Project name: 73fc00d181043c5

Status: done

submitted: 2018-07-10 09:48:13, status changed: 2018-07-24 18:11:28

Project settings
Protein sequence(s) DEFEPPVPDELWPKVDILLCHYSEPAEEAIDTLMACMNVQYPPHLLQIWVCDDGYCKTKWTKGNPIPTVELNKGILETAGDLRQEVAQFMYDRVCDPNEDMEVYAWRKLHSSANLPSPSRCKVVNRADCAVGSFRDDYRYPGLPHVTFIGRVKPETHYSKAGNINNCLYNEGANGRYLIILDTDMQPHPKFILATLPFFFDDEDRQDKAKYICCGVGCNAVAKLCCASCQIAGVPEEQISYCSKDCFENAMHVQSAVHRRQVNGTMSDTNASKIDMRCMNCDAKLPKSGVCRKCGNKGADGEDVSSLHTYSDDVRDNAVAFVQTPQYFRDCIQLQIGDPMGHRNATFYDAIQTGQDGYDCASFAGTNAIFRREALDSIGGIQYGSLTEDCYTGQVLCSMGWKAQYFRKDFEGEPSERIRLAEGLIPDSVAGSLAQRKRWAKGNFQIALMNKKTQYFDPEW input pdb
Peptide sequence RLTAQCRLHHHHHH
Simulation mc cycles50
Peptide secondary structure psipred CCHHHHHHHHHCCC
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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
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
 

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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) 32.9881 2.03104 6.11016 67
cluster_2.pdb ( medoid) 26.1865 3.93332 8.55347 103
cluster_3.pdb ( medoid) 24.3919 3.60776 6.84589 88
cluster_4.pdb ( medoid) 23.4159 1.79365 5.96452 42
cluster_5.pdb ( medoid) 21.77 8.54386 19.8683 186
cluster_6.pdb ( medoid) 19.2671 6.02062 42.3601 116
cluster_7.pdb ( medoid) 7.93811 9.19614 21.7183 73
cluster_8.pdb ( medoid) 7.87601 7.4911 15.1454 59
cluster_9.pdb ( medoid) 7.21777 10.6681 43.7104 77
cluster_10.pdb ( medoid) 3.22233 22.6544 56.9457 73

 
Laboratory of Theory of Biopolymers 2015