SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'AKR'


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.
1MRL_C_DOLC302_1
(STREPTOGRAMIN A
ACETYLTRANSFERASE)
4kem MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Azospirillum
lipoferum)
5 / 10 VAL A 345
TYR A 342
TYR A  56
HIS A 321
ASN A 214
None
AKR  A 405 (-4.7A)
None
AKR  A 405 (-4.6A)
AKR  A 405 ( 3.3A)
1.46A 1mrlA-4kemA:
0.0
1mrlC-4kemA:
0.0
1mrlA-4kemA:
19.11
1mrlC-4kemA:
19.11
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.
2ZTH_A_SAMA305_1
(CATECHOL
O-METHYLTRANSFERASE)
4kem MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Azospirillum
lipoferum)
3 / 3 SER A 327
GLU A 340
ASP A 291
None
AKR  A 405 (-2.7A)
None
0.81A 2zthA-4kemA:
3.1
2zthA-4kemA:
21.24
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.
3BWY_A_SAMA301_1
(COMT PROTEIN)
4kem MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Azospirillum
lipoferum)
3 / 3 SER A 327
GLU A 340
ASP A 291
None
AKR  A 405 (-2.7A)
None
0.85A 3bwyA-4kemA:
undetectable
3bwyA-4kemA:
20.31
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.
4LRH_D_FOLD301_1
(FOLATE RECEPTOR
ALPHA)
4kem MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Azospirillum
lipoferum)
3 / 3 HIS A 321
TRP A 236
SER A  52
AKR  A 405 (-4.6A)
None
None
1.18A 4lrhD-4kemA:
undetectable
4lrhD-4kemA:
19.07
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.
4PAH_A_LNRA600_1
(PHENYLALANINE
HYDROXYLASE)
5y4k DMSP LYASE DDDY
(Acinetobacter
bereziniae)
4 / 6 HIS A 265
HIS A 338
TYR A 271
GLU A 269
ZN  A 501 ( 3.3A)
ZN  A 501 ( 3.3A)
AKR  A 502 (-4.7A)
ZN  A 501 ( 2.4A)
1.04A 4pahA-5y4kA:
undetectable
4pahA-5y4kA:
21.39
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.
5EWU_B_BEZB1401_0
(MAGNESIUM-CHELATASE
SUBUNIT CHLH,
CHLOROPLASTIC)
5gxd AMP-DEPENDENT
SYNTHETASE AND
LIGASE

(Dinoroseobacter
shibae)
4 / 6 GLY A 394
THR A 393
SER A 289
VAL A 285
None
None
None
AKR  A 702 ( 4.4A)
0.99A 5ewuB-5gxdA:
2.4
5ewuB-5gxdA:
20.80
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.
5PAH_A_LDPA600_1
(PHENYLALANINE
4-MONOOXYGENASE)
5y4k DMSP LYASE DDDY
(Acinetobacter
bereziniae)
4 / 4 HIS A 265
HIS A 338
TYR A 271
GLU A 269
ZN  A 501 ( 3.3A)
ZN  A 501 ( 3.3A)
AKR  A 502 (-4.7A)
ZN  A 501 ( 2.4A)
1.03A 5pahA-5y4kA:
undetectable
5pahA-5y4kA:
21.39
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2

(Mus
musculus)
5 / 10 PRO A 173
MET A 502
ILE A 499
PHE A 479
GLU A 491
None
None
None
AKR  A 609 (-4.6A)
None
1.39A 5tixB-4ph9A:
undetectable
5tixB-4ph9A:
18.52