Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
CASP11 (Apr 2014)

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)		 Modeller
(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]
 [Best Score]
 Main Code
 [Name]
 [Number]
 [Number]
 Distribution of CDocking pKd
 [Number]
50T081720 29% 0.439 0.515 PF00496 41 - (0)0 - / - / - -
51T08290 23% 0.362 0.424 PF01491 1 - (0)0 - / - / - -
52T07844 59% 0.421 0.429 PF03178 0 - (0)0 - / - / - -
53T07737 47% 0.420 0.677 PF00106 6 - (6)0 - / - / - -
54T08240 19% 0.093 0.281PF05963 0 - (0)0 - / - / - -
55T08334 45% 0.249 0.331 PF03388 6 - (0)0 - / - / - -
56T083513 19% 0.327 0.415 PF00759 21 - (0)0 - / - / - -
57T08302 34% 0.173 0.250PF02516 4 - (0)0 - / - / - -
58T082810 31% 0.207 0.210PF14852 3 - (0)0 - / - / - -
59T07610 38% 0.116 0.282PF00578 1 - (0)0 - / - / - -
60T078320 32% 0.233 0.331 PF01128 30 - (18)0 - / - / - -
61T084516 23% 0.205 0.345 PF00058 7 - (0)0 - / - / - -
62T07750 41% -0.022 0.026PF01123 0 - (0)0 - / - / - -
63T082615 18% 0.169 0.240PF01663 4 - (0)0 - / - / - -
64T077813 39% 0.363 0.392 PF00515 4 - (0)0 - / - / - -
65T07968 29% 0.291 0.324 PF03440 4 - (0)0 - / - / - -
66T07670 34% 0.133 0.161PF01776 1 - (0)0 - / - / - -
67T07950 18% 0.359 0.271PF08910 1 - (0)0 - / - / - -
68T08060 39% 0.219 0.286PF00790 8 - (0)0 - / - / - -
69T07823 20% 0.345 0.308 PF05963 2 - (0)0 - / - / - -
70T07606 31% 0.302 0.437 PF11631 7 - (0)0 - / - / - -
71T08382 24% 0.286 0.453 PF09032 3 - (1)0 - / - / - -
72T08314 26% 0.271 0.324 PF13176 3 - (0)0 - / - / - -
73T08499 27% 0.433 0.556 PF02798 17 - (6)0 - / - / - -
74T076419 35% 0.431 0.434 PF00326 12 - (1)0 - / - / - -
75T080513 43% 0.446 0.534 PF00881 61 - (34)0 - / - / - -
76T07993 64% 0.150 0.273PF01842 4 - (0)0 - / - / - -
77T07938 24% 0.207 0.255PF05496 15 - (11)0 - / - / - -
78T077620 34% 0.399 0.465 PF00657 12 - (2)0 - / - / - -
79T08360 53% -0.027 -PF00240 4 - (0)0 - / - / - -
80T08002 31% 0.176 0.175PF00011 4 - (0)0 - / - / - -
81T085612 27% 0.288 0.485 PF00622 6 - (0)0 - / - / - -
82T08083 20% 0.157 0.241PF01494 13 - (4)0 - / - / - -
83T07850 20% 0.243 0.341 PF02359 0 - (0)0 - / - / - -
84T077210 32% 0.353 0.355 PF00722 21 - (0)0 - / - / - -
85T08222 37% 0.264 0.241PF05963 2 - (0)0 - / - / - -
86T084714 30% 0.373 0.491 PF14676 3 - (0)0 - / - / - -
87T084020 100% 0.396 0.483 PF01833 8 - (0)1 - / - / - -
88T07974 44% 0.705 0.848 PF00069 2 - (0)0 - / - / - -
89T08531 38% 0.252 0.367 PF02887 5 - (2)0 - / - / - -
90T08320 32% 0.180 0.361 PF01213 5 - (2)0 - / - / - -
91T084120 100% 0.514 0.557 PF00089 15 - (0)0 - / - / - -
92T085416 35% 0.456 0.574 PF00702 13 - (9)0 - / - / - -
93T08370 41% 0.315 0.363 PF00072 1 - (0)0 - / - / - -
94T084320 32% 0.479 0.531 PF01041 48 - (24)0 - / - / - -
95T08030 32% 0.107 0.150PF03947 0 - (0)0 - / - / - -
96T08440 40% 0.267 0.290PF06133 1 - (0)0 - / - / - -
97T07810 37% 0.196 0.154PF01751 7 - (0)0 - / - / - -

<< Page / 2 >> - Show