D-I-TASSER A0A286YFG1

D-I-TASSER results for A0A286YFG1

[Click result.zip to download all results on this page]

Summary of the Protein

Uniprot ID: A0A286YFG1
Protein Name: Small cysteine and glycine repeat-containing protein 8
Gene Name: SCYGR8

Input Sequence in FASTA format

>A0A286YFG1 (108 residues)
MGCCGCGGCGGGCGGCSGGCGGGCGGGCGGGGCGGGCGSCTTCRCYRVGCCSSCCPCCRG
CCGGCCSTPVICCCRRTCSSCGCGYGKGCCQQKGCCQQKCCCQKQCCC

Predicted Contact and Distance Map Used in D-I-TASSER simulation

Contact Map

Distance Map

D-I-TASSER simulation is guided by the consensus contact map (left figure) and distance map (right figure) derived based on confidence scores of AttentionPotential. In the contact, distance map and hydrogen bond networks, the axes mark the residue index along the sequence. For the contact map, each dot represents a residue pair with predicted contact, while for the distance map and hydrogen bond network, a color scale represents a distance of 1-20+ angstroms or a angle of 0-180 degree.

Information of Domain

No. of Domain	Domain	Domain Boundary	Length of Domain	Models of Domain	Sequence
1	A0A286YFG1-D1	1-108	108		MGCCGCGGCGGGCGGCSGGCGGGCGGGCGGGGCGGGCGSCTTCRCYRVGCCSSCCPCCRGCCGGCCSTPVICCCRRTCSSCGCGYGKGCCQQKGCCQQKCCCQKQCCC

Top 1 final models from D-I-TASSER

Click to view	Rank^a	Download	Estimated TM-score^b
	1	model1.pdb.gz	0.5242

(a)

D-I-TASSER simulations generate a large ensemble of structural conformations, i.e. decoys. These decoys are clustered by SPICKER based on pairwise structure similarity to report up to five final models from the five largest clusters. Models are ranked in descending order of cluster size. If the simulations converge well, it is possible to have less than 5 models generated, which is usually an indication of good model quality.

(b)

The model confidence is quantitatified by estimated TM-score (eTM-score), calculated based on significance of threading template alignments, contact map satisfaction rate, mean absolute error between distance of model and distance of AttentionPotential, and convergence of D-I-TASSER simulations. eTM-score is typically in the range of [0, 1], with higher eTM-score signifies higher model confidence.

Proteins with similar structure

Top 10 structural analogs in PDB (as identified by TM-align)

Rank	PDB Hit	TM-score	RMSD^a	IDEN^a	Cov.	Download Alignment
1	3r9mA	0.48	4.13	0.065	0.824	model1_3r9mA.pdb.gz
2	7d3uA1	0.46	4.67	0.060	0.870	model1_7d3uA1.pdb.gz
3	3rkoM1	0.46	4.90	0.048	0.898	model1_3rkoM1.pdb.gz
4	4he8L1	0.46	4.62	0.050	0.852	model1_4he8L1.pdb.gz
5	4he8N	0.45	5.14	0.020	0.898	model1_4he8N.pdb.gz
6	2z0jA	0.45	4.42	0.071	0.796	model1_2z0jA.pdb.gz
7	6i0dL	0.45	4.61	0.050	0.843	model1_6i0dL.pdb.gz
8	1vr0C	0.44	4.48	0.089	0.806	model1_1vr0C.pdb.gz
9	5jtaA	0.44	4.64	0.057	0.843	model1_5jtaA.pdb.gz
10	7a23M1	0.44	4.98	0.052	0.833	model1_7a23M1.pdb.gz

(a)	Query structure is shown in cartoon, while the structural analog is displayed using backbone trace.
(b)	Ranking of proteins is based on TM-score of the structural alignment between the query structure and known structures in the PDB library.
(c)	RMSD^a is the RMSD between residues that are structurally aligned by TM-align.
(d)	IDEN^a is the percentage sequence identity in the structurally aligned region.
(e)	Cov. represents the coverage of the alignment by TM-align and is equal to the number of structurally aligned residues divided by length of the query protein.

Predicted Gene Ontology (GO) Terms

./A0A286YFG1-D1/GOsearchresult_final_MF.svg

Molecular Function (MF)

GO term	Cscore^GO	Name
GO:0048038	0.07	quinone binding
GO:0019901	0.07	protein kinase binding
GO:0008137	0.07	NADH dehydrogenase (ubiquinone) activity
GO:0004725	0.07	protein tyrosine phosphatase activity

Download full result of the above consensus prediction.

Click the graph to show a high resolution version.

(a)

Cscore^GO is the confidence score of predicted GO terms. Cscore^GO values range in between [0-1]; where a higher value indicates a better confidence in predicting the function using the template.

(b)

The graph shows the predicted terms within the Gene Ontology hierachy for Molecular Function. Confidently predicted terms are color coded by Cscore^GO:

[0.4,0.5)

[0.5,0.6)

[0.6,0.7)

[0.7,0.8)

[0.8,0.9)

[0.9,1.0]

./A0A286YFG1-D1/GOsearchresult_final_BP.svg

Biological Process (BP)

GO term	Cscore^GO	Name
GO:2000643	0.07	positive regulation of early endosome to late endosome transport
GO:1903393	0.07	positive regulation of adherens junction organization
GO:1903387	0.07	positive regulation of homophilic cell adhesion
GO:0060271	0.07	cilium morphogenesis
GO:0043162	0.07	ubiquitin-dependent protein catabolic process via the multivesicular body sorting pathway
GO:0042773	0.07	ATP synthesis coupled electron transport
GO:0035335	0.07	peptidyl-tyrosine dephosphorylation
GO:0015031	0.07	protein transport
GO:0010633	0.07	negative regulation of epithelial cell migration

Download full result of the above consensus prediction.

Click the graph to show a high resolution version.

(a)

Cscore^GO is the confidence score of predicted GO terms. Cscore^GO values range in between [0-1]; where a higher value indicates a better confidence in predicting the function using the template.

(b)

The graph shows the predicted terms within the Gene Ontology hierachy for Biological Process. Confidently predicted terms are color coded by Cscore^GO:

[0.4,0.5)

[0.5,0.6)

[0.6,0.7)

[0.7,0.8)

[0.8,0.9)

[0.9,1.0]

./A0A286YFG1-D1/GOsearchresult_final_CC.svg

Cellular Component (CC)

GO term	Cscore^GO	Name
GO:0044464	0.90	cell part
GO:0016020	0.80	membrane
GO:0044425	0.50	membrane part
GO:0005886	0.50	plasma membrane

Download full result of the above consensus prediction.

Click the graph to show a high resolution version.

(a)

Cscore^GO is the confidence score of predicted GO terms. Cscore^GO values range in between [0-1]; where a higher value indicates a better confidence in predicting the function using the template.

(b)

The graph shows the predicted terms within the Gene Ontology hierachy for Cellular Component. Confidently predicted terms are color coded by Cscore^GO:

[0.4,0.5)

[0.5,0.6)

[0.6,0.7)

[0.7,0.8)

[0.8,0.9)

[0.9,1.0]

Predicted Enzyme Commission (EC) Numbers

Top 5 enzyme homologs in PDB

Rank	Cscore^EC	PDB Hit	TM-score	RMSD^a	IDEN^a	Cov.	EC Number	Predicted Active Site Residues
1	0.060	1vr0C	0.441	4.48	0.089	0.806	3.1.3.71	61,96
2	0.060	1h12A	0.417	4.85	0.048	0.815	3.2.1.8	52
3	0.060	3gtdA	0.415	4.84	0.101	0.750	4.2.1.2	NA
4	0.060	2i2xA	0.421	5.25	0.049	0.870	2.1.1.90	20,31
5	0.060	1tqyA	0.420	4.87	0.053	0.806	2.3.1.41	NA

	Click on the radio buttons to visualize predicted active site residues.
(a)	Cscore^EC is the confidence score for the Enzyme Commission (EC) number prediction. Cscore^EC values range in between [0-1]; where a higher score indicates a more reliable EC number prediction.
(b)	TM-score is a measure of global structural similarity between query and template protein.
(c)	RMSD^a is the RMSD between residues that are structurally aligned by TM-align.
(d)	IDEN^a is the percentage sequence identity in the structurally aligned region.
(e)	Cov. represents the coverage of global structural alignment and is equal to the number of structurally aligned residues divided by length of the query protein.

Predicted Ligand Binding Sites

Template proteins with similar binding site:

Rank	Cscore^LB	PDB Hit	TM-score	RMSD^a	IDEN^a	Cov.	BS-score	Lig. Name	Download Complex	Predicted binding site residues
1	0.01	3oeeN	0.333	5.11	0.000	0.685	0.86	PO4	complex1.pdb.gz	30,31,33,34,35
2	0.01	1w0kE	0.421	4.47	0.040	0.732	0.78	PO4	complex2.pdb.gz	14,15,24
3	0.01	2jj1L	0.335	4.85	0.030	0.630	0.77	PO4	complex3.pdb.gz	8,11,12,16,17
4	0.01	3fksF	0.379	4.82	0.042	0.732	0.67	PO4	complex4.pdb.gz	23,24,25,28

	Click on the radio buttons to visualize predicted binding site and residues.
(a)	Cscore^LB is the confidence score of predicted binding site. Cscore^LB values range in between [0-1]; where a higher score indicates a more reliable ligand-binding site prediction.
(b)	BS-score is a measure of local similarity (sequence & structure) between template binding site and predicted binding site in the query structure. Based on large scale benchmarking analysis, we have observed that a BS-score >1 reflects a significant local match between the predicted and template binding site.
(c)	TM-score is a measure of global structural similarity between query and template protein.
(d)	RMSD^a the RMSD between residues that are structurally aligned by TM-align.
(e)	IDEN^a is the percentage sequence identity in the structurally aligned region.
(f)	Cov. represents the coverage of global structural alignment and is equal to the number of structurally aligned residues divided by length of the query protein.

[Click result.zip to download all results on this page]

References:
1.	Wei Zheng, Chengxin Zhang, Yang Li, Robin Pearce, Eric W. Bell, Yang Zhang. Folding non-homology proteins by coupling deep-learning contact maps with I-TASSER assembly simulations. In preparation, 2020.