Project name: MATH

Status: done

submitted: 2017-09-14 05:21:30, status changed: 2017-09-14 20:38:55

Project settings
Peptide sequence PFSKEEC
Simulation mc cycles50
Peptide secondary structure psipred CCCCCCC
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) 47.027 2.57299 29.8969 121
cluster_2.pdb ( medoid) 26.2469 4.15288 24.4361 109
cluster_3.pdb ( medoid) 26.2285 5.9096 18.1619 155
cluster_4.pdb ( medoid) 23.9661 4.8819 10.9741 117
cluster_5.pdb ( medoid) 20.3006 8.52192 19.4182 173
cluster_6.pdb ( medoid) 13.0975 7.10058 19.3885 93
cluster_7.pdb ( medoid) 12.2962 4.47291 11.247 55
cluster_8.pdb ( medoid) 12.2329 7.35719 19.7744 90
cluster_9.pdb ( medoid) 4.70114 8.7213 20.5549 41
cluster_10.pdb ( medoid) 3.34906 13.7352 31.1574 46

Laboratory of Theory of Biopolymers 2015