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]
150SA188616 39% 0.527 PF08245 C2_S141 - (20)11 1 / 6 / - 4
151SA172833 59% 0.531 PF02540 C7_S161 - (54)11 - / 14 / 13 5
152SA134225 69% 0.497 PF03446 C1_S128 - (16)11 - / 3 / 9 5
153SA013748 40% 0.548 PF08402 C1_S146 - (0)11 - / 16 / 19 6
154SA034736 39% 0.519 PF01053 C1_S123 - (17)11 - / 2 / 11 5
155SA199627 56% 0.522 PF02502 C7_S148 - (36)11 - / - / 2 1
156SA084731 40% 0.482 PF00005 C1_S129 - (0)10 - / 3 / 14 5
157SA045320 34% 0.451 PF00288 C1_S156 - (43)10 - / 3 / 7 4
158SA097629 100% 0.533 PF04650 C4_S148 - (0)10 6 / - / 12 4
159SA155231 100% 0.526 PF04650 C4_S147 - (0)10 6 / - / 9 4
160SA155420 36% 0.515 PF13193 C3_S162 - (23)10 - / 4 / 6 5
161SA221755 48% 0.368 PF00005 C2_S159 - (59)10 - / 30 / 6 6
162SA050828 42% 0.573 PF00155 C1_S129 - (21)10 - / - / 13 5
163SA169735 45% 0.445 PF01451 C7_S122 - (2)10 - / - / 16 6
164SA185421 41% 0.515 PF00814 C5_S123 - (21)10 - / 16 / - 5
165SA159922 34% 0.585 PF00923 C6_S127 - (1)10 - / - / 20 4
166SA145934 45% 0.513 PF02580 C9_S119 - (0)10 - / 1 / 7 1
167SA016638 37% 0.511 PF08402 C1_S121 - (0)10 - / 8 / 10 5
168SA249241 41% 0.530 PF00005 C1_S131 - (0)10 - / 18 / 8 5
169SA121835 36% 0.482 PF00005 C1_S128 - (0)10 - / 7 / 16 5
170SA047320 99% 0.529 PF02152 C5_S130 - (14)10 - / - / 11 10
171SA099747 51% 0.653 PF01177 C1_S152 - (35)10 - / 1 / 37 4
172SA138539 38% 0.650 PF00005 C1_S148 - (0)10 - / 6 / 15 4
173SA020646 51% 0.526 PF00005 C2_S132 - (0)10 - / 11 / 15 5
174SA128725 46% 0.543 PF01336 C4_S131 - (23)10 - / 13 / - 5
175SA102949 100% 0.668 PF00091 C6_S158 - (0)10 1 / 31 / 12 5
176SA195931 98% ? PF01380 C2_S114 - (13)10 - / - / 11 5
177SA200323 39% 0.421 PF08124 C1_S129 - (0)10 - / 2 / 13 3
178SAP02231 38% 0.589 PF00005 C1_S122 - (0)10 - / - / 19 5
179SA034631 47% 0.630 PF01053 C1_S121 - (16)10 - / 2 / 11 4
180SA088836 38% 0.460 PF00005 C1_S145 - (0)10 - / 1 / 23 5
181SA196520 67% 0.596 PF00408 C1_S117 - (16)10 - / - / 9 7
182SA090226 36% 0.565 PF00155 C1_S143 - (32)9 - / 1 / 19 3
183SA242536 54% 0.601 PF00696 C5_S146 - (20)9 - / 8 / 14 2
184SA189629 45% 0.517 PF08543 C1_S157 - (39)9 - / 9 / 6 2
185SA192128 63% 0.507 PF00265 C8_S140 - (39)9 7 / 14 / 3 5
186SA083726 33% 0.480 PF00682 C1_S125 - (16)9 - / - / 7 1
187SA083127 99% 0.484 PF02852 C1_S199 - (94)9 14 / 3 / 6 4
188SA025824 99% 0.575 PF00294 C1_S163 - (52)9 - / 5 / 16 4
189SA000642 99% 0.545 PF00521 C7_S180 - (0)9 - / 1 / 28 0
190SA114421 74% 0.574 PF01715 C3_S143 - (20)9 - / - / 7 4
191SA024520 62% 0.494 PF01128 C1_S135 - (28)9 - / 3 / 5 4
192SA091725 97% 0.565 PF02222 C1_S148 - (36)9 - / 6 / 13 5
193SA127225 45% 0.581 PF05222 C1_S130 - (26)9 5 / 6 / 5 2
194SA118421 52% ? PF00694 C2_S127 - (11)9 - / 1 / 6 4
195SA153126 61% 0.591 PF05222 C3_S178 - (67)9 11 / - / 6 2
196SA246920 27% 0.497 PF00155 C1_S131 - (22)9 - / 2 / 6 4
197SA023427 45% 0.561 PF01156 C4_S159 - (30)9 - / - / 19 4
198SA168525 45% 0.477 PF14815 C2_S148 - (0)9 13 / - / 6 2
199SA000934 52% 0.404 PF00587 C4_S126 - (26)9 - / 12 / 10 5
200SA227818 42% 0.607 PF00293 C2_S119 - (0)9 - / - / 7 3

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