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]
150SA241641 42% 0.456 PF08402 C1_S122 - (0)11 - / 6 / 12 5
151SA233748 48% 0.457 PF07670 C9_S165 - (0)11 5 / 28 / 10 7
152SA242029 39% 0.449 PF00245 C7_S118 - (5)11 - / - / 5 1
153SA188757 100% 0.619 PF01820 C1_S181 - (57)11 - / 18 / 22 3
154SA098529 93% 0.454 PF01409 C3_S120 - (13)11 2 / 6 / 6 9
155SA085528 64% 0.571 PF00579 C5_S131 - (23)11 6 / 1 / 6 3
156SA249241 41% 0.530 PF00005 C1_S131 - (0)10 - / 18 / 8 5
157SA045320 34% 0.451 PF00288 C1_S156 - (43)10 - / 3 / 7 4
158SA050828 42% 0.573 PF00155 C1_S129 - (21)10 - / - / 13 5
159SA200323 39% 0.421 PF08124 C1_S129 - (0)10 - / 2 / 13 3
160SA016638 37% 0.511 PF08402 C1_S121 - (0)10 - / 8 / 10 5
161SA034631 47% 0.630 PF01053 C1_S121 - (16)10 - / 2 / 11 4
162SA145934 45% 0.513 PF02580 C9_S119 - (0)10 - / 1 / 7 1
163SA196520 67% 0.596 PF00408 C1_S117 - (16)10 - / - / 9 7
164SA221755 48% 0.368 PF00005 C2_S159 - (59)10 - / 30 / 6 6
165SA097629 100% 0.533 PF04650 C4_S148 - (0)10 6 / - / 12 4
166SA020646 51% 0.526 PF00005 C2_S132 - (0)10 - / 11 / 15 5
167SA185421 41% 0.515 PF00814 C5_S123 - (21)10 - / 16 / - 5
168SA121835 36% 0.482 PF00005 C1_S128 - (0)10 - / 7 / 16 5
169SA159922 34% 0.585 PF00923 C6_S127 - (1)10 - / - / 20 4
170SA138539 38% 0.650 PF00005 C1_S148 - (0)10 - / 6 / 15 4
171SA128725 46% 0.543 PF01336 C4_S131 - (23)10 - / 13 / - 5
172SA088836 38% 0.460 PF00005 C1_S145 - (0)10 - / 1 / 23 5
173SA155420 36% 0.515 PF13193 C3_S162 - (23)10 - / 4 / 6 5
174SA155231 100% 0.526 PF04650 C4_S147 - (0)10 6 / - / 9 4
175SA047320 99% 0.529 PF02152 C5_S130 - (14)10 - / - / 11 10
176SAP02231 38% 0.589 PF00005 C1_S122 - (0)10 - / - / 19 5
177SA084731 40% 0.482 PF00005 C1_S129 - (0)10 - / 3 / 14 5
178SA169735 45% 0.445 PF01451 C7_S122 - (2)10 - / - / 16 6
179SA099747 51% 0.653 PF01177 C1_S152 - (35)10 - / 1 / 37 4
180SA195931 98% ? PF01380 C2_S114 - (13)10 - / - / 11 5
181SA102949 100% 0.668 PF00091 C6_S158 - (0)10 1 / 31 / 12 5
182SA153126 61% 0.591 PF05222 C3_S178 - (67)9 11 / - / 6 2
183SA090226 36% 0.565 PF00155 C1_S143 - (32)9 - / 1 / 19 3
184SA000642 99% 0.545 PF00521 C7_S180 - (0)9 - / 1 / 28 0
185SA127225 45% 0.581 PF05222 C1_S130 - (26)9 5 / 6 / 5 2
186SA168525 45% 0.477 PF14815 C2_S148 - (0)9 13 / - / 6 2
187SA246920 27% 0.497 PF00155 C1_S131 - (22)9 - / 2 / 6 4
188SA024520 62% 0.494 PF01128 C1_S135 - (28)9 - / 3 / 5 4
189SA000934 52% 0.404 PF00587 C4_S126 - (26)9 - / 12 / 10 5
190SA083127 99% 0.484 PF02852 C1_S199 - (94)9 14 / 3 / 6 4
191SA189629 45% 0.517 PF08543 C1_S157 - (39)9 - / 9 / 6 2
192SA083726 33% 0.480 PF00682 C1_S125 - (16)9 - / - / 7 1
193SA077620 49% 0.592 PF00266 C1_S151 - (37)9 - / - / 13 2
194SA091725 97% 0.565 PF02222 C1_S148 - (36)9 - / 6 / 13 5
195SA114421 74% 0.574 PF01715 C3_S143 - (20)9 - / - / 7 4
196SA242536 54% 0.601 PF00696 C5_S146 - (20)9 - / 8 / 14 2
197SA237540 37% 0.553 PF01180 C2_S1145 - (86)9 40 / 2 / 4 4
198SA118421 52% ? PF00694 C2_S127 - (11)9 - / 1 / 6 4
199SA192128 63% 0.507 PF00265 C8_S140 - (39)9 7 / 14 / 3 5
200SA023427 45% 0.561 PF01156 C4_S159 - (30)9 - / - / 19 4

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