Project name: 1klu bound default 2 runAB GELIGTLNAAKVPAD ss: CEECCCCCCCCCCCC

Status: done

submitted: 2015-02-23 11:18:27, status changed: 2015-03-13 11:08:09

Project settings
Peptide sequence GELIGTLNAAKVPAD
Simulation mc cycles50
Peptide secondary structure CEECCCCCCCCCCCC
Flexible regions
Unlikely to bind regions
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) 74.5748 1.34094 3.58854 100
cluster_2.pdb ( medoid) 27.8987 2.47323 6.34148 69
cluster_3.pdb ( medoid) 25.517 2.90002 5.09562 74
cluster_4.pdb ( medoid) 23.0999 4.54548 31.9059 105
cluster_5.pdb ( medoid) 20.1479 2.68018 5.13396 54
cluster_6.pdb ( medoid) 20.0557 3.29083 8.10451 66
cluster_7.pdb ( medoid) 15.9267 15.1946 49.5859 242
cluster_8.pdb ( medoid) 14.7663 10.7 35.35 158
cluster_9.pdb ( medoid) 13.987 6.79203 27.9701 95
cluster_10.pdb ( medoid) 10.9693 3.37306 6.43053 37
Laboratory of Theory of Biopolymers 2015