Project name: Docking project

Status: done

submitted: 2017-12-07 14:38:16, status changed: 2017-12-08 04:02:29

Project settings
Peptide sequence SFGDGFADF
Simulation mc cycles50
Peptide secondary structure CCCCHHHHC
Re-submit project
Zoom/rotate predicted model of the complex using mouse. Click the "View" button on the right panel to load the appropriate model. View in JSmol (pure html5/js) if you got rendering problems.
Models are ranked and numbered according to their occurrence in docking trajectory (1 = most probable result).
Representative conformations
model_1 Download
model_2 Download
model_3 Download
model_4 Download
model_5 Download
model_6 Download
model_7 Download
model_8 Download
model_9 Download
model_10 Download

Download all files
Click the "View" button to load the contact map of appropriate model.
Representative conformations
model_1 View
model_2 View
model_3 View
model_4 View
model_5 View
model_6 View
model_7 View
model_8 View
model_9 View
model_10 View

Receptor residuePeptide residue
Receptor residuePeptide residue
Receptor residuePeptide residue
Select trajectory from the right panel to display animation in JSmol. Note that it may hangs browser window for few minutes or ever.
replica_1 Download
replica_2 Download
replica_3 Download
replica_4 Download
replica_5 Download
replica_6 Download
replica_7 Download
replica_8 Download
replica_9 Download
replica_10 Download
Selected model: model_1.pdb (most representative model of the best cluster) download the model
Details about clusters
cluster namecluster density average rmsdmax rmsdnumber of elements
cluster_1.pdb ( medoid) 41.7 2.85371 27.4879 119
cluster_2.pdb ( medoid) 38.5009 4.23367 12.6583 163
cluster_3.pdb ( medoid) 23.0405 7.55192 16.5931 174
cluster_4.pdb ( medoid) 20.0204 10.8389 27.0576 217
cluster_5.pdb ( medoid) 14.6376 5.05549 10.3056 74
cluster_6.pdb ( medoid) 13.9393 7.31743 29.1641 102
cluster_7.pdb ( medoid) 5.86608 9.20547 24.3654 54
cluster_8.pdb ( medoid) 2.19277 22.3461 48.5377 49
cluster_9.pdb ( medoid) 1.19166 20.9791 42.6758 25
cluster_10.pdb ( medoid) 0.824609 24.2539 55.5214 20

Laboratory of Theory of Biopolymers 2015