4 / - / 2 3
214SA061632 39% 0.479 PF08402 C1_S120 - (0)8 - / 5 / 9 3
215SA090226 36% 0.565 PF00155 C1_S143 - (32)9 - / 1 / 19 3
216SA112720 35% 0.475 PF03453 C2_S110 - (0)4 - / 1 / 3 3
217SA133620 43% 0.514 PF00479 C3_S120 - (17)6 1 / 1 / 6 3
218SA151122 34% 0.577 PF01121 C4_S125 - (19)6 3 / 3 / 2 3
219SA132222 49% 0.439 PF00512 C2_S136 - (32)5 2 / 10 / - 3
220SA155637 33% 0.466 PF00850 C9_S141 - (0)20 - / 6 / 21 3
221SA034421 58% 0.526 PF01717 C2_S114 - (9)8 1 / - / 7 3
222SA104723 54% 0.659 PF00215 C1_S142 - (28)12 - / 11 / 5 3
223SA233620 54% 0.512 PF10431 C2_S117 - (0)6 - / 11 / - 3
224SA241339 42% 0.491 PF00175 C2_S1145 - (131)7 17 / 14 / - 3
225SA051412 35% 0.643 PF01712 C1_S173 - (48)5 1 / 7 / 2 3
226SA191814 40% 0.484 PF01300 C6_S114 - (0)3 1 / - / 3 3
227SA165622 57% 0.533 PF01230 C5_S178 - (0)7 - / 2 / 4 3
228SA172918 59% 0.516 PF02057 C2_S140 - (5)8 - / - / 5 3
229SA186347 54% 0.529 PF00180 C5_S154 - (47)15 - / 9 / 22 3
230SA146720 55% 0.508 PF05496 C2_S126 - (0)7 - / 10 / 5 3
231SA184521 35% 0.431 PF00294 C1_S127 - (17)7 - / 1 / 6 3
232SA221220 30% 0.472 PF00155 C1_S131 - (22)6 - / - / 7 3
233SA092826 41% 0.348 PF00005 C1_S118 - (0)5 - / - / 10 3
234SA045825 78% 0.654 PF13793 C9_S129 - (25)5 - / - / 11 3
235SA077423 63% 0.596 PF00005 C1_S116 - (0)6 - / 2 / 3 3
236SA097722 100% 0.574 PF05031 C12_S161 - (0)7 15 / 1 / 3 3
237SA065424 99% 0.497 PF00294 C1_S148 - (35)7 - / 2 / 6 3
238SA156113 36% 0.549 PF08245 C1_S130 - (16)3 2 / 1 / - 3
239SA020721 99% 0.575 PF00104 C1_S142 - (0)5 - / - / 7 3
240SA136720 51% 0.531 PF08669 C3_S18 - (6)4 - / - / 3 3
241SA200323 39% 0.421 PF08124 C1_S129 - (0)10 - / 2 / 13 3
242SA188757 100% 0.619 PF01820 C1_S181 - (57)11 - / 18 / 22 3
243SA094019 67% 0.538 PF07521 C1_S117 - (0)4 5 / 1 / 3 3
244SA192624 52% 0.529 PF00275 C6_S121 - (12)6 - / 5 / 3 3
245SA154220 37% 0.461 PF03009 C3_S114 - (4)5 - / - / 3 3
246SA158631 68% 0.619 PF00885 C4_S137 - (29)2 - / 1 / 10 3
247SA117246 79% 0.538 PF00478 C2_S158 - (41)19 - / 7 / 24 3
248SA079321 46% 0.558 PF13193 C4_S164 - (32)8 - / 9 / 3 3
249SA193822 99% 0.589 PF07831 C3_S112 - (3)5 - / - / 6 3
250SA030115 57% 0.633 PF04227 C5_S111 - (0)7 - / - / 5 3

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