D-I-TASSER Q9Y255

D-I-TASSER results for Q9Y255

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

Summary of the Protein

Uniprot ID: Q9Y255
Protein Name: PRELI domain-containing protein 1, mitochondrial
Gene Name: PRELID1

Input Sequence in FASTA format

>Q9Y255 (219 residues)
MVKYFLGQSVLRSSWDQVFAAFWQRYPNPYSKHVLTEDIVHREVTPDQKLLSRRLLTKTN
RMPRWAERLFPANVAHSVYVLEDSIVDPQNQTMTTFTWNINHARLMVVEERCVYCVNSDN
SGWTEIRREAWVSSSLFGVSRAVQEFGLARFKSNVTKTMKGFEYILAKLQGEAPSKTLVE
TAKEAKEKAKETALAATEKAKDLASKAATKKQQQQQQFV

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	Q9Y255-D1	1-219	219		MVKYFLGQSVLRSSWDQVFAAFWQRYPNPYSKHVLTEDIVHREVTPDQKLLSRRLLTKTNRMPRWAERLFPANVAHSVYVLEDSIVDPQNQTMTTFTWNINHARLMVVEERCVYCVNSDNSGWTEIRREAWVSSSLFGVSRAVQEFGLARFKSNVTKTMKGFEYILAKLQGEAPSKTLVETAKEAKEKAKETALAATEKAKDLASKAATKKQQQQQQFV

Top 1 final models from D-I-TASSER

Click to view	Rank^a	Download	Estimated TM-score^b
	1	model1.pdb.gz	0.7674

(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	5jqmC	0.78	2.94	0.265	0.877	model1_5jqmC.pdb.gz
2	4xhrA	0.75	1.04	0.320	0.772	model1_4xhrA.pdb.gz
3	1uw5A	0.63	3.16	0.079	0.776	model1_1uw5A.pdb.gz
4	6i3vF	0.61	1.58	0.792	0.635	model1_6i3vF.pdb.gz
5	4xzvB	0.60	1.63	0.218	0.648	model1_4xzvB.pdb.gz
6	6bymA	0.60	3.06	0.098	0.740	model1_6bymA.pdb.gz
7	4qdcA2	0.60	3.68	0.048	0.772	model1_4qdcA2.pdb.gz
8	2zylA	0.60	3.73	0.047	0.772	model1_2zylA.pdb.gz
9	6serA	0.60	3.69	0.078	0.799	model1_6serA.pdb.gz
10	5yqjA	0.59	2.81	0.090	0.703	model1_5yqjA.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

Molecular Function (MF)

GO term	Cscore^GO	Name
GO:0022892	0.99	substrate-specific transporter activity
GO:1990050	0.98	phosphatidic acid transporter 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]

Biological Process (BP)

GO term	Cscore^GO	Name
GO:0009987	0.90	cellular process
GO:0044699	0.89	single-organism process
GO:0044763	0.82	single-organism cellular process
GO:0065007	0.81	biological regulation
GO:0050789	0.81	regulation of biological process
GO:0050794	0.73	regulation of cellular process
GO:0016043	0.71	cellular component organization
GO:0048519	0.67	negative regulation of biological process
GO:0048518	0.66	positive regulation of biological process
GO:0019222	0.64	regulation of metabolic process
GO:0048523	0.62	negative regulation of cellular process
GO:0048522	0.62	positive regulation of cellular process
GO:0048583	0.61	regulation of response to stimulus
GO:0009968	0.60	negative regulation of signal transduction
GO:0051239	0.59	regulation of multicellular organismal process
GO:0051050	0.59	positive regulation of transport
GO:0010821	0.59	regulation of mitochondrion organization
GO:0002682	0.59	regulation of immune system process
GO:0044802	0.57	single-organism membrane organization
GO:0009893	0.57	positive regulation of metabolic process
GO:0080090	0.55	regulation of primary metabolic process
GO:0060255	0.55	regulation of macromolecule metabolic process
GO:0031323	0.55	regulation of cellular metabolic process
GO:0050790	0.53	regulation of catalytic activity
GO:0042981	0.53	regulation of apoptotic process
GO:0032268	0.53	regulation of cellular protein metabolic process
GO:0031325	0.53	positive regulation of cellular metabolic process
GO:0010604	0.53	positive regulation of macromolecule metabolic process
GO:2001140	0.52	positive regulation of phospholipid transport
GO:1901857	0.52	positive regulation of cellular respiration
GO:0097035	0.52	regulation of membrane lipid distribution
GO:0090201	0.52	negative regulation of release of cytochrome c from mitochondria
GO:0070234	0.52	positive regulation of T cell apoptotic process
GO:0045580	0.52	regulation of T cell differentiation
GO:0010950	0.52	positive regulation of endopeptidase activity
GO:0010917	0.52	negative regulation of mitochondrial membrane potential

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]

Cellular Component (CC)

GO term	Cscore^GO	Name
GO:0044444	1.00	cytoplasmic part
GO:0044446	0.99	intracellular organelle part
GO:0044429	0.98	mitochondrial part
GO:0070013	0.97	intracellular organelle lumen
GO:0005758	0.97	mitochondrial intermembrane space

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	3dwsB	0.418	4.46	0.021	0.585	1.3.3.3	NA
2	0.060	2vq5A	0.519	3.24	0.078	0.644	4.2.1.78	NA
3	0.060	2ewnA	0.435	4.89	0.081	0.621	6.3.4.15	NA
4	0.060	3b9jJ	0.322	5.75	0.092	0.566	1.17.1.4 1.17.3.2	NA
5	0.060	2glxE	0.427	4.93	0.067	0.667	1.1.1.263	38

	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	0.02	2bmoA	0.548	3.91	0.082	0.740	0.44	FES	complex1.pdb.gz	158,159,160
2	0.02	1kcm0	0.570	4.16	0.087	0.758	0.55	III	complex2.pdb.gz	80,110,143,150,154,157,158
3	0.01	3gb4A	0.570	4.07	0.036	0.767	0.42	D3M	complex3.pdb.gz	94,96,113,162,165

	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.