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]
150SA065899 51% 0.652 PF00248 C7_S1156 - (120)16 66 / 10 / 3 4
151SA1692_10 36% 0.652 PF00790 2 - (0)? - / - / - 0
152SA130535 100% 0.652 PF00216 C9_S159 - (0)2 4 / 2 / 12 0
153SA057311 100% 0.651 PF01047 7 - (0)? - / - / - 0
154SA203420 80% 0.651 PF00410 21 - (0)? - / - / - 0
155SA018318 62% 0.650 PF00358 5 - (0)? - / - / - 0
156SAP0284 37% 0.650 PF00717 22 - (0)? - / - / - 0
157SA108922 65% 0.650 PF00549 C2_S124 - (14)2 - / 10 / - 1
158SA138539 38% 0.650 PF00005 C1_S148 - (0)10 - / 6 / 15 4
159SA126090 100% 0.650 PF00303 C5_S1130 - (85)20 - / 4 / 75 9
160SA112511 100% 0.649 PF01381 18 - (0)? - / - / - 0
161SA047011 68% 0.648 PF01430 C3_S13 - (0)2 - / - / 3 1
162SA02721 28% 0.648 PF03104 26 - (26)? - / - / - 0
163SA07216 79% 0.648 PF01220 C4_S112 - (7)1 - / - / 2 1
164SA192515 100% 0.648 PF00996 C2_S110 - (0)2 - / - / 3 0
165SA16619 39% 0.647 PF04423 C2_S113 - (0)? - / - / 1 0
166SA074679 99% 0.647 PF00565 C8_S176 - (0)6 - / 65 / 5 2
167SA072957 100% 0.647 PF00121 C8_S159 - (46)19 - / - / 38 7
168SA127718 57% 0.647 PF05175 C1_S130 - (0)1 - / 2 / - 1
169SA15045 74% 0.646 PF01467 13 - (8)? - / - / - 0
170SA187315 100% 0.646 PF02452 C2_S12 - (0)? 1 / - / - 0
171SA135511 35% 0.646 PF01029 19 - (0)? - / - / - 0
172SA110221 62% 0.646 PF01765 C4_S15 - (0)1 - / - / 3 0
173SA098016 100% 0.646 PF01497 C1_S124 - (0)? 1 / - / - 0
174SA026519 100% 0.645 PF01551 C6_S13 - (0)2 - / - / 2 1
175SA113020 64% 0.645 PF00149 12 - (2)? - / - / - 0
176SA134319 100% 0.645 PF04151 C1_S130 - (5)2 - / - / 2 0
177SA053858 100% 0.645 PF03167 C8_S179 - (0)20 - / 2 / 33 12
178SA062719 95% 0.644 PF03466 8 - (0)? - / - / - 0
179SA16400 32% 0.644 PF01576 0 - (0)? - / - / - 0
180SA142235 99% 0.644 PF01467 C3_S167 - (37)17 4 / 11 / 12 4
181SA02863 36% 0.644 PF13181 0 - (0)? - / - / - 0
182SA207024 52% 0.644 PF00994 C3_S115 - (0)7 - / - / 2 1
183SA125213 100% 0.644 PF00583 40 - (13)1 - / - / - 0
184SA139912 48% 0.644 PF02130 7 - (0)? - / - / - 0
185SA122743 99% 0.643 PF00701 C3_S167 - (64)7 - / - / 5 0
186SA051412 35% 0.643 PF01712 C1_S173 - (48)5 1 / 7 / 2 3
187SA21580 40% 0.643 PF13499 7 - (0)? - / - / - 0
188SA081920 74% 0.642 PF02812 0 - (0)? - / - / - 0
189SA054523 97% 0.642 PF01515 C2_S124 - (9)5 - / 2 / 3 1
190SA239026 63% 0.642 PF02261 C4_S145 - (8)2 4 / - / 1 1
191SA245812 97% 0.641 PF00440 C1_S118 - (0)1 - / - / 1 0
192SA107850 53% 0.641 PF02978 C6_S163 - (0)14 4 / 15 / 12 3
193SA19163 56% 0.640 PF04260 9 - (5)? - / - / - 0
194SA093618 41% 0.640 PF00462 2 - (0)? - / - / - 0
195SA212214 72% 0.639 PF01175 C7_S120 - (18)2 5 / - / - 1
196SA011820 99% 0.639 PF03328 C7_S113 - (10)4 - / - / 3 1
197SA151824 45% 0.639 PF00285 C8_S115 - (11)7 - / 6 / 6 3
198SA07584 39% 0.638 PF00085 0 - (0)? - / - / - 0
199SA135130 60% 0.638 PF02863 C8_S1173 - (0)6 - / - / 17 1
200SA237020 98% 0.637 PF02852 C5_S142 - (29)1 2 / - / - 1

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