Project name: 2J6K unbound default 3 run A PPKPRPRR ss: CCCCCCCC

Status: done

submitted: 2015-02-25 18:47:40, status changed: 2015-03-13 11:21:11

Project settings
Protein sequence(s) VDYIVEYDYDAVHDDELTIRVGEIIRNVKKLQEEGWLEGELNGRRGMFPDNFVKEIK input pdb
Peptide sequence PPKPRPRR
Simulation mc cycles50
Peptide secondary structure CCCCCCCC
Flexible regions
Unlikely to bind regions
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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
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model_7 Download
model_8 Download
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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.
Trajectories
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) 31.9262 4.85494 27.8527 155
cluster_2.pdb ( medoid) 30.3964 4.27682 11.4915 130
cluster_3.pdb ( medoid) 27.1232 5.19851 13.1415 141
cluster_4.pdb ( medoid) 18.9159 5.49803 11.361 104
cluster_5.pdb ( medoid) 16.1406 7.80642 18.0177 126
cluster_6.pdb ( medoid) 15.3784 7.47803 18.9119 115
cluster_7.pdb ( medoid) 15.1709 5.8665 17.5126 89
cluster_8.pdb ( medoid) 9.92928 5.94202 14.0356 59
cluster_9.pdb ( medoid) 4.51503 7.5304 16.9949 34
cluster_10.pdb ( medoid) 4.02984 11.663 25.1917 47
Laboratory of Theory of Biopolymers 2015