SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2XQ'


List of Similar Pattern of Amino Acids


Hit pattern: 3D amino acid arrangements similar to known drug binding site

Query pattern: Residues from known binding site for annotated drug that match the hit pattern


(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID
Hit
Macromolecule
Res.
Matches
Interface HETATM RMSD Dali
Z-score
Seq.
Identity (%)
View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2G70_B_SAMB2002_0
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)
4qbj GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE

(Aspergillus
fumigatus)
5 / 12 LEU A 438
HIS A 265
ALA A 421
PHE A 373
TYR A 374
None
2XQ  A 505 (-4.0A)
None
None
None
1.41A 2g70B-4qbjA:
undetectable
2g70B-4qbjA:
19.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2NYR_B_SVRB401_2
(NAD-DEPENDENT
DEACETYLASE
SIRTUIN-5)
4qbj GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE

(Aspergillus
fumigatus)
4 / 6 ARG A 236
ASN A 241
ASN A 213
LEU A 168
None
None
2XQ  A 505 ( 3.5A)
None
1.30A 2nyrA-4qbjA:
undetectable
2nyrA-4qbjA:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2WEK_A_DIFA1375_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)
4qbj GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE

(Aspergillus
fumigatus)
3 / 3 LEU A 436
TYR A 263
GLN A 456
2XQ  A 505 ( 4.4A)
2XQ  A 505 (-3.8A)
None
0.72A 2wekA-4qbjA:
undetectable
2wekA-4qbjA:
22.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4F8Y_C_VK3C202_1
(NADPH QUINONE
OXIDOREDUCTASE)
4qbj GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE

(Aspergillus
fumigatus)
4 / 7 TYR A 263
LEU A 436
ASN A 434
TYR A 374
2XQ  A 505 (-3.8A)
2XQ  A 505 ( 4.4A)
2XQ  A 505 (-3.9A)
None
1.35A 4f8yC-4qbjA:
undetectable
4f8yD-4qbjA:
undetectable
4f8yC-4qbjA:
17.87
4f8yD-4qbjA:
17.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4F8Y_C_VK3C202_1
(NADPH QUINONE
OXIDOREDUCTASE)
4qbj GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE

(Aspergillus
fumigatus)
4 / 7 TYR A 263
LEU A 457
ASN A 434
TYR A 374
2XQ  A 505 (-3.8A)
None
2XQ  A 505 (-3.9A)
None
1.24A 4f8yC-4qbjA:
undetectable
4f8yD-4qbjA:
undetectable
4f8yC-4qbjA:
17.87
4f8yD-4qbjA:
17.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XP1_A_LDPA708_1
(DOPAMINE
TRANSPORTER, ISOFORM
B)
4qbj GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE

(Aspergillus
fumigatus)
5 / 10 PHE A 155
VAL A 432
ASP A 431
PHE A 278
SER A 378
None
2XQ  A 505 (-4.5A)
None
2XQ  A 505 (-3.6A)
2XQ  A 505 (-3.1A)
1.07A 4xp1A-4qbjA:
undetectable
4xp1A-4qbjA:
19.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XP4_A_COCA706_1
(DOPAMINE TRANSPORTER)
4qbj GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE

(Aspergillus
fumigatus)
5 / 11 PHE A 155
VAL A 432
ASP A 431
PHE A 278
SER A 378
None
2XQ  A 505 (-4.5A)
None
2XQ  A 505 (-3.6A)
2XQ  A 505 (-3.1A)
1.12A 4xp4A-4qbjA:
undetectable
4xp4A-4qbjA:
20.22