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]
100SA071939 97% 0.634 PF07992 C2_S1113 - (100)13 6 / 12 / 8 4
101SA139737 52% 0.485 PF00383 C5_S144 - (27)13 - / - / 29 6
102SA120226 39% 0.533 PF00218 C3_S136 - (9)13 - / 5 / 5 6
103SA160668 56% 0.498 PF00248 C7_S1156 - (118)13 36 / 7 / 4 3
104SA207245 39% 0.549 PF08402 C1_S134 - (0)13 - / - / 25 6
105SA232729 34% 0.575 PF02776 C7_S190 - (61)13 - / 21 / - 6
106SA108039 54% 0.540 PF02978 C4_S161 - (0)13 3 / 13 / 15 4
107SAP01121 93% 0.537 PF00905 C1_S134 - (1)13 - / 1 / 13 6
108SA212925 34% 0.492 PF01263 C4_S148 - (39)12 - / - / 9 6
109SA191446 76% 0.517 PF13793 C3_S159 - (46)12 - / 10 / 22 4
110SA091632 100% 0.679 PF00731 C9_S138 - (28)12 - / 1 / 16 4
111SA067744 46% 0.621 PF08402 C1_S128 - (0)12 - / 16 / 8 5
112SA240220 37% 0.571 PF13193 C5_S168 - (40)12 - / 3 / 8 4
113SA242740 64% 0.616 PF02729 C8_S146 - (36)12 - / 8 / 17 5
114SA130932 100% 0.575 PF02224 C1_S134 - (31)12 1 / 13 / 10 6
115SA108327 44% 0.583 PF01746 C5_S129 - (18)12 - / 21 / 4 5
116SA224355 35% 0.533 PF00005 C1_S147 - (0)12 - / 23 / 19 7
117SA101239 64% 0.700 PF02729 C5_S150 - (42)12 - / 8 / 17 5
118SA060238 35% 0.517 PF00005 C1_S138 - (0)12 - / 7 / 22 5
119SA107438 100% 0.661 PF00106 C1_S163 - (41)12 12 / 5 / 8 2
120SA104723 54% 0.659 PF00215 C1_S142 - (28)12 - / 11 / 5 3
121SA046030 43% 0.592 PF01195 C3_S119 - (0)12 - / 1 / 8 4
122SA052727 49% 0.611 PF01182 C4_S117 - (11)12 - / - / 13 7
123SA025623 61% 0.611 PF00232 C3_S191 - (72)12 - / 2 / 8 6
124SA059965 52% 0.407 PF00005 C2_S159 - (59)12 - / 38 / 10 7
125SA233325 42% 0.557 PF00368 C4_S121 - (12)12 - / 1 / - 1
126SA095044 46% 0.580 PF08402 C2_S129 - (0)12 - / 8 / 16 7
127SA047529 73% 0.482 PF01336 C5_S140 - (28)12 - / 7 / 5 5
128SA017634 38% 0.558 PF00696 C1_S155 - (43)12 - / 3 / 15 5
129SA073158 81% 0.631 PF03952 C1_S148 - (33)12 - / 3 / 33 6
130SA014720 36% 0.540 PF02719 C1_S177 - (68)12 4 / 6 / 5 5
131SA220041 57% 0.626 PF08402 C1_S142 - (0)12 - / 9 / 22 5
132SA029746 38% 0.601 PF00005 C1_S141 - (0)12 - / 13 / 15 5
133SA088423 43% 0.564 PF03099 C4_S132 - (20)12 3 / 2 / 13 3
134SA225140 35% 0.597 PF00005 C1_S131 - (0)12 - / 12 / 12 5
135SA091830 57% 0.475 PF01259 C4_S152 - (39)12 - / 18 / 9 6
136SA112833 67% 0.521 PF00154 C2_S141 - (0)11 - / 16 / 8 5
137SA013748 40% 0.548 PF08402 C1_S146 - (0)11 - / 16 / 19 6
138SA241641 42% 0.456 PF08402 C1_S122 - (0)11 - / 6 / 12 5
139SA185920 43% 0.549 PF02776 C2_S172 - (28)11 9 / 1 / 8 3
140SA098529 93% 0.454 PF01409 C3_S120 - (13)11 2 / 6 / 6 9
141SA172833 59% 0.531 PF02540 C7_S161 - (54)11 - / 14 / 13 5
142SA168353 100% 0.405 PF00005 C1_S164 - (58)11 - / 29 / 7 6
143SA188616 39% 0.527 PF08245 C2_S141 - (20)11 1 / 6 / - 4
144SA011253 37% 0.445 PF00291 C2_S175 - (50)11 - / 4 / 40 4
145SA034736 39% 0.519 PF01053 C1_S123 - (17)11 - / 2 / 11 5
146SA234633 38% 0.555 PF02826 C2_S153 - (37)11 2 / 9 / 9 4
147SA188757 100% 0.619 PF01820 C1_S181 - (57)11 - / 18 / 22 3
148SA134225 69% 0.497 PF03446 C1_S128 - (16)11 - / 3 / 9 5
149SA199627 56% 0.522 PF02502 C7_S148 - (36)11 - / - / 2 1
150SA233748 48% 0.457 PF07670 C9_S165 - (0)11 5 / 28 / 10 7

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