SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'TXE'


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.
3NRR_A_D16A530_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5abm RETINAL
DEHYDROGENASE 1
(Ovis
aries) 		5 / 12 ALA A 242
ILE A 253
LEU A 269
GLY A 245
TYR A 425
 None
None
None
TXE  A 501 (-3.6A)
None
 1.08A 3nrrA-5abmA:
2.2		 3nrrA-5abmA:
20.77
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.
3NRR_B_D16B530_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5abm RETINAL
DEHYDROGENASE 1
(Ovis
aries) 		5 / 12 ALA A 242
ILE A 253
LEU A 269
GLY A 245
TYR A 425
 None
None
None
TXE  A 501 (-3.6A)
None
 1.06A 3nrrB-5abmA:
2.3		 3nrrB-5abmA:
20.77
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.
3SUD_A_SUEA1201_2
(NS3 PROTEASE, NS4A
PROTEIN)		 5abm RETINAL
DEHYDROGENASE 1
(Ovis
aries) 		4 / 4 PHE A 401
TYR A 296
ILE A 357
LEU A 354
 TXE  A 501 ( 3.9A)
None
None
None
 1.49A 3sudA-5abmA:
undetectable		 3sudA-5abmA:
17.67
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.
3TEG_A_DAHA416_1
(PHENYLALANYL-TRNA
SYNTHETASE,
MITOCHONDRIAL)		 5abm RETINAL
DEHYDROGENASE 1
(Ovis
aries) 		5 / 12 SER A 428
PHE A 465
GLY A 270
GLY A 472
GLY A 271
 None
None
TXE  A 501 (-3.7A)
None
None
 1.16A 3tegA-5abmA:
undetectable		 3tegA-5abmA:
20.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4FR8_A_TNGA601_1
(ALDEHYDE
DEHYDROGENASE,
MITOCHONDRIAL)		 5abm RETINAL
DEHYDROGENASE 1
(Ovis
aries) 		5 / 11 ASN A 169
PHE A 170
LEU A 173
MET A 174
CYH A 302
 TXE  A 501 (-3.5A)
None
None
None
TXE  A 501 (-4.4A)
 1.19A 4fr8A-5abmA:
65.1		 4fr8A-5abmA:
67.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4FR8_A_TNGA601_1
(ALDEHYDE
DEHYDROGENASE,
MITOCHONDRIAL)		 5abm RETINAL
DEHYDROGENASE 1
(Ovis
aries) 		5 / 11 ASN A 169
PHE A 170
LEU A 173
TRP A 177
CYH A 302
 TXE  A 501 (-3.5A)
None
None
None
TXE  A 501 (-4.4A)
 1.04A 4fr8A-5abmA:
65.1		 4fr8A-5abmA:
67.40
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.
4G0U_B_ASWB1301_1
(DNA TOPOISOMERASE
2-BETA)		 5abm RETINAL
DEHYDROGENASE 1
(Ovis
aries) 		4 / 7 ILE A 303
GLY A 245
GLU A 268
GLN A 196
 None
TXE  A 501 (-3.6A)
TXE  A 501 (-3.6A)
TXE  A 501 ( 4.1A)
 0.81A 4g0uB-5abmA:
undetectable		 4g0uB-5abmA:
19.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5FHZ_A_REAA602_1
(ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3)		 5abm RETINAL
DEHYDROGENASE 1
(Ovis
aries) 		8 / 12 GLY A 124
THR A 128
ASN A 169
PHE A 170
LEU A 173
TRP A 177
CYH A 301
CYH A 302
 None
None
TXE  A 501 (-3.5A)
None
None
None
None
TXE  A 501 (-4.4A)
 0.64A 5fhzA-5abmA:
62.2		 5fhzA-5abmA:
68.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5FHZ_A_REAA602_1
(ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3)		 5abm RETINAL
DEHYDROGENASE 1
(Ovis
aries) 		7 / 12 GLY A 124
THR A 128
PHE A 170
LEU A 173
MET A 174
CYH A 301
CYH A 302
 None
None
None
None
None
None
TXE  A 501 (-4.4A)
 0.94A 5fhzA-5abmA:
62.2		 5fhzA-5abmA:
68.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5FHZ_D_READ602_1
(ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3)		 5abm RETINAL
DEHYDROGENASE 1
(Ovis
aries) 		6 / 12 GLY A 124
ASN A 169
TRP A 177
GLU A 268
CYH A 301
CYH A 302
 None
TXE  A 501 (-3.5A)
None
TXE  A 501 (-3.6A)
None
TXE  A 501 (-4.4A)
 0.75A 5fhzD-5abmA:
61.1		 5fhzD-5abmA:
68.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5FHZ_D_READ602_1
(ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3)		 5abm RETINAL
DEHYDROGENASE 1
(Ovis
aries) 		5 / 12 GLY A 124
MET A 174
GLU A 268
CYH A 301
CYH A 302
 None
None
TXE  A 501 (-3.6A)
None
TXE  A 501 (-4.4A)
 1.12A 5fhzD-5abmA:
61.1		 5fhzD-5abmA:
68.71
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.
5HWA_A_GCSA303_1
(CHITOSANASE)		 5abm RETINAL
DEHYDROGENASE 1
(Ovis
aries) 		4 / 5 HIS A 235
VAL A 221
GLY A 229
ALA A 228
 None
None
TXE  A 501 (-3.5A)
None
 1.04A 5hwaA-5abmA:
undetectable		 5hwaA-5abmA:
20.60