CABS-dock: 5445cabcc1f4004

Project name: 5445cabcc1f4004

Status: done

submitted: 2025-12-27 05:21:04, status changed: 2025-12-27 13:03:56

Project settings

Protein sequence(s)	QYQVGPLLGGFGSVYSGIRVSDNLPVAIKHVEKDRISDWGELPNGTRVPMEVVLLKKVSSGFSGVIRLLDWFERPDSFVLILERPEPVQDLFDFITERGALQEELARSFFWQVLEAVRHCHNCGVLHRDIKDENILIDLNRGELKLIDFGSGALLKDTVYTDFDGTRVYSPPEWIRYHRYHGRSAAVWSLGILLYDMVCGDIPFEHDEEIIGGQVFFRQRVSECQHLIRWCLALRPSDRPTFEEIQNHPWMQDVLLPQETAEIHLHKRRRHPS input pdb
Peptide sequence	LPCRMCRRLHPLHWRITA
Simulation mc cycles	50
Peptide secondary structure psipred	CCCHHCCCCCCCEEEECC

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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)	50.1118	2.13522	20.378	107
cluster_2.pdb ( medoid)	38.8874	4.78304	21.8558	186
cluster_3.pdb ( medoid)	21.9044	6.34577	23.806	139
cluster_4.pdb ( medoid)	20.8671	4.12133	9.06062	86
cluster_5.pdb ( medoid)	17.0607	8.206	22.7644	140
cluster_6.pdb ( medoid)	15.5967	8.01453	22.7666	125
cluster_7.pdb ( medoid)	8.26266	9.92416	28.5255	82
cluster_8.pdb ( medoid)	7.10153	5.7734	23.5839	41
cluster_9.pdb ( medoid)	6.33894	9.93857	24.5674	63
cluster_10.pdb ( medoid)	2.87054	10.7994	23.6364	31