CABS-dock: 71633181192e036

Project name: 71633181192e036

Status: done

submitted: 2026-01-23 12:00:23, status changed: 2026-01-23 21:42:00

Project settings

Protein sequence(s)	ITKAANITKPGCPKQCGNVTVPYPFGIGSGCALDPMFEIDCNVTTPFIGNIQIYDISDAEMRISNFINTKCYSQTGVLIQDIPSWITLGTKSPYTFSTLNRFIVVGCDDGAIVSGNNFANGCPSLCTSTNDIVKGKCMGFGCCQITIPKGLKFFNTTMVTTRNHSLIWSFNPCGHSFLGEASRFEFQGIEDLSDVNFANKIRNNVPIVLDWAIGNLSCVEARKSNDYACLNNSQCVDSDTSLGGYRCSCNSGYIGNPYIGSGCQDIDECADPNTNSCEKICTNIPGSYNCSCPEGYTGDGRKNGRGCIAPN input pdb
Peptide sequence	EQAGKINVVKDTIKVGAGEVFDGHG
Simulation mc cycles	50
Peptide secondary structure psipred	CCCCCCEEEECEEEECCCCCCCCCC

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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 3Dmol (WebGL)

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

Contact cutoff (Å)

	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 residue	Peptide residue

Receptor residue	Peptide residue

Receptor residue	Peptide 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 name	cluster density	average rmsd	max rmsd	number of elements
cluster_1.pdb ( medoid)	64.0386	1.57717	18.8347	101
cluster_2.pdb ( medoid)	19.889	3.97204	19.5918	79
cluster_3.pdb ( medoid)	10.9992	13.7283	34.1563	151
cluster_4.pdb ( medoid)	10.9559	9.2188	17.426	101
cluster_5.pdb ( medoid)	8.74446	7.31892	20.4208	64
cluster_6.pdb ( medoid)	8.69474	13.4564	54.9401	117
cluster_7.pdb ( medoid)	6.58928	13.2033	25.528	87
cluster_8.pdb ( medoid)	4.67643	20.3147	49.18	95
cluster_9.pdb ( medoid)	4.25441	15.0432	36.279	64
cluster_10.pdb ( medoid)	3.31212	14.7942	36.8477	49