CABS-dock: LexA-Scrambled

Project name: LexA-Scrambled

Status: done

submitted: 2026-01-11 18:25:09, status changed: 2026-01-11 21:47:39

Project settings

Protein sequence(s)	EEEEGLPLVGRVAAGEPLLAQQHIEGHYQVDPSLFKPNADFLLRVSGMSMKDIGIMDGDLLAVHKTQDVRNGQVVVARIDDEVTVKRLKKQGNKVELLPENSEFKPIVVDLRQQSFTIEGLAVGVVIRNGDWL input pdb
Peptide sequence	QKAIHVKQAILGKHVNE
Simulation mc cycles	50
Peptide secondary structure psipred	CCCHHHHHHHHHCCCCC

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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)	33.6103	5.56378	30.3471	187
cluster_2.pdb ( medoid)	17.1587	5.59483	34.7042	96
cluster_3.pdb ( medoid)	16.3991	8.1712	32.2586	134
cluster_4.pdb ( medoid)	15.4222	7.71613	19.1248	119
cluster_5.pdb ( medoid)	13.1876	9.47857	28.9179	125
cluster_6.pdb ( medoid)	13.132	10.0518	30.995	132
cluster_7.pdb ( medoid)	8.93121	5.71031	36.4792	51
cluster_8.pdb ( medoid)	7.93233	7.56398	37.778	60
cluster_9.pdb ( medoid)	4.3255	12.2529	30.154	53
cluster_10.pdb ( medoid)	3.60942	11.9133	23.0204	43