SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4pue'

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.
11GS_A_EAAA211_1
(GLUTATHIONE
S-TRANSFERASE)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		4 / 7 PHE A 360
ILE A 284
TYR A 281
GLY A 363
 None
 0.67A 11gsA-4pueA:
undetectable		 11gsA-4pueA:
23.21
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.
11GS_B_EAAB211_1
(GLUTATHIONE
S-TRANSFERASE)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		4 / 7 PHE A 360
ILE A 284
TYR A 281
GLY A 363
 None
 0.67A 11gsB-4pueA:
undetectable		 11gsB-4pueA:
23.21
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.
1AV2_D_DVAD8_0
(GRAMICIDIN A)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		3 / 3 VAL A  98
VAL A 160
TRP A 172
 None
 0.89A 1av2C-4pueA:
undetectable
1av2D-4pueA:
undetectable		 1av2C-4pueA:
3.28
1av2D-4pueA:
3.28
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.
1W5U_D_DVAD8_0
(GRAMICIDIN D)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		3 / 3 VAL A  98
VAL A 160
TRP A 172
 None
 0.92A 1w5uC-4pueA:
undetectable
1w5uD-4pueA:
undetectable		 1w5uC-4pueA:
3.28
1w5uD-4pueA:
3.28
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.
2ACL_C_REAC503_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		5 / 10 ALA A 188
ASN A 158
PHE A 185
ALA A 187
ILE A 231
 None
XYP  A 403 (-3.2A)
None
None
None
 1.17A 2aclC-4pueA:
undetectable		 2aclC-4pueA:
21.62
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.
2GSS_A_EAAA0_1
(GLUTATHIONE
S-TRANSFERASE P1-1)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		4 / 8 PHE A 360
ILE A 284
TYR A 281
GLY A 363
 None
 0.74A 2gssA-4pueA:
undetectable		 2gssA-4pueA:
22.92
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.
2GSS_B_EAAB0_1
(GLUTATHIONE
S-TRANSFERASE P1-1)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		4 / 8 PHE A 360
ILE A 284
TYR A 281
GLY A 363
 None
 0.74A 2gssB-4pueA:
undetectable		 2gssB-4pueA:
22.92
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.
2IZQ_A_DVAA8_0
(GRAMICIDIN D)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		3 / 3 VAL A 160
TRP A 172
VAL A  98
 None
 0.91A 2izqA-4pueA:
undetectable
2izqB-4pueA:
undetectable		 2izqA-4pueA:
3.28
2izqB-4pueA:
3.28
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.
2XDC_A_DVAA8_0
(GRAMICIDIN A)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		3 / 3 VAL A 268
TRP A 316
TRP A 324
 None
XYP  A 404 (-4.0A)
XYP  A 403 (-4.0A)
 1.24A 2xdcA-4pueA:
undetectable
2xdcB-4pueA:
undetectable		 2xdcA-4pueA:
3.28
2xdcB-4pueA:
3.28
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.
2XDC_B_DVAB8_0
(GRAMICIDIN A)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		3 / 3 TRP A 324
VAL A 268
TRP A 316
 XYP  A 403 (-4.0A)
None
XYP  A 404 (-4.0A)
 1.26A 2xdcA-4pueA:
undetectable
2xdcB-4pueA:
undetectable		 2xdcA-4pueA:
3.28
2xdcB-4pueA:
3.28
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.
2Y5M_A_DVAA8_0
(VAL-GRAMICIDIN A)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		3 / 3 VAL A 268
TRP A 316
TRP A 324
 None
XYP  A 404 (-4.0A)
XYP  A 403 (-4.0A)
 1.26A 2y5mA-4pueA:
undetectable
2y5mB-4pueA:
undetectable		 2y5mA-4pueA:
3.28
2y5mB-4pueA:
3.28
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.
2Y6N_A_DVAA8_0
(VAL-GRAMICIDIN A)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		3 / 3 VAL A 268
TRP A 316
TRP A 324
 None
XYP  A 404 (-4.0A)
XYP  A 403 (-4.0A)
 1.26A 2y6nA-4pueA:
undetectable
2y6nB-4pueA:
undetectable		 2y6nA-4pueA:
3.28
2y6nB-4pueA:
3.28
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.
2Y6N_B_DVAB8_0
(VAL-GRAMICIDIN A)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		3 / 3 TRP A 324
VAL A 268
TRP A 316
 XYP  A 403 (-4.0A)
None
XYP  A 404 (-4.0A)
 1.26A 2y6nA-4pueA:
undetectable
2y6nB-4pueA:
undetectable		 2y6nA-4pueA:
3.28
2y6nB-4pueA:
3.28
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.
3BRF_A_SORA2_0
(LIN-12 AND GLP-1
PHENOTYPE PROTEIN 1,
ISOFORM A)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		3 / 3 LYS A 148
LYS A 141
VAL A 144
 None
 0.84A 3brfA-4pueA:
undetectable		 3brfA-4pueA:
22.04
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.
3GSS_A_EAAA212_1
(GLUTATHIONE
S-TRANSFERASE P1-1)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		4 / 7 PHE A 360
ILE A 284
TYR A 281
GLY A 363
 None
 0.62A 3gssA-4pueA:
undetectable		 3gssA-4pueA:
22.92
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.
3GSS_B_EAAB211_1
(GLUTATHIONE
S-TRANSFERASE P1-1)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		4 / 7 PHE A 360
ILE A 284
TYR A 281
GLY A 363
 None
 0.64A 3gssB-4pueA:
undetectable		 3gssB-4pueA:
22.92
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.
3L8L_B_DVAB8_0
(GRAMICIDIN D)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		3 / 3 VAL A  98
VAL A 160
TRP A 172
 None
 0.85A 3l8lA-4pueA:
undetectable
3l8lB-4pueA:
undetectable		 3l8lA-4pueA:
3.28
3l8lB-4pueA:
3.55
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.
3N9J_A_EAAA210_1
(GLUTATHIONE
S-TRANSFERASE P)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		4 / 8 PHE A 360
ILE A 284
TYR A 281
GLY A 363
 None
 0.76A 3n9jA-4pueA:
undetectable		 3n9jA-4pueA:
23.21
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.
3OKX_B_SAMB201_0
(YAEB-LIKE PROTEIN
RPA0152)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		3 / 3 LYS A 301
ARG A  23
LYS A   9
 ZN  A 409 ( 4.6A)
None
None
 1.47A 3okxA-4pueA:
undetectable		 3okxA-4pueA:
18.90
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.
3SGL_A_SAMA692_0
(TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		5 / 12 GLU A 265
THR A  96
TYR A 153
VAL A 313
GLY A 232
 XYP  A 403 (-3.1A)
None
None
None
None
 1.06A 3sglA-4pueA:
undetectable		 3sglA-4pueA:
20.85
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.
3TWP_A_SALA404_1
(ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		4 / 7 ALA A 358
TYR A 271
ARG A 328
ALA A 329
 None
None
XYP  A 401 (-3.3A)
None
 0.99A 3twpA-4pueA:
undetectable		 3twpA-4pueA:
22.62
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.
3W9T_C_W9TC1005_1
(HEMOLYTIC LECTIN
CEL-III)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		3 / 3 ASP A 202
GLY A 162
TYR A 203
 None
None
XYP  A 402 ( 3.9A)
 0.77A 3w9tC-4pueA:
undetectable		 3w9tC-4pueA:
19.91
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.
3W9T_G_W9TG503_1
(HEMOLYTIC LECTIN
CEL-III)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		3 / 3 ASP A 202
GLY A 162
TYR A 203
 None
None
XYP  A 402 ( 3.9A)
 0.77A 3w9tG-4pueA:
undetectable		 3w9tG-4pueA:
19.91
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.
4A7A_B_RGZB601_1
(AMINE OXIDASE
[FLAVIN-CONTAINING]
B)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		5 / 12 LEU A 299
LEU A 302
LEU A 306
ILE A 263
ILE A 247
 None
 1.13A 4a7aB-4pueA:
undetectable		 4a7aB-4pueA:
19.54
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.
4DMG_A_SAMA401_0
(PUTATIVE
UNCHARACTERIZED
PROTEIN TTHA1493)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		5 / 12 TYR A 199
TYR A 153
ASP A  91
ALA A  33
ASP A 155
 None
 1.45A 4dmgA-4pueA:
undetectable		 4dmgA-4pueA:
20.14
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.
4DMG_B_SAMB401_0
(PUTATIVE
UNCHARACTERIZED
PROTEIN TTHA1493)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		5 / 11 TYR A 199
TYR A 153
ASP A  91
ALA A  33
ASP A 155
 None
 1.45A 4dmgB-4pueA:
undetectable		 4dmgB-4pueA:
20.14
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.
4OK1_A_198A1001_2
(ANDROGEN RECEPTOR)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		4 / 8 LEU A 259
ASN A 261
LEU A 214
ILE A 247
 None
 0.87A 4ok1A-4pueA:
undetectable		 4ok1A-4pueA:
21.77
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.
4RZV_A_032A801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		4 / 5 ILE A 318
VAL A  34
PHE A  94
HIS A  51
 None
 1.24A 4rzvA-4pueA:
undetectable		 4rzvA-4pueA:
19.15
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.
4XP6_A_B40A601_1
(TRANSPORTER)		 4pue ENDO-1,4-BETA-XYLANA
SE
(Geobacillus
stearothermophil
us) 		4 / 5 ASP A 202
VAL A 218
PHE A 254
GLY A 230
 None
 1.05A 4xp6A-4pueA:
undetectable		 4xp6A-4pueA:
21.57