CABS-dock: 7T5M_QAIELQ

Project name: 7T5M_QAIELQ_E2

Status: done

submitted: 2026-05-30 16:09:14, status changed: 2026-05-31 14:54:23

Project settings

Protein sequence(s)	GSSHSSMMRYFFTSVSRPGRGEPRFIAVGYVDDTQFVRRFDSDAASQRMEEPRAPWIEQEGPPEYWDGETRRKVKAHSQTHRVDLGTLLRGYYNQSEAGSHTVQRMYGCDVVGSDWRFLRGYHQYAYDGKDYIALKEDLRSWTAADMAAQTTKHHHKWEAAHVAEQLRAYLEGTCVEWLRRYLENGKKETLQRTTDAPKKTHMMTHHAVSDHEATLRCWALSFYPPAEITLTWQRDGEDDQTQDTELVETRPAGDGTFQKWAAVVVPSSSGQEQRYTCHVQHEGLPKPLTLRWEP input pdb
Peptide sequence	QAIELQLTLETIYNSQYSN
Simulation mc cycles	200
Peptide secondary structure psipred	CCEEEEEEHHHHHHCCCCC

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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)	56.0087	5.37417	17.3938	301
cluster_2.pdb ( medoid)	41.8346	2.6055	14.4323	109
cluster_3.pdb ( medoid)	27.0782	4.65319	9.3992	126
cluster_4.pdb ( medoid)	20.743	3.08538	6.52193	64
cluster_5.pdb ( medoid)	11.5707	11.1488	31.2769	129
cluster_6.pdb ( medoid)	8.70472	8.1565	29.0893	71
cluster_7.pdb ( medoid)	8.47239	5.19334	12.0026	44
cluster_8.pdb ( medoid)	7.7858	5.266	14.4947	41
cluster_9.pdb ( medoid)	7.30438	10.9523	21.271	80
cluster_10.pdb ( medoid)	4.67117	7.49277	15.4702	35