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]
200SA105239 99% 0.560 PF00625 C2_S151 - (37)14 4 / 13 / 12 5
201SA073020 99% 0.600 PF01676 C5_S113 - (10)5 - / 6 / 2 2
202SA097813 99% 0.549 PF05031 C3_S152 - (0)3 1 / - / 3 1
203SA064119 99% 0.563 PF01047 26 - (0)1 - / - / - 0
204SA079813 99% 0.730 PF00462 4 - (0)? - / - / - 0
205SA095822 99% 0.633 PF00459 C4_S132 - (12)8 - / - / 1 1
206SA162817 99% 0.608 PF00089 2 - (0)? - / - / - 0
207SA199520 99% 0.543 PF00294 C2_S141 - (32)8 - / 5 / 4 3
208SA13164 99% 0.385 PF03119 C2_S16 - (0)1 - / 1 / - 1
209SA107325 99% 0.613 PF00698 C1_S115 - (11)8 - / - / 6 2
210SA172224 99% 0.655 PF01884 C2_S122 - (4)6 - / 1 / 8 3
211SA245613 99% 0.688 PF02706 C1_S126 - (24)2 - / 3 / 1 1
212SA118859 99% 0.502 PF01751 C2_S165 - (0)20 8 / 29 / 14 18
213SA193216 99% 0.544 PF03630 C4_S131 - (27)4 3 / 3 / - 2
214SA10005 99% 0.665 PF12199 0 - (0)? - / - / - 0
215SA128320 99% 0.457 PF00905 C3_S125 - (0)2 - / - / 1 1
216SA231613 99% 0.502 PF03449 0 - (0)? - / - / - 0
217SA003315 99% 0.712 PF07827 C5_S124 - (14)2 - / - / 2 1
218SA139120 99% 0.552 PF01807 C2_S114 - (0)8 - / 5 / 4 6
219SA098318 99% 0.457 PF03992 C5_S135 - (0)4 16 / - / - 2
220SA011820 99% 0.639 PF03328 C7_S113 - (10)4 - / - / 3 1
221SA237817 99% 0.290 PF12681 5 - (0)? - / - / - 0
222SA083127 99% 0.484 PF02852 C1_S199 - (94)9 14 / 3 / 6 4
223SA022920 99% 0.414 PF00496 C3_S152 - (0)3 - / - / 5 1
224SA169515 99% 0.603 PF02073 C3_S15 - (0)4 - / - / 2 1
225SA12678 99% 0.555 PF01468 3 - (0)? - / - / - 0
226SA074679 99% 0.647 PF00565 C8_S176 - (0)6 - / 65 / 5 2
227SA023237 99% 0.673 PF00056 C5_S136 - (26)4 9 / 13 / 1 2
228SA154022 99% 0.594 PF13185 C4_S114 - (6)3 - / - / 12 2
229SA065424 99% 0.497 PF00294 C1_S148 - (35)7 - / 2 / 6 3
230SA000642 99% 0.545 PF00521 C7_S180 - (0)9 - / 1 / 28 0
231SA020721 99% 0.575 PF00104 C1_S142 - (0)5 - / - / 7 3
232SA098220 99% 0.807 -C2_S118 - (1)5 - / - / 6 1
233SA164220 99% 0.449 PF01123 1 - (0)? - / - / - 0
234SA210420 99% 0.585 PF00459 C3_S134 - (24)6 - / - / 8 0
235SA001119 99% 0.489 PF00561 29 - (19)? - / - / - 0
236SA25027 99% 0.577 PF00825 C2_S12 - (0)1 - / - / 1 0
237SA089820 99% 0.472 PF00378 0 - (0)? - / - / - 0
238SA122823 99% 0.663 PF01113 C3_S131 - (15)5 - / 1 / 2 1
239SA193822 99% 0.589 PF07831 C3_S112 - (3)5 - / - / 6 3
240SA082320 99% 0.596 PF00342 C4_S111 - (11)4 - / - / 4 4
241SA152021 99% 0.557 PF02887 42 - (0)1 - / - / - 0
242SA093520 99% 0.537 PF02896 C4_S17 - (0)3 - / - / 4 2
243SA157813 99% 0.587 PF00581 15 - (0)1 - / - / - 0
244SA163721 99% 0.345 PF07968 54 - (0)1 - / - / - 0
245SA11828 99% 0.244 PF01741 4 - (0)? - / - / - 0
246SA206017 99% 0.539 PF01047 C1_S114 - (0)2 - / - / 1 1
247SA114140 99% 0.510 PF00370 C4_S159 - (59)14 - / 1 / 19 4
248SA038827 99% 0.484 PF01123 C6_S118 - (0)3 - / - / 7 0
249SA240620 99% 0.584 PF00171 0 - (0)? - / - / - 0
250SA17264 99% 0.477 PF09023 0 - (0)? - / - / - 0

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