CABS-dock: 989a41cad1da22

Project name: 989a41cad1da22

Status: done

submitted: 2025-06-21 06:54:32, status changed: 2025-06-21 09:14:06

Project settings

Protein sequence(s)	AKCVSYGVAQIKAPALHSQGYTGSNVKVAILDTGIDSSHPDLNVAGGASFVPSETNPFQDNSSGGTHIAGTVLAVAPSASLYAVKVLGADGKGQASWIINGIEWAIANNMDVINMSLGSPSGSAAVKAAVDKAVASGVVVVAAAGNSGTSGSSSTVTYPAKYPSVIAVGAVDSSNQRAPFSSVGPELDVMAPGVSICSTLPGGKYGALSGTSMASPHVAGAAALILSKHPNWTNTQVRSSLENTATKLGDSFYYGKGLINVEAAAQ input pdb
Peptide sequence	WSLGYTG
Simulation mc cycles	50
Peptide secondary structure psipred	CCCCCCC

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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

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)	23.4037	7.30654	22.1205	171
cluster_2.pdb ( medoid)	18.3071	9.17678	31.2473	168
cluster_3.pdb ( medoid)	16.4029	6.2184	20.872	102
cluster_4.pdb ( medoid)	14.5516	7.35313	18.7963	107
cluster_5.pdb ( medoid)	12.6532	8.53538	30.2991	108
cluster_6.pdb ( medoid)	12.4442	8.59837	23.0142	107
cluster_7.pdb ( medoid)	10.4037	6.9206	16.7083	72
cluster_8.pdb ( medoid)	9.83562	6.7103	17.1545	66
cluster_9.pdb ( medoid)	8.2194	5.96151	27.1905	49
cluster_10.pdb ( medoid)	7.73021	6.46813	32.1212	50