CABS-dock: 3f1524457ff0aa3

Project name: 3f1524457ff0aa3

Status: done

submitted: 2025-04-21 18:15:30, status changed: 2025-04-21 20:32:24

Project settings

Protein sequence(s)	VNPTVFFDIAVDGEPLGRVSFELFADKVPKTAENFRALSTGEKGFGYKGSCFHRIIPGFMCQGGDFTRHNGTGGKSIYGEKFEDENFILKHTGPGILSMANAGPNTNGSQFFICTAKTEWLDGKHVVFGKVKEGMNIVEAMERFGSRNGKTSKKITIADCGQLE input pdb
Peptide sequence	MLTW
Simulation mc cycles	50
Peptide secondary structure psipred	CCCC

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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

Download all files

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)	74.8007	2.04544	35.5103	153
cluster_2.pdb ( medoid)	73.5762	1.7261	10.3276	127
cluster_3.pdb ( medoid)	46.6176	3.02461	36.2704	141
cluster_4.pdb ( medoid)	40.3978	3.73783	8.88301	151
cluster_5.pdb ( medoid)	18.8124	3.98673	8.77053	75
cluster_6.pdb ( medoid)	15.4287	1.8148	6.77181	28
cluster_7.pdb ( medoid)	15.2324	8.00922	36.6699	122
cluster_8.pdb ( medoid)	7.01859	13.5355	37.9823	95
cluster_9.pdb ( medoid)	6.72685	8.02753	27.0424	54
cluster_10.pdb ( medoid)	6.31204	8.55508	30.8278	54