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]
200SA044823 100% 0.637 PF01588 C2_S118 - (1)3 - / 3 / 1 2
201SA237020 98% 0.637 PF02852 C5_S142 - (29)1 2 / - / - 1
202SA167440 62% 0.637 PF08402 C1_S135 - (0)14 - / 17 / 15 7
203SA00860 33% 0.637 PF02038 1 - (0)? - / - / - 0
204SA188915 40% 0.637 PF00403 1 - (0)? - / - / - 0
205SA22640 42% 0.637 PF07714 2 - (0)? - / - / - 0
206SA188570 44% 0.636 PF00271 C4_S189 - (0)16 17 / 16 / 24 5
207SA235617 50% 0.636 PF00062 13 - (0)? - / - / - 0
208SA122920 61% 0.636 PF00132 C3_S169 - (48)5 - / - / 4 0
209SA204319 68% 0.636 PF00203 4 - (0)? - / - / - 0
210SA10274 35% 0.636 PF08478 7 - (0)? - / - / - 0
211SA097214 47% 0.635 PF03602 19 - (0)? - / - / - 0
212SA153520 98% 0.635 PF08534 16 - (0)4 - / - / - 0
213SA216120 97% 0.635 PF00583 33 - (22)? - / - / - 0
214SA234720 98% 0.635 PF00155 C1_S136 - (26)2 - / - / 2 2
215SA075915 100% 0.635 PF03960 C2_S116 - (0)1 - / - / 1 0
216SA196016 56% 0.635 PF02302 3 - (0)? - / - / - 0
217SA160921 54% 0.634 PF01293 C3_S139 - (35)6 9 / 4 / - 2
218SA168010 37% 0.634 PF00578 20 - (0)? - / - / - 0
219SA071939 97% 0.634 PF07992 C2_S1113 - (100)13 6 / 12 / 8 4
220SA012223 58% 0.634 PF00106 C1_S177 - (59)6 2 / 1 / 1 1
221SA206717 40% 0.634 PF00154 13 - (11)? - / - / - 0
222SA08780 30% 0.634 PF09457 0 - (0)? - / - / - 0
223SA168153 49% 0.634 PF00202 C1_S198 - (43)20 - / - / 49 8
224SA092423 50% 0.634 PF00551 C4_S193 - (5)4 - / - / 3 1
225SA20899 100% 0.633 PF03144 27 - (0)? - / - / - 0
226SA095822 99% 0.633 PF00459 C4_S132 - (12)8 - / - / 1 1
227SA030115 57% 0.633 PF04227 C5_S111 - (0)7 - / - / 5 3
228SA10200 53% 0.632 PF05822 1 - (0)? - / - / - 0
229SA125970 100% 0.632 PF00186 C6_S1163 - (83)20 65 / 7 / 9 10
230SA115215 26% 0.632 PF00717 6 - (0)? - / - / - 0
231SA073158 81% 0.631 PF03952 C1_S148 - (33)12 - / 3 / 33 6
232SA145315 100% 0.631 PF02082 C3_S15 - (0)? - / - / 1 0
233SA055820 42% 0.631 PF03358 16 - (12)? - / - / - 0
234SA013425 65% 0.631 PF01676 C5_S116 - (3)7 - / - / 8 3
235SA15475 39% 0.631 PF02378 0 - (0)? - / - / - 0
236SA034631 47% 0.630 PF01053 C1_S121 - (16)10 - / 2 / 11 4
237SA00965 73% 0.630 PF04507 0 - (0)? - / - / - 0
238SA100417 100% 0.630 PF11546 3 - (0)? - / - / - 0
239SA02518 38% 0.630 PF00072 5 - (0)? - / - / - 0
240SA044920 98% 0.630 PF01026 C2_S19 - (0)1 - / - / 2 1
241SA210511 37% 0.630 PF00069 17 - (0)? - / - / - 0
242SA03138 60% 0.629 PF01597 10 - (0)? - / - / - 0
243SA031019 100% 0.629 PF07859 39 - (1)? - / - / - 0
244SA144219 100% 0.629 PF01596 34 - (24)1 - / - / - 0
245SA248020 100% 0.629 PF08450 16 - (0)? - / - / - 0
246SA049913 45% 0.629 PF05175 40 - (27)? - / - / - 0
247SA166611 41% 0.628 PF00072 1 - (0)? - / - / - 0
248SA067920 37% 0.628 PF00155 C1_S122 - (16)5 - / - / 4 2
249SA0975_10 50% 0.628 PF01783 1 - (0)? - / - / - 0
250SA169213 48% 0.627 PF01965 5 - (0)? - / - / - 0

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