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]
150SA099243 100% 0.718 PF00085 C1_S134 - (0)6 - / - / 8 0
151SA069614 98% 0.398 PF00085 2 - (0)1 - / - / - 0
152SA23897 51% 0.457 PF00089 24 - (0)? - / - / - 0
153SA23826 40% 0.319 PF00089 10 - (0)1 - / - / - 0
154SA162817 99% 0.608 PF00089 2 - (0)? - / - / - 0
155SA162717 94% 0.586 PF00089 C1_S123 - (0)4 - / - / 4 1
156SA163118 96% 0.493 PF00089 1 - (0)? - / - / - 0
157SA162919 100% 0.489 PF00089 1 - (0)? - / - / - 0
158SA163019 99% 0.584 PF00089 1 - (0)? - / - / - 0
159SA090120 100% 0.490 PF00089 22 - (0)? - / - / - 0
160SA1841_11 100% 0.400 PF00089 2 - (0)? - / - / - 0
161SA141115 33% 0.475 PF00091 2 - (0)? - / - / - 0
162SA102949 100% 0.668 PF00091 C6_S158 - (0)10 1 / 31 / 12 5
163SA01260 30% 0.206 PF00092 0 - (0)? - / - / - 0
164SA124018 26% 0.172 PF00092 0 - (0)? - / - / - 0
165SAP0149 24% 0.454 PF00098 3 - (0)? - / - / - 0
166SA2013_21 25% 0.250 PF00098 1 - (0)? - / - / - 0
167SA1956_41 35% 0.229 PF00098 2 - (0)? - / - / - 0
168SA00625 22% 0.370 PF00098 3 - (0)? - / - / - 0
169SA05430 36% 0.060 PF00098 0 - (0)? - / - / - 0
170SA24960 40% 0.011 PF00102 6 - (0)? - / - / - 0
171SA22920 22% 0.359 PF00103 0 - (0)? - / - / - 0
172SA020721 99% 0.575 PF00104 C1_S142 - (0)5 - / - / 7 3
173SA13320 50% 0.421 PF00105 2 - (0)? - / - / - 0
174SA13339 29% 0.469 PF00106 40 - (26)? - / - / - 0
175SA236520 32% 0.511 PF00106 C1_S144 - (30)3 7 / - / - 2
176SA226624 38% 0.577 PF00106 C1_S185 - (59)8 7 / 2 / 4 2
177SA112320 34% 0.566 PF00106 35 - (23)? - / - / - 0
178SA211920 61% 0.551 PF00106 C2_S168 - (49)4 5 / - / 2 1
179SA226023 38% 0.446 PF00106 C1_S159 - (49)2 3 / - / - 1
180SA012223 58% 0.634 PF00106 C1_S177 - (59)6 2 / 1 / 1 1
181SA107438 100% 0.661 PF00106 C1_S163 - (41)12 12 / 5 / 8 2
182SA086932 100% 0.614 PF00106 C3_S148 - (30)6 15 / 1 / - 4
183SA20550 46% 0.437 PF00107 0 - (0)? - / - / - 0
184SA198820 69% 0.581 PF00107 42 - (25)? - / - / - 0
185SAP00820 43% 0.596 PF00107 C1_S137 - (23)4 - / 6 / - 2
186SA024219 29% 0.466 PF00107 33 - (22)? - / - / - 0
187SA216018 47% 0.588 PF00107 C1_S133 - (24)5 - / 6 / - 2
188SA024616 27% 0.467 PF00107 31 - (16)? - / - / - 0
189SA225715 33% 0.566 PF00107 17 - (10)? - / - / - 0
190SA023920 33% 0.516 PF00107 C1_S130 - (18)3 1 / 1 / 1 1
191SA024023 36% 0.423 PF00107 C1_S133 - (19)4 - / - / 2 0
192SA198943 45% 0.595 PF00107 C1_S180 - (46)15 21 / 2 / 6 2
193SA056228 69% 0.548 PF00107 C1_S160 - (36)7 - / - / 6 0
194SA14412 29% 0.414 PF00108 2 - (0)? - / - / - 0
195SA23183 40% 0.407 PF00108 4 - (0)1 - / - / - 0
196SA053420 48% 0.490 PF00108 19 - (7)? - / - / - 0
197SA022322 55% 0.439 PF00108 C3_S118 - (7)3 - / 1 / 2 1
198SA034223 58% 0.582 PF00108 C5_S115 - (5)3 - / 1 / 2 1
199SA14322 21% 0.278 PF00110 2 - (0)? - / - / - 0
200SA222410 32% 0.414 PF00112 7 - (0)? - / - / - 0

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