SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2qde'

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.
1FM6_A_9CRA501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 ILE A  69
ALA A 103
GLN A 102
VAL A 387
LEU A  38
 None
 0.97A 1fm6A-2qdeA:
undetectable		 1fm6A-2qdeA:
22.44
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.
1RBP_A_RTLA183_0
(PLASMA
RETINOL-BINDING
PROTEIN PRECURSOR)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 LEU A 284
LEU A 267
ALA A 263
ALA A 264
VAL A 294
 None
 1.35A 1rbpA-2qdeA:
undetectable		 1rbpA-2qdeA:
17.51
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.
1XDK_A_9CRA500_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 ILE A  69
ALA A 103
GLN A 102
VAL A 387
LEU A  38
 None
 1.12A 1xdkA-2qdeA:
undetectable		 1xdkA-2qdeA:
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.
1XIU_B_9CRB202_1
(RXR-LIKE PROTEIN)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 ILE A  69
ALA A 103
GLN A 102
VAL A 387
LEU A  38
 None
 1.05A 1xiuB-2qdeA:
undetectable		 1xiuB-2qdeA:
21.63
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.
2AVO_B_MK1B902_1
(POL POLYPROTEIN)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 9 LEU A 369
ILE A  31
GLY A  33
VAL A 374
ILE A 345
 None
 1.02A 2avoA-2qdeA:
undetectable		 2avoA-2qdeA:
13.39
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.
2FJ1_A_CTCA222_0
(TETRACYCLINE
REPRESSOR PROTEIN
CLASS D)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 PRO A  16
THR A 379
LEU A 373
ILE A 345
SER A 302
 None
 1.43A 2fj1A-2qdeA:
undetectable		 2fj1A-2qdeA:
21.55
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.
2PLW_A_SAMA203_0
(RIBOSOMAL RNA
METHYLTRANSFERASE,
PUTATIVE)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 ALA A  48
GLY A 303
PRO A 308
ILE A 341
ALA A 346
 None
 1.08A 2plwA-2qdeA:
2.5		 2plwA-2qdeA:
18.59
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.
2PRG_A_BRLA1_2
(PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
GAMMA)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		3 / 3 ILE A 332
ILE A 345
LEU A 137
 None
 0.57A 2prgA-2qdeA:
undetectable		 2prgA-2qdeA:
23.47
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.
2QO6_A_CHDA130_0
(LIVER-BASIC FATTY
ACID BINDING PROTEIN)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 LEU A 217
ILE A 220
LEU A 212
VAL A 182
ASP A 175
 None
 1.18A 2qo6A-2qdeA:
undetectable		 2qo6A-2qdeA:
16.13
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.
2QQT_A_AINA596_1
(LACTOPEROXIDASE)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 6 HIS A 331
GLU A 325
PHE A 163
GLN A 324
 None
 1.38A 2qqtA-2qdeA:
undetectable		 2qqtA-2qdeA:
21.90
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.
3A35_B_RBFB191_1
(LUMAZINE PROTEIN)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 LEU A 224
ASP A 203
GLN A 204
ALA A 205
THR A 208
 None
 1.22A 3a35B-2qdeA:
undetectable		 3a35B-2qdeA:
20.30
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.
3DZU_A_9CRA7223_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 ILE A  69
ALA A 103
GLN A 102
VAL A 387
LEU A  38
 None
 0.98A 3dzuA-2qdeA:
undetectable		 3dzuA-2qdeA:
21.60
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.
3DZY_A_9CRA463_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 ILE A  69
ALA A 103
GLN A 102
VAL A 387
LEU A  38
 None
 1.03A 3dzyA-2qdeA:
undetectable		 3dzyA-2qdeA:
21.60
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.
3R9C_A_ECLA452_1
(CYTOCHROME P450
164A2)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 ALA A  50
LEU A  36
LEU A  38
LEU A 111
LEU A 126
 None
 1.12A 3r9cA-2qdeA:
undetectable		 3r9cA-2qdeA:
25.21
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.
3ROX_A_TEPA266_1
(APOLIPOPROTEIN
A-I-BINDING PROTEIN)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 8 VAL A 107
ASP A 108
LEU A 111
ASP A  94
 None
 0.75A 3roxA-2qdeA:
undetectable		 3roxA-2qdeA:
23.52
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.
3S53_A_017A201_1
(PROTEASE)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 9 ASP A 175
GLY A 169
ALA A 168
ILE A 220
GLY A 198
 None
 0.98A 3s53A-2qdeA:
undetectable		 3s53A-2qdeA:
14.44
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.
4EYR_B_RITB301_1
(HIV-1 PROTEASE)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 7 LEU A 365
ALA A 306
VAL A 349
ILE A  31
 None
 0.92A 4eyrA-2qdeA:
undetectable		 4eyrA-2qdeA:
14.44
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.
4FEU_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 8 ASP A 246
CYH A 298
GLU A 325
GLU A 247
 BA  A 401 (-3.7A)
None
None
BA  A 401 (-3.3A)
 1.15A 4feuF-2qdeA:
undetectable		 4feuF-2qdeA:
20.70
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.
4FEV_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 7 ASP A 246
ASP A  52
GLU A 325
GLU A 247
 BA  A 401 (-3.7A)
None
None
BA  A 401 (-3.3A)
 1.03A 4fevD-2qdeA:
undetectable		 4fevD-2qdeA:
20.70
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.
4FEW_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 8 ASP A 246
ASP A  52
GLU A 325
GLU A 247
 BA  A 401 (-3.7A)
None
None
BA  A 401 (-3.3A)
 1.03A 4fewD-2qdeA:
undetectable		 4fewD-2qdeA:
20.70
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.
4FEW_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 8 ASP A 246
CYH A 298
GLU A 325
GLU A 247
 BA  A 401 (-3.7A)
None
None
BA  A 401 (-3.3A)
 1.19A 4fewD-2qdeA:
undetectable		 4fewD-2qdeA:
20.70
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.
4FEW_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 8 ASP A 246
ASP A  52
GLU A 325
GLU A 247
 BA  A 401 (-3.7A)
None
None
BA  A 401 (-3.3A)
 1.07A 4fewF-2qdeA:
undetectable		 4fewF-2qdeA:
20.70
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.
4FEW_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 8 ASP A 246
CYH A 298
GLU A 325
GLU A 247
 BA  A 401 (-3.7A)
None
None
BA  A 401 (-3.3A)
 1.20A 4fewF-2qdeA:
undetectable		 4fewF-2qdeA:
20.70
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.
4GKH_B_KANB301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 8 ASP A 246
ASP A  52
GLU A 325
GLU A 247
 BA  A 401 (-3.7A)
None
None
BA  A 401 (-3.3A)
 1.02A 4gkhB-2qdeA:
undetectable		 4gkhB-2qdeA:
20.70
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.
4GKH_B_KANB301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 8 ASP A 246
CYH A 298
GLU A 325
GLU A 247
 BA  A 401 (-3.7A)
None
None
BA  A 401 (-3.3A)
 1.13A 4gkhB-2qdeA:
undetectable		 4gkhB-2qdeA:
20.70
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.
4GKH_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 8 ASP A 246
ASP A  52
GLU A 325
GLU A 247
 BA  A 401 (-3.7A)
None
None
BA  A 401 (-3.3A)
 1.05A 4gkhF-2qdeA:
undetectable		 4gkhF-2qdeA:
20.70
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.
4GKH_G_KANG301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 7 ASP A 246
ASP A  52
GLU A 325
GLU A 247
 BA  A 401 (-3.7A)
None
None
BA  A 401 (-3.3A)
 1.05A 4gkhG-2qdeA:
undetectable		 4gkhG-2qdeA:
20.70
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.
4GKH_K_KANK301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 8 ASP A 246
ASP A  52
GLU A 325
GLU A 247
 BA  A 401 (-3.7A)
None
None
BA  A 401 (-3.3A)
 1.05A 4gkhC-2qdeA:
undetectable
4gkhK-2qdeA:
undetectable		 4gkhC-2qdeA:
20.70
4gkhK-2qdeA:
20.70
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.
4GKI_A_KANA301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 8 ASP A 246
ASP A  52
GLU A 325
GLU A 247
 BA  A 401 (-3.7A)
None
None
BA  A 401 (-3.3A)
 1.05A 4gkiA-2qdeA:
undetectable		 4gkiA-2qdeA:
20.70
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.
4GKI_A_KANA301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 8 ASP A 246
CYH A 298
GLU A 325
GLU A 247
 BA  A 401 (-3.7A)
None
None
BA  A 401 (-3.3A)
 1.21A 4gkiA-2qdeA:
undetectable		 4gkiA-2qdeA:
20.70
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.
4GKI_C_KANC301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 8 ASP A 246
ASP A  52
GLU A 325
GLU A 247
 BA  A 401 (-3.7A)
None
None
BA  A 401 (-3.3A)
 1.06A 4gkiC-2qdeA:
undetectable		 4gkiC-2qdeA:
20.70
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.
4GKI_C_KANC301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 8 ASP A 246
CYH A 298
GLU A 325
GLU A 247
 BA  A 401 (-3.7A)
None
None
BA  A 401 (-3.3A)
 1.13A 4gkiC-2qdeA:
undetectable		 4gkiC-2qdeA:
20.70
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.
4GKI_G_KANG301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 8 ASP A 246
ASP A  52
GLU A 325
GLU A 247
 BA  A 401 (-3.7A)
None
None
BA  A 401 (-3.3A)
 1.08A 4gkiE-2qdeA:
undetectable
4gkiG-2qdeA:
undetectable		 4gkiE-2qdeA:
20.70
4gkiG-2qdeA:
20.70
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.
4O5F_A_PAUA301_0
(TYPE III
PANTOTHENATE KINASE)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 LEU A 373
ASP A 344
THR A  15
ILE A  13
LEU A  35
 None
 0.87A 4o5fA-2qdeA:
undetectable
4o5fB-2qdeA:
undetectable		 4o5fA-2qdeA:
22.25
4o5fB-2qdeA:
22.25
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.
4O5F_B_PAUB302_0
(TYPE III
PANTOTHENATE KINASE)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 LEU A  35
LEU A 373
ASP A 344
THR A  15
ILE A  13
 None
 0.89A 4o5fA-2qdeA:
undetectable
4o5fB-2qdeA:
undetectable		 4o5fA-2qdeA:
22.25
4o5fB-2qdeA:
22.25
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.
4P6V_E_RBFE201_1
(NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT B
NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT E)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 5 HIS A  39
VAL A   8
GLU A   9
VAL A  45
 None
 1.06A 4p6vB-2qdeA:
undetectable
4p6vE-2qdeA:
undetectable		 4p6vB-2qdeA:
22.30
4p6vE-2qdeA:
19.40
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.
4PEV_B_ADNB501_2
(MEMBRANE LIPOPROTEIN
FAMILY PROTEIN)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		3 / 3 PRO A 223
LEU A 224
GLN A 204
 None
 0.63A 4pevB-2qdeA:
2.3		 4pevB-2qdeA:
22.01
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.
4PO0_A_NPSA602_1
(SERUM ALBUMIN)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 8 LYS A 279
ALA A 280
LEU A 284
LEU A 312
 None
 0.83A 4po0A-2qdeA:
undetectable		 4po0A-2qdeA:
21.36
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.
4RET_C_DGXC2005_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 GLU A 159
LEU A 357
LEU A 141
GLY A 328
ALA A 306
 None
 1.29A 4retC-2qdeA:
undetectable		 4retC-2qdeA:
16.54
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.
5B8H_A_PAUA302_0
(TYPE III
PANTOTHENATE KINASE)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 LEU A 373
ASP A 344
THR A  15
ILE A  13
LEU A  35
 None
 0.88A 5b8hA-2qdeA:
undetectable
5b8hB-2qdeA:
undetectable		 5b8hA-2qdeA:
23.47
5b8hB-2qdeA:
23.47
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.
5B8H_B_PAUB302_0
(TYPE III
PANTOTHENATE KINASE)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 LEU A  35
LEU A 373
ASP A 344
THR A  15
ILE A  13
 None
 0.90A 5b8hA-2qdeA:
undetectable
5b8hB-2qdeA:
undetectable		 5b8hA-2qdeA:
23.47
5b8hB-2qdeA:
23.47
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.
5C0O_H_SAMH301_0
(TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
TRMI)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 ALA A 346
GLY A 303
SER A 302
GLY A 301
GLU A 353
 None
 1.06A 5c0oH-2qdeA:
1.4		 5c0oH-2qdeA:
23.12
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.
5H4D_A_BBIA403_1
(NAD-DEPENDENT
PROTEIN DEACETYLASE
SIRTUIN-3,
MITOCHONDRIAL)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		4 / 6 PHE A 193
GLU A 325
GLU A 152
VAL A 156
 None
 1.25A 5h4dA-2qdeA:
undetectable		 5h4dA-2qdeA:
21.59
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.
5IEP_A_VDYA201_2
(CDL2.3B)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 9 ILE A 243
PRO A 242
VAL A 179
LEU A 212
LEU A 224
 None
 1.25A 5iepA-2qdeA:
undetectable		 5iepA-2qdeA:
17.57
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.
5UAN_A_9CRA503_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 ILE A  69
ALA A 103
GLN A 102
VAL A 387
LEU A  38
 None
 0.96A 5uanA-2qdeA:
undetectable		 5uanA-2qdeA:
22.20
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.
5ZNI_A_YMZA302_0
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 9 GLY A 303
VAL A 349
ASP A  49
GLY A 301
PRO A 329
 None
 1.40A 5zniA-2qdeA:
undetectable		 5zniA-2qdeA:
13.32
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.
6D8F_A_ACTA803_0
(UNCHARACTERIZED
PROTEIN)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		3 / 3 GLU A 151
LEU A 154
ARG A 158
 None
 0.83A 6d8fA-2qdeA:
undetectable		 6d8fA-2qdeA:
21.50
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.
6DWN_A_AQ4A602_0
(CYTOCHROME P450 1A1)		 2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Aromatoleum
aromaticum) 		5 / 12 SER A 302
ASP A  49
GLY A  33
ASP A  32
ILE A 332
 None
 1.32A 6dwnA-2qdeA:
undetectable		 6dwnA-2qdeA:
13.42