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]
150SA099820 100% 0.601 PF01725 C3_S114 - (12)5 - / 6 / 5 2
151SA02217 100% 0.800 PF11546 0 - (0)? - / - / - 0
152SA212436 100% 0.543 PF12681 C1_S154 - (0)15 - / - / 25 4
153SA126090 100% 0.650 PF00303 C5_S1130 - (85)20 - / 4 / 75 9
154SA090120 100% 0.490 PF00089 22 - (0)? - / - / - 0
155SA053858 100% 0.645 PF03167 C8_S179 - (0)20 - / 2 / 33 12
156SA010719 100% 0.831 PF04650 1 - (0)? - / - / - 0
157SA173111 100% 0.588 PF00351 C5_S19 - (0)2 - / - / 3 1
158SA025928 100% 0.537 PF05025 C5_S126 - (0)6 - / - / 13 1
159SA205916 100% 0.525 PF00903 9 - (0)1 - / - / - 0
160SA026519 100% 0.645 PF01551 C6_S13 - (0)2 - / - / 2 1
161SA004114 100% 0.579 PF00480 31 - (25)? - / - / - 0
162SA104420 100% 0.594 PF01979 C1_S112 - (3)1 - / - / 1 1
163SA003820 100% 0.516 PF00905 C2_S118 - (0)5 - / 2 / 3 5
164SA072855 100% 0.536 PF00162 C9_S181 - (71)18 - / 21 / 23 9
165SA187315 100% 0.646 PF02452 C2_S12 - (0)? 1 / - / - 0
166SA084120 100% 0.450 PF01123 2 - (0)? - / - / - 0
167SA011120 100% 0.606 PF01497 C1_S139 - (0)1 - / 1 / 1 1
168SA100720 100% 0.596 PF07968 54 - (0)1 - / - / - 0
169SA223020 100% 0.534 PF00144 27 - (1)? - / - / - 0
170SA192420 100% 0.593 PF00171 30 - (0)? - / - / - 0
171SA125213 100% 0.644 PF00583 40 - (13)1 - / - / - 0
172SA000567 99% 0.532 PF01751 C2_S165 - (0)20 6 / 30 / 18 22
173SA073020 99% 0.600 PF01676 C5_S113 - (10)5 - / 6 / 2 2
174SA199520 99% 0.543 PF00294 C2_S141 - (32)8 - / 5 / 4 3
175SA011820 99% 0.639 PF03328 C7_S113 - (10)4 - / - / 3 1
176SA206017 99% 0.539 PF01047 C1_S114 - (0)2 - / - / 1 1
177SA163019 99% 0.584 PF00089 1 - (0)? - / - / - 0
178SA193822 99% 0.589 PF07831 C3_S112 - (3)5 - / - / 6 3
179SA2391107 99% 0.599 PF02569 C8_S1331 - (259)20 8 / 44 / 33 9
180SA139120 99% 0.552 PF01807 C2_S114 - (0)8 - / 5 / 4 6
181SA138815 99% 0.587 PF01784 3 - (0)2 - / - / - 0
182SA047320 99% 0.529 PF02152 C5_S130 - (14)10 - / - / 11 10
183SA154022 99% 0.594 PF13185 C4_S114 - (6)3 - / - / 12 2
184SA065424 99% 0.497 PF00294 C1_S148 - (35)7 - / 2 / 6 3
185SA17264 99% 0.477 PF09023 0 - (0)? - / - / - 0
186SA25027 99% 0.577 PF00825 C2_S12 - (0)1 - / - / 1 0
187SA098220 99% 0.807 -C2_S118 - (1)5 - / - / 6 1
188SA030445 99% 0.599 PF00701 C5_S137 - (28)16 - / - / 25 6
189SA138119 99% 0.500 PF00905 C1_S121 - (0)2 - / - / 2 1
190SA164220 99% 0.449 PF01123 1 - (0)? - / - / - 0
191SA193216 99% 0.544 PF03630 C4_S131 - (27)4 3 / 3 / - 2
192SA074679 99% 0.647 PF00565 C8_S176 - (0)6 - / 65 / 5 2
193SA089820 99% 0.472 PF00378 0 - (0)? - / - / - 0
194SA105239 99% 0.560 PF00625 C2_S151 - (37)14 4 / 13 / 12 5
195SA114140 99% 0.510 PF00370 C4_S159 - (59)14 - / 1 / 19 4
196SA09072 99% 0.467 PF00005 2 - (0)? - / - / - 0
197SA095822 99% 0.633 PF00459 C4_S132 - (12)8 - / - / 1 1
198SA163721 99% 0.345 PF07968 54 - (0)1 - / - / - 0
199SA135247 99% 0.597 PF00348 C1_S162 - (48)16 - / 2 / 26 6
200SA023237 99% 0.673 PF00056 C5_S136 - (26)4 9 / 13 / 1 2

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