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]
200SA189629 45% 0.517 PF08543 C1_S157 - (39)9 - / 9 / 6 2
201SA081728 39% 0.558 PF00724 C3_S171 - (39)2 1 / 4 / 5 1
202SA039328 98% 0.467 PF01123 C8_S111 - (0)3 - / - / 7 1
203SA080328 98% 0.515 PF02789 C5_S116 - (1)7 - / - / 5 0
204SA110128 59% 0.614 PF00696 C1_S128 - (18)7 - / 3 / 4 3
205SA050828 42% 0.573 PF00155 C1_S129 - (21)10 - / - / 13 5
206SA056228 69% 0.548 PF00107 C1_S160 - (36)7 - / - / 6 0
207SA085528 64% 0.571 PF00579 C5_S131 - (23)11 6 / 1 / 6 3
208SA060528 49% 0.546 PF02733 C6_S146 - (27)8 - / - / 8 1
209SA025928 100% 0.537 PF05025 C5_S126 - (0)6 - / - / 13 1
210SA160828 64% 0.518 PF00438 C3_S110 - (6)6 - / - / 7 1
211SA192128 63% 0.507 PF00265 C8_S140 - (39)9 7 / 14 / 3 5
212SA022428 44% 0.456 PF02737 C1_S139 - (36)7 5 / 2 / 1 2
213SA072728 100% 0.545 PF00044 C4_S115 - (9)2 5 / 3 / - 1
214SA225228 33% 0.554 PF09383 C1_S121 - (0)11 - / - / 15 5
215SA131028 35% 0.552 PF00710 C4_S116 - (16)5 - / - / 12 3
216SA022527 37% 0.552 PF02771 C2_S155 - (37)3 6 / 3 / - 2
217SA083127 99% 0.484 PF02852 C1_S199 - (94)9 14 / 3 / 6 4
218SA157127 52% 0.617 PF01063 C6_S171 - (63)16 - / 8 / 13 5
219SA023427 45% 0.561 PF01156 C4_S159 - (30)9 - / - / 19 4
220SA091527 49% 0.672 PF02882 C5_S149 - (41)14 2 / 18 / 8 5
221SA199627 56% 0.522 PF02502 C7_S148 - (36)11 - / - / 2 1
222SA138727 48% 0.593 PF00271 C4_S140 - (0)7 - / 1 / 6 1
223SA155827 68% 0.517 PF00793 C2_S134 - (33)4 - / - / 10 2
224SA187427 100% 0.573 PF01168 C1_S151 - (40)6 - / 5 / 15 3
225SA038827 99% 0.484 PF01123 C6_S118 - (0)3 - / - / 7 0
226SA146127 52% 0.530 PF00156 C2_S151 - (37)7 - / 3 / 12 4
227SA130727 81% 0.614 PF01926 C1_S127 - (0)3 - / 8 / 6 2
228SA108327 44% 0.583 PF01746 C5_S129 - (18)12 - / 21 / 4 5
229SA052727 49% 0.611 PF01182 C4_S117 - (11)12 - / - / 13 7
230SA018226 40% 0.576 PF02776 C6_S138 - (15)5 - / 7 / 1 2
231SA083726 33% 0.480 PF00682 C1_S125 - (16)9 - / - / 7 1
232SA239026 63% 0.642 PF02261 C4_S145 - (8)2 4 / - / 1 1
233SA231226 37% 0.539 PF02826 C1_S152 - (44)5 2 / 3 / 7 1
234SA090226 36% 0.565 PF00155 C1_S143 - (32)9 - / 1 / 19 3
235SA202026 45% 0.517 PF00005 C1_S146 - (0)6 - / - / 9 3
236SA000726 45% 0.671 PF03853 C2_S161 - (46)7 - / 8 / - 4
237SA117026 64% 0.464 PF06628 C7_S123 - (4)4 14 / - / 2 1
238SA092826 41% 0.348 PF00005 C1_S118 - (0)5 - / - / 10 3
239SA038526 94% 0.489 PF01123 C6_S120 - (0)5 - / 4 / 8 1
240SA048726 49% 0.667 PF12464 C1_S182 - (56)6 - / - / 13 1
241SA051626 100% 0.605 PF00383 C4_S144 - (11)6 2 / 3 / 5 1
242SA036626 76% 0.555 PF00578 C1_S110 - (0)4 - / - / 1 0
243SA136026 49% 0.618 PF00557 C2_S119 - (1)4 - / 1 / 3 0
244SA113726 40% 0.473 PF00488 C5_S170 - (0)2 - / 11 / 11 0
245SA234426 50% 0.442 PF00702 C1_S117 - (0)8 - / 5 / 5 4
246SA019826 40% 0.514 PF09383 C3_S114 - (0)8 - / - / 8 5
247SA120226 39% 0.533 PF00218 C3_S136 - (9)13 - / 5 / 5 6
248SA192726 100% 0.593 PF01116 C3_S121 - (18)7 - / - / 15 5
249SA153126 61% 0.591 PF05222 C3_S178 - (67)9 11 / - / 6 2
250SA038325 50% 0.385 PF01123 C10_S117 - (0)4 - / 4 / 6 1

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