SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'SEB'


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.
1ACJ_A_THAA999_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 9 TRP A 245
GLY A 278
TRP A 592
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.5A)
None
SEB  A 360 ( 4.2A)
None
 0.91A 1acjA-5ydjA:
65.6		 1acjA-5ydjA:
12.11
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.
1ACJ_A_THAA999_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 9 TRP A 245
GLY A 279
GLU A 359
TYR A 493
TRP A 592
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
None
 0.51A 1acjA-5ydjA:
65.6		 1acjA-5ydjA:
12.11
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.
1ACL_A_DMEA999_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 10 TRP A 245
TYR A 282
GLU A 359
TRP A 441
TYR A 493
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
None
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
None
 0.39A 1aclA-5ydjA:
66.0		 1aclA-5ydjA:
12.11
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.
1AEG_A_4APA296_1
(CYTOCHROME C
PEROXIDASE)		 4kry ACETYL ESTERASE
(Escherichia
coli) 		5 / 8 HIS A 292
GLY A 215
GLY A 210
LEU A 264
ASP A 262
 SEB  A 165 ( 4.1A)
None
None
None
None
 0.87A 1aegA-4kryA:
undetectable		 1aegA-4kryA:
20.71
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.
1AX9_A_EDRA999_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		4 / 8 TRP A 245
GLY A 278
GLU A 359
HIS A 600
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.5A)
SEB  A 360 ( 3.3A)
SEB  A 360 ( 4.2A)
 0.93A 1ax9A-5ydjA:
60.2		 1ax9A-5ydjA:
12.11
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.
1AX9_A_EDRA999_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		6 / 8 TRP A 245
GLY A 279
TYR A 282
GLU A 359
PHE A 490
HIS A 600
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 3.3A)
None
SEB  A 360 ( 4.2A)
 0.37A 1ax9A-5ydjA:
60.2		 1ax9A-5ydjA:
12.11
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.
1BRP_A_RTLA183_0
(RETINOL BINDING
PROTEIN)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 12 PHE A 449
ALA A 361
PHE A 490
LEU A 384
GLN A 385
 None
SEB  A 360 ( 3.7A)
None
None
None
 1.41A 1brpA-5ydjA:
undetectable		 1brpA-5ydjA:
undetectable
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.
1DX6_A_GNTA602_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		10 / 12 ASP A 233
TRP A 245
GLY A 278
GLY A 279
GLY A 280
TYR A 282
TRP A 393
PHE A 449
PHE A 490
HIS A 600
 None
SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.5A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.0A)
None
None
None
None
SEB  A 360 ( 4.2A)
 0.40A 1dx6A-5ydjA:
65.7		 1dx6A-5ydjA:
9.02
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.
1EVE_A_E20A2001_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		6 / 10 GLY A 280
TYR A 282
TRP A 441
PHE A 490
TYR A 493
HIS A 600
 SEB  A 360 ( 3.0A)
None
None
None
None
SEB  A 360 ( 4.2A)
 1.15A 1eveA-5ydjA:
66.7		 1eveA-5ydjA:
9.02
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.
1EVE_A_E20A2001_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		9 / 10 TRP A 245
GLY A 279
TYR A 282
GLU A 359
TRP A 441
LEU A 444
PHE A 490
TYR A 493
HIS A 600
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 3.3A)
None
SO4  A 816 (-4.0A)
None
None
SEB  A 360 ( 4.2A)
 0.73A 1eveA-5ydjA:
66.7		 1eveA-5ydjA:
9.02
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.
1FML_A_RTLA401_0
(RETINOL DEHYDRATASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 12 LEU A 368
LEU A 371
SER A 367
HIS A 600
PHE A 449
 None
None
None
SEB  A 360 ( 4.2A)
None
 1.20A 1fmlA-5ydjA:
undetectable		 1fmlA-5ydjA:
undetectable
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.
1FML_B_RTLB501_0
(RETINOL DEHYDRATASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 12 LEU A 368
LEU A 371
SER A 367
HIS A 600
PHE A 449
 None
None
None
SEB  A 360 ( 4.2A)
None
 1.19A 1fmlB-5ydjA:
undetectable		 1fmlB-5ydjA:
undetectable
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.
1GMK_C_DVAC6_0
(GRAMICIDIN A)		 2apj PUTATIVE ESTERASE
(Arabidopsis
thaliana) 		3 / 3 ALA A  34
VAL A  92
TRP A  50
 SEB  A  31 ( 3.8A)
None
None
 0.98A 1gmkC-2apjA:
undetectable
1gmkD-2apjA:
undetectable		 1gmkC-2apjA:
6.17
1gmkD-2apjA:
6.17
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.
1HRK_A_CHDA1502_0
(FERROCHELATASE)		 4e14 KYNURENINE
FORMAMIDASE
(Drosophila
melanogaster) 		4 / 8 LEU A 125
PRO A  15
VAL A 190
GLY A 189
 None
None
None
SEB  A 157 ( 3.3A)
 1.04A 1hrkA-4e14A:
3.8		 1hrkA-4e14A:
23.36
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.
1JG4_A_SAMA500_0
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 4zrs ESTERASE
(uncultured
bacterium) 		5 / 12 THR A 225
VAL A 226
SER A 227
GLY A 182
GLY A  75
 None
None
None
SEB  A 151 ( 3.7A)
SEB  A 151 ( 3.8A)
 1.04A 1jg4A-4zrsA:
undetectable		 1jg4A-4zrsA:
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.
1KQE_B_DVAB6_0
(MINI-GRAMICIDIN A)		 2apj PUTATIVE ESTERASE
(Arabidopsis
thaliana) 		3 / 3 ALA A  34
VAL A  92
TRP A  50
 SEB  A  31 ( 3.8A)
None
None
 0.89A 1kqeB-2apjA:
undetectable
1kqeD-2apjA:
undetectable		 1kqeB-2apjA:
7.00
1kqeD-2apjA:
7.00
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.
1MAA_A_DMEA998_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		8 / 12 ASP A 233
GLY A 280
TYR A 282
GLU A 359
TRP A 441
TYR A 489
TYR A 493
HIS A 600
 None
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 3.3A)
None
None
None
SEB  A 360 ( 4.2A)
 1.17A 1maaA-5ydjA:
55.1		 1maaA-5ydjA:
9.14
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.
1MAA_A_DMEA998_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		10 / 12 ASP A 233
TRP A 245
GLY A 279
TYR A 282
GLU A 359
TRP A 441
PHE A 449
TYR A 489
TYR A 493
HIS A 600
 None
SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 3.3A)
None
None
None
None
SEB  A 360 ( 4.2A)
 0.60A 1maaA-5ydjA:
55.1		 1maaA-5ydjA:
9.14
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.
1MAA_B_DMEB996_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		4 / 6 TRP A 245
TYR A 282
GLU A 359
ILE A 446
 SEB  A 360 ( 4.2A)
None
SEB  A 360 ( 3.3A)
None
 0.69A 1maaB-5ydjA:
63.3
1maaD-5ydjA:
55.1		 1maaB-5ydjA:
9.14
1maaD-5ydjA:
9.14
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.
1MAA_B_DMEB996_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		4 / 6 TRP A 245
TYR A 282
GLU A 359
TYR A 493
 SEB  A 360 ( 4.2A)
None
SEB  A 360 ( 3.3A)
None
 0.57A 1maaB-5ydjA:
63.3
1maaD-5ydjA:
55.1		 1maaB-5ydjA:
9.14
1maaD-5ydjA:
9.14
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.
1MAA_C_DMEC997_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 12 GLY A 280
TYR A 282
TRP A 441
TYR A 489
PHE A 490
TYR A 493
HIS A 600
 SEB  A 360 ( 3.0A)
None
None
None
None
None
SEB  A 360 ( 4.2A)
 1.19A 1maaC-5ydjA:
59.9		 1maaC-5ydjA:
9.14
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.
1MAA_C_DMEC997_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 12 TRP A 245
GLY A 278
TYR A 489
PHE A 490
HIS A 600
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.5A)
None
None
SEB  A 360 ( 4.2A)
 0.92A 1maaC-5ydjA:
59.9		 1maaC-5ydjA:
9.14
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.
1MAA_C_DMEC997_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		10 / 12 TRP A 245
GLY A 279
TYR A 282
TYR A 291
TRP A 441
PHE A 449
TYR A 489
PHE A 490
TYR A 493
HIS A 600
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
None
None
None
None
None
None
None
SEB  A 360 ( 4.2A)
 0.63A 1maaC-5ydjA:
59.9		 1maaC-5ydjA:
9.14
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.
1MAA_D_DMED999_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		6 / 8 GLY A 280
TYR A 282
GLU A 359
TRP A 441
TYR A 493
HIS A 600
 SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
 1.20A 1maaD-5ydjA:
55.1		 1maaD-5ydjA:
9.14
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.
1MAA_D_DMED999_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 8 TRP A 245
GLY A 279
TYR A 282
GLU A 359
TRP A 441
TYR A 493
HIS A 600
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
 0.56A 1maaD-5ydjA:
55.1		 1maaD-5ydjA:
9.14
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.
1N2X_B_SAMB402_0
(S-ADENOSYL-METHYLTRA
NSFERASE MRAW)		 4e14 KYNURENINE
FORMAMIDASE
(Drosophila
melanogaster) 		5 / 12 GLY A 159
GLY A  87
GLY A  88
VAL A  85
TYR A 255
 SEB  A 157 ( 4.0A)
EDO  A 404 (-3.6A)
SEB  A 157 ( 3.5A)
None
None
 0.88A 1n2xB-4e14A:
2.8		 1n2xB-4e14A:
24.04
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.
1Q23_A_FUAA702_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4zrs ESTERASE
(uncultured
bacterium) 		5 / 12 TYR A 184
PHE A 234
SER A 227
ALA A 158
ALA A 154
 None
SEB  A 151 ( 4.5A)
None
None
SEB  A 151 ( 3.3A)
 1.28A 1q23A-4zrsA:
undetectable
1q23B-4zrsA:
undetectable		 1q23A-4zrsA:
19.38
1q23B-4zrsA:
19.38
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.
1QTI_A_GNTA600_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		6 / 12 ASP A 233
GLY A 279
TYR A 282
GLU A 359
PHE A 490
HIS A 600
 None
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 3.3A)
None
SEB  A 360 ( 4.2A)
 1.08A 1qtiA-5ydjA:
61.5		 1qtiA-5ydjA:
12.11
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.
1QTI_A_GNTA600_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		10 / 12 ASP A 233
TRP A 245
GLY A 278
GLY A 279
GLY A 280
TYR A 282
GLU A 359
PHE A 449
PHE A 490
HIS A 600
 None
SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.5A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
 0.38A 1qtiA-5ydjA:
61.5		 1qtiA-5ydjA:
12.11
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.
1QTI_A_GNTA600_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 12 GLY A 278
GLY A 279
GLY A 280
GLU A 359
PHE A 490
PHE A 449
HIS A 600
 SEB  A 360 ( 3.5A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
 1.03A 1qtiA-5ydjA:
61.5		 1qtiA-5ydjA:
12.11
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.
1U65_A_CP0A1000_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		6 / 11 TRP A 245
TYR A 282
GLU A 359
TRP A 441
LEU A 444
HIS A 600
 SEB  A 360 ( 4.2A)
None
SEB  A 360 ( 3.3A)
None
SO4  A 816 (-4.0A)
SEB  A 360 ( 4.2A)
 0.84A 1u65A-5ydjA:
62.1		 1u65A-5ydjA:
9.02
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.
1U65_A_CP0A1000_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		6 / 11 TRP A 245
TYR A 282
GLU A 359
TRP A 441
TYR A 493
HIS A 600
 SEB  A 360 ( 4.2A)
None
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
 0.44A 1u65A-5ydjA:
62.1		 1u65A-5ydjA:
9.02
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.
1W6R_A_GNTA1536_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		9 / 12 ASP A 233
TRP A 245
GLY A 278
GLY A 279
GLY A 280
TYR A 282
PHE A 449
PHE A 490
HIS A 600
 None
SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.5A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.0A)
None
None
None
SEB  A 360 ( 4.2A)
 0.38A 1w6rA-5ydjA:
65.7		 1w6rA-5ydjA:
9.02
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.
1W6R_A_GNTA1536_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		6 / 12 GLY A 278
GLY A 279
GLY A 280
PHE A 490
PHE A 449
HIS A 600
 SEB  A 360 ( 3.5A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.0A)
None
None
SEB  A 360 ( 4.2A)
 1.13A 1w6rA-5ydjA:
65.7		 1w6rA-5ydjA:
9.02
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.
1W76_A_GNTA1538_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		9 / 11 ASP A 233
TRP A 245
GLY A 279
GLY A 280
TYR A 282
GLU A 359
PHE A 449
PHE A 490
HIS A 600
 None
SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
 0.45A 1w76A-5ydjA:
63.5		 1w76A-5ydjA:
9.02
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.
1W76_B_GNTB1538_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		9 / 10 ASP A 233
TRP A 245
GLY A 278
GLY A 279
TYR A 282
GLU A 359
PHE A 449
PHE A 490
HIS A 600
 None
SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.5A)
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
 0.37A 1w76B-5ydjA:
63.4		 1w76B-5ydjA:
9.02
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.
1X8V_A_ESLA471_1
(CYTOCHROME P450 51)		 4e14 KYNURENINE
FORMAMIDASE
(Drosophila
melanogaster) 		4 / 8 PHE A 248
ALA A 158
HIS A 161
LEU A 125
 None
SEB  A 157 ( 3.3A)
None
None
 0.96A 1x8vA-4e14A:
undetectable		 1x8vA-4e14A:
23.53
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.
1Y4L_B_SVRB301_2
(PHOSPHOLIPASE A2
HOMOLOG 2)		 4e14 KYNURENINE
FORMAMIDASE
(Drosophila
melanogaster) 		5 / 11 LEU A 196
LEU A 193
GLY A  87
HIS A 161
LYS A 158
 None
None
EDO  A 404 (-3.6A)
None
SEB  A 157 ( 2.8A)
 1.24A 1y4lB-4e14A:
undetectable		 1y4lB-4e14A:
16.78
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.
2ACE_A_ACHA998_0
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		6 / 9 GLY A 279
GLY A 280
ALA A 361
PHE A 490
PHE A 449
HIS A 600
 SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.7A)
None
None
SEB  A 360 ( 4.2A)
 1.20A 2aceA-5ydjA:
66.4		 2aceA-5ydjA:
undetectable
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.
2ACE_A_ACHA998_0
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		6 / 9 GLY A 279
GLY A 280
ALA A 361
TRP A 393
PHE A 449
HIS A 600
 SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.7A)
None
None
SEB  A 360 ( 4.2A)
 0.42A 2aceA-5ydjA:
66.4		 2aceA-5ydjA:
undetectable
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.
2ACK_A_EDRA999_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		4 / 7 TRP A 245
GLY A 278
GLU A 359
HIS A 600
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.5A)
SEB  A 360 ( 3.3A)
SEB  A 360 ( 4.2A)
 0.94A 2ackA-5ydjA:
65.2		 2ackA-5ydjA:
12.11
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.
2ACK_A_EDRA999_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		6 / 7 TRP A 245
GLY A 279
TYR A 282
GLU A 359
PHE A 490
HIS A 600
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 3.3A)
None
SEB  A 360 ( 4.2A)
 0.45A 2ackA-5ydjA:
65.2		 2ackA-5ydjA:
12.11
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.
2BM9_D_SAMD301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 4zrs ESTERASE
(uncultured
bacterium) 		5 / 12 LEU A  16
LEU A  21
GLY A  76
ALA A 152
ALA A 155
 SEB  A 151 ( 4.8A)
None
SEB  A 151 ( 3.5A)
SEB  A 151 ( 3.4A)
SEB  A 151 ( 4.0A)
 1.17A 2bm9D-4zrsA:
undetectable		 2bm9D-4zrsA:
21.02
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.
2HA2_A_SCKA901_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 8 ASP A 233
TRP A 245
TYR A 282
TRP A 441
TYR A 489
TYR A 493
HIS A 600
 None
SEB  A 360 ( 4.2A)
None
None
None
None
SEB  A 360 ( 4.2A)
 0.75A 2ha2A-5ydjA:
26.1		 2ha2A-5ydjA:
12.28
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.
2HA2_B_SCKB951_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		6 / 8 ASP A 233
TRP A 245
TYR A 282
TRP A 441
TYR A 493
HIS A 600
 None
SEB  A 360 ( 4.2A)
None
None
None
SEB  A 360 ( 4.2A)
 0.62A 2ha2B-5ydjA:
63.6		 2ha2B-5ydjA:
12.28
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.
2HA2_B_SCKB951_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		6 / 8 ASP A 233
TRP A 245
TYR A 282
TYR A 489
TYR A 493
HIS A 600
 None
SEB  A 360 ( 4.2A)
None
None
None
SEB  A 360 ( 4.2A)
 0.84A 2ha2B-5ydjA:
63.6		 2ha2B-5ydjA:
12.28
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.
2HA4_A_ACHA546_0
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		8 / 8 TRP A 245
TYR A 282
TYR A 291
GLU A 359
TYR A 489
PHE A 490
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
None
None
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
None
 0.38A 2ha4A-5ydjA:
59.7		 2ha4A-5ydjA:
undetectable
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.
2HA4_A_ACTA544_0
(ACETYLCHOLINESTERASE)		 4kry ACETYL ESTERASE
(Escherichia
coli) 		4 / 8 GLY A  93
GLY A  94
ALA A 166
HIS A 292
 SEB  A 165 ( 3.6A)
SEB  A 165 ( 3.5A)
SEB  A 165 ( 3.4A)
SEB  A 165 ( 4.1A)
 0.21A 2ha4A-4kryA:
4.5		 2ha4A-4kryA:
22.24
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.
2HA4_A_ACTA544_0
(ACETYLCHOLINESTERASE)		 4zrs ESTERASE
(uncultured
bacterium) 		4 / 8 GLY A  75
GLY A  76
ALA A 152
HIS A 263
 SEB  A 151 ( 3.8A)
SEB  A 151 ( 3.5A)
SEB  A 151 ( 3.4A)
SEB  A 151 ( 4.1A)
 0.17A 2ha4A-4zrsA:
21.3		 2ha4A-4zrsA:
23.60
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.
2HA4_B_ACHB603_0
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 7 TRP A 245
TYR A 282
TYR A 291
GLU A 359
TYR A 489
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
None
None
SEB  A 360 ( 3.3A)
None
SEB  A 360 ( 4.2A)
None
 0.38A 2ha4B-5ydjA:
64.6		 2ha4B-5ydjA:
undetectable
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.
2HA4_B_ACTB601_0
(ACETYLCHOLINESTERASE)		 4kry ACETYL ESTERASE
(Escherichia
coli) 		4 / 7 GLY A  93
GLY A  94
ALA A 166
HIS A 292
 SEB  A 165 ( 3.6A)
SEB  A 165 ( 3.5A)
SEB  A 165 ( 3.4A)
SEB  A 165 ( 4.1A)
 0.17A 2ha4B-4kryA:
18.1		 2ha4B-4kryA:
22.24
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.
2HA4_B_ACTB601_0
(ACETYLCHOLINESTERASE)		 4zrs ESTERASE
(uncultured
bacterium) 		4 / 7 GLY A  75
GLY A  76
ALA A 152
HIS A 263
 SEB  A 151 ( 3.8A)
SEB  A 151 ( 3.5A)
SEB  A 151 ( 3.4A)
SEB  A 151 ( 4.1A)
 0.16A 2ha4B-4zrsA:
21.7		 2ha4B-4zrsA:
23.60
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.
2HA4_B_ACTB601_0
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		6 / 7 GLY A 279
GLY A 280
ALA A 361
TRP A 393
PHE A 449
HIS A 600
 SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.7A)
None
None
SEB  A 360 ( 4.2A)
 0.47A 2ha4B-5ydjA:
64.6		 2ha4B-5ydjA:
undetectable
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.
2HA6_A_SCKA901_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 9 ASP A 233
TRP A 245
TYR A 282
GLU A 359
TRP A 441
TYR A 489
TYR A 493
 None
SEB  A 360 ( 4.2A)
None
SEB  A 360 ( 3.3A)
None
None
None
 0.73A 2ha6A-5ydjA:
59.9		 2ha6A-5ydjA:
10.71
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.
2HA6_B_SCKB951_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		8 / 9 TRP A 245
TYR A 282
TRP A 441
TYR A 489
PHE A 490
TYR A 493
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
None
None
None
None
None
SEB  A 360 ( 4.2A)
None
 0.73A 2ha6B-5ydjA:
63.4		 2ha6B-5ydjA:
10.71
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.
2OAX_F_SNLF6001_1
(MINERALOCORTICOID
RECEPTOR)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 12 LEU A 384
ALA A 363
LEU A 371
LEU A 395
PHE A 560
 None
SEB  A 360 ( 3.3A)
None
None
None
 1.39A 2oaxF-5ydjA:
undetectable		 2oaxF-5ydjA:
17.95
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.
2PNC_A_CLUA808_1
(COPPER AMINE
OXIDASE, LIVER
ISOZYME)		 4kry ACETYL ESTERASE
(Escherichia
coli) 		4 / 7 ALA A 293
TYR A 195
MET A 301
HIS A 296
 None
SEB  A 165 ( 4.8A)
None
None
 1.37A 2pncA-4kryA:
undetectable		 2pncA-4kryA:
19.18
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.
2WQ5_A_MIYA1120_1
(PHOSPHOLIPASE A2,
ACIDIC)		 4e14 KYNURENINE
FORMAMIDASE
(Drosophila
melanogaster) 		4 / 7 LEU A 193
TRP A  90
ALA A 158
GLY A 189
 None
None
SEB  A 157 ( 3.3A)
SEB  A 157 ( 3.3A)
 0.91A 2wq5A-4e14A:
undetectable		 2wq5A-4e14A:
14.62
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.
2XUD_A_DMEA1544_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 6 TRP A 245
TYR A 282
TRP A 441
TYR A 493
HIS A 600
 SEB  A 360 ( 4.2A)
None
None
None
SEB  A 360 ( 4.2A)
 0.61A 2xudA-5ydjA:
55.2		 2xudA-5ydjA:
12.28
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.
3BXO_A_SAMA238_1
(N,N-DIMETHYLTRANSFER
ASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		3 / 3 TYR A 309
GLU A 359
ASP A 602
 None
SEB  A 360 ( 3.3A)
None
 0.83A 3bxoA-5ydjA:
undetectable		 3bxoA-5ydjA:
undetectable
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.
3G1U_B_ADNB438_1
(ADENOSYLHOMOCYSTEINA
SE)		 4kry ACETYL ESTERASE
(Escherichia
coli) 		5 / 12 LEU A 100
THR A 102
ASP A 122
LEU A 125
GLY A  93
 None
None
None
None
SEB  A 165 ( 3.6A)
 1.29A 3g1uB-4kryA:
undetectable		 3g1uB-4kryA:
21.30
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.
3G1U_C_ADNC438_1
(ADENOSYLHOMOCYSTEINA
SE)		 4kry ACETYL ESTERASE
(Escherichia
coli) 		5 / 12 LEU A 100
THR A 102
ASP A 122
LEU A 125
GLY A  93
 None
None
None
None
SEB  A 165 ( 3.6A)
 1.31A 3g1uC-4kryA:
5.2		 3g1uC-4kryA:
21.30
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.
3G1U_D_ADND438_1
(ADENOSYLHOMOCYSTEINA
SE)		 4kry ACETYL ESTERASE
(Escherichia
coli) 		5 / 12 LEU A 100
THR A 102
ASP A 122
LEU A 125
GLY A  93
 None
None
None
None
SEB  A 165 ( 3.6A)
 1.28A 3g1uD-4kryA:
5.4		 3g1uD-4kryA:
21.30
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.
3HS6_A_EPAA1_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 12 VAL A 564
TYR A 581
GLY A 362
ALA A 363
LEU A 370
 None
None
SEB  A 360 ( 4.1A)
SEB  A 360 ( 3.3A)
None
 0.93A 3hs6A-5ydjA:
undetectable		 3hs6A-5ydjA:
9.39
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.
3JZJ_A_ACRA405_1
(ACARBOSE/MALTOSE
BINDING PROTEIN GACH)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 12 GLU A 486
GLY A 279
ALA A 242
ASP A 602
ASN A 246
 None
SEB  A 360 ( 3.0A)
None
None
None
 1.39A 3jzjA-5ydjA:
undetectable		 3jzjA-5ydjA:
11.57
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.
3M6V_A_SAMA465_0
(RRNA METHYLASE)		 4kry ACETYL ESTERASE
(Escherichia
coli) 		5 / 12 ALA A 168
GLY A  94
GLY A  93
ASP A 267
ASP A 164
 SEB  A 165 ( 3.4A)
SEB  A 165 ( 3.5A)
SEB  A 165 ( 3.6A)
PGE  A 401 ( 4.4A)
SEB  A 165 ( 4.4A)
 1.10A 3m6vA-4kryA:
undetectable		 3m6vA-4kryA:
22.32
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.
3M6V_B_SAMB465_0
(RRNA METHYLASE)		 4kry ACETYL ESTERASE
(Escherichia
coli) 		5 / 12 ALA A 168
GLY A  94
GLY A  93
ASP A 267
ASP A 164
 SEB  A 165 ( 3.4A)
SEB  A 165 ( 3.5A)
SEB  A 165 ( 3.6A)
PGE  A 401 ( 4.4A)
SEB  A 165 ( 4.4A)
 1.10A 3m6vB-4kryA:
undetectable		 3m6vB-4kryA:
22.32
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.
3O9M_A_BEZA999_0
(CHOLINESTERASE)		 4kry ACETYL ESTERASE
(Escherichia
coli) 		4 / 7 GLY A  93
GLY A  94
LEU A 221
HIS A 292
 SEB  A 165 ( 3.6A)
SEB  A 165 ( 3.5A)
PGE  A 401 (-4.1A)
SEB  A 165 ( 4.1A)
 0.48A 3o9mA-4kryA:
2.9		 3o9mA-4kryA:
18.84
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.
3O9M_A_BEZA999_0
(CHOLINESTERASE)		 4zrs ESTERASE
(uncultured
bacterium) 		4 / 7 GLY A  75
GLY A  76
PHE A 234
HIS A 263
 SEB  A 151 ( 3.8A)
SEB  A 151 ( 3.5A)
SEB  A 151 ( 4.5A)
SEB  A 151 ( 4.1A)
 0.41A 3o9mA-4zrsA:
21.5		 3o9mA-4zrsA:
20.41
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.
3O9M_A_BEZA999_0
(CHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 7 GLY A 279
GLY A 280
TRP A 393
PHE A 560
HIS A 600
 SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.0A)
None
None
SEB  A 360 ( 4.2A)
 0.43A 3o9mA-5ydjA:
65.9		 3o9mA-5ydjA:
undetectable
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.
3O9M_B_BEZB999_0
(CHOLINESTERASE)		 4kry ACETYL ESTERASE
(Escherichia
coli) 		4 / 6 GLY A  93
GLY A  94
LEU A 221
HIS A 292
 SEB  A 165 ( 3.6A)
SEB  A 165 ( 3.5A)
PGE  A 401 (-4.1A)
SEB  A 165 ( 4.1A)
 0.49A 3o9mB-4kryA:
4.4		 3o9mB-4kryA:
18.84
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.
3O9M_B_BEZB999_0
(CHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		4 / 6 GLY A 279
GLY A 280
TRP A 393
HIS A 600
 SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 4.2A)
 0.49A 3o9mB-5ydjA:
65.9		 3o9mB-5ydjA:
undetectable
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.
3OU7_B_SAMB300_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 4kry ACETYL ESTERASE
(Escherichia
coli) 		5 / 12 LEU A 209
ALA A 259
GLY A 258
TRP A 194
HIS A 292
 None
None
None
None
SEB  A 165 ( 4.1A)
 1.15A 3ou7B-4kryA:
3.4		 3ou7B-4kryA:
22.83
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.
3TKA_A_SAMA400_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE H)		 4kry ACETYL ESTERASE
(Escherichia
coli) 		5 / 12 GLY A 196
GLY A 163
ARG A 269
ASP A 267
PHE A 284
 SEB  A 165 ( 3.5A)
None
None
PGE  A 401 ( 4.4A)
None
 1.31A 3tkaA-4kryA:
3.0		 3tkaA-4kryA:
21.96
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.
3V4T_A_ACTA502_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		4 / 5 TYR A 282
VAL A 311
SER A 283
GLY A 278
 None
None
SEB  A 360 ( 4.6A)
SEB  A 360 ( 3.5A)
 1.45A 3v4tA-5ydjA:
undetectable
3v4tD-5ydjA:
undetectable		 3v4tA-5ydjA:
undetectable
3v4tD-5ydjA:
undetectable
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_F_W9TF512_1
(HEMOLYTIC LECTIN
CEL-III)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		4 / 6 THR A 390
ASN A 563
GLY A 387
ILE A 478
 None
None
SEB  A 360 ( 4.0A)
None
 0.90A 3w9tF-5ydjA:
undetectable		 3w9tF-5ydjA:
11.49
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.
4BDS_A_THAA701_1
(CHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 9 TRP A 245
GLU A 359
TYR A 493
TRP A 592
MET A 599
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.3A)
None
None
None
SEB  A 360 ( 4.2A)
None
 0.70A 4bdsA-5ydjA:
63.4		 4bdsA-5ydjA:
9.66
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.
4E1G_A_LNLA701_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 12 PHE A 379
TYR A 581
GLY A 362
ALA A 363
LEU A 370
 None
None
SEB  A 360 ( 4.1A)
SEB  A 360 ( 3.3A)
None
 0.92A 4e1gA-5ydjA:
undetectable		 4e1gA-5ydjA:
8.61
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.
4EY6_A_GNTA604_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		6 / 12 GLY A 278
GLY A 279
GLY A 280
PHE A 490
PHE A 449
HIS A 600
 SEB  A 360 ( 3.5A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.0A)
None
None
SEB  A 360 ( 4.2A)
 1.18A 4ey6A-5ydjA:
63.8		 4ey6A-5ydjA:
10.33
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.
4EY6_A_GNTA604_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		6 / 12 GLY A 279
TYR A 282
SER A 283
TYR A 489
PHE A 490
HIS A 600
 SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 4.6A)
None
None
SEB  A 360 ( 4.2A)
 1.15A 4ey6A-5ydjA:
63.8		 4ey6A-5ydjA:
10.33
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.
4EY6_A_GNTA604_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		10 / 12 TRP A 245
GLY A 278
GLY A 279
GLY A 280
TYR A 282
SER A 283
PHE A 449
TYR A 489
PHE A 490
HIS A 600
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.5A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 4.6A)
None
None
None
SEB  A 360 ( 4.2A)
 0.47A 4ey6A-5ydjA:
63.8		 4ey6A-5ydjA:
10.33
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.
4EY6_A_GNTA604_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 12 TRP A 245
GLY A 278
TYR A 489
PHE A 490
HIS A 600
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.5A)
None
None
SEB  A 360 ( 4.2A)
 0.86A 4ey6A-5ydjA:
63.8		 4ey6A-5ydjA:
10.33
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.
4EY6_B_GNTB605_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 12 GLY A 278
GLY A 279
GLY A 280
GLU A 359
PHE A 490
PHE A 449
HIS A 600
 SEB  A 360 ( 3.5A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
 1.12A 4ey6B-5ydjA:
55.6		 4ey6B-5ydjA:
10.33
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.
4EY6_B_GNTB605_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		10 / 12 TRP A 245
GLY A 278
GLY A 279
GLY A 280
TYR A 282
GLU A 359
PHE A 449
TYR A 489
PHE A 490
HIS A 600
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.5A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 3.3A)
None
None
None
SEB  A 360 ( 4.2A)
 0.48A 4ey6B-5ydjA:
55.6		 4ey6B-5ydjA:
10.33
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.
4EY6_B_GNTB605_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 12 TRP A 245
GLY A 278
TYR A 489
PHE A 490
HIS A 600
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.5A)
None
None
SEB  A 360 ( 4.2A)
 0.87A 4ey6B-5ydjA:
55.6		 4ey6B-5ydjA:
10.33
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.
4EY7_A_E20A604_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 11 TRP A 245
GLY A 278
TYR A 489
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.5A)
None
SEB  A 360 ( 4.2A)
None
 0.72A 4ey7A-5ydjA:
63.6		 4ey7A-5ydjA:
10.33
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.
4EY7_A_E20A604_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 11 TRP A 245
GLY A 279
GLU A 359
TRP A 441
TYR A 489
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
None
 0.75A 4ey7A-5ydjA:
63.6		 4ey7A-5ydjA:
10.33
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.
4EY7_A_E20A604_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 11 TRP A 245
GLY A 279
GLU A 359
TYR A 489
TYR A 493
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
None
 0.95A 4ey7A-5ydjA:
63.6		 4ey7A-5ydjA:
10.33
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.
4EY7_A_E20A604_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 11 TRP A 245
GLY A 279
TYR A 282
GLU A 359
TRP A 441
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 3.3A)
None
SEB  A 360 ( 4.2A)
None
 0.53A 4ey7A-5ydjA:
63.6		 4ey7A-5ydjA:
10.33
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.
4EY7_A_E20A604_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 11 TRP A 245
GLY A 279
TYR A 282
GLU A 359
TYR A 493
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 3.3A)
None
SEB  A 360 ( 4.2A)
None
 0.58A 4ey7A-5ydjA:
63.6		 4ey7A-5ydjA:
10.33
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.
4EY7_B_E20B605_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 11 TRP A 245
GLY A 278
TYR A 489
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.5A)
None
SEB  A 360 ( 4.2A)
None
 0.72A 4ey7B-5ydjA:
60.0		 4ey7B-5ydjA:
10.33
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.
4EY7_B_E20B605_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 11 TRP A 245
GLY A 279
GLU A 359
TRP A 441
TYR A 489
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
None
 0.75A 4ey7B-5ydjA:
60.0		 4ey7B-5ydjA:
10.33
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.
4EY7_B_E20B605_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 11 TRP A 245
GLY A 279
GLU A 359
TYR A 489
TYR A 493
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
None
 0.95A 4ey7B-5ydjA:
60.0		 4ey7B-5ydjA:
10.33
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.
4EY7_B_E20B605_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 11 TRP A 245
GLY A 279
TYR A 282
GLU A 359
TRP A 441
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 3.3A)
None
SEB  A 360 ( 4.2A)
None
 0.52A 4ey7B-5ydjA:
60.0		 4ey7B-5ydjA:
10.33
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.
4EY7_B_E20B605_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 11 TRP A 245
GLY A 279
TYR A 282
GLU A 359
TYR A 493
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
None
SEB  A 360 ( 3.3A)
None
SEB  A 360 ( 4.2A)
None
 0.58A 4ey7B-5ydjA:
60.0		 4ey7B-5ydjA:
10.33
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.
4N48_B_SAMB601_1
(CAP-SPECIFIC MRNA
(NUCLEOSIDE-2'-O-)-M
ETHYLTRANSFERASE 1)		 2apj PUTATIVE ESTERASE
(Arabidopsis
thaliana) 		4 / 5 PRO A  79
GLY A  35
ASP A  70
ASP A  85
 None
SEB  A  31 ( 3.5A)
None
None
 1.02A 4n48B-2apjA:
undetectable		 4n48B-2apjA:
21.19
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.
4R7L_A_SHHA709_1
(LEUKOTRIENE A-4
HYDROLASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 12 TYR A 583
HIS A 600
GLU A 486
GLU A 359
LEU A 296
 None
SEB  A 360 ( 4.2A)
None
SEB  A 360 ( 3.3A)
None
 1.33A 4r7lA-5ydjA:
undetectable		 4r7lA-5ydjA:
8.35
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.
5E4J_A_DMEA608_1
(ACETYLCHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		7 / 9 TRP A 245
TYR A 282
GLU A 359
TRP A 441
TYR A 493
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
None
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
None
 0.47A 5e4jA-5ydjA:
66.4		 5e4jA-5ydjA:
12.22
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.
5FCT_B_C2FB402_0
(THYMIDYLATE SYNTHASE)		 4kry ACETYL ESTERASE
(Escherichia
coli) 		5 / 12 VAL A 118
PHE A  88
ILE A 121
LEU A 125
ALA A 166
 None
None
None
None
SEB  A 165 ( 3.4A)
 1.26A 5fctB-4kryA:
undetectable		 5fctB-4kryA:
21.20
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.
5GQB_A_GCSA603_1
(CHITINASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		4 / 8 PHE A 239
GLY A 241
TRP A 245
ASP A 602
 None
None
SEB  A 360 ( 4.2A)
None
 0.88A 5gqbA-5ydjA:
undetectable		 5gqbA-5ydjA:
10.13
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.
5L0Z_A_SAMA304_0
(PROBABLE RNA
METHYLTRANSFERASE,
TRMH FAMILY)		 4zrs ESTERASE
(uncultured
bacterium) 		6 / 12 LEU A 124
GLY A 149
GLY A 153
ILE A 174
LEU A 179
ALA A 177
 None
None
SEB  A 151 ( 4.0A)
None
None
None
 1.40A 5l0zA-4zrsA:
3.0		 5l0zA-4zrsA:
23.68
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.
5TE8_B_08JB602_1
(CYTOCHROME P450 3A4)		 4zrs ESTERASE
(uncultured
bacterium) 		4 / 8 ALA A 155
ILE A 161
ALA A 162
LEU A 215
 SEB  A 151 ( 4.0A)
None
None
None
 0.68A 5te8B-4zrsA:
undetectable		 5te8B-4zrsA:
20.32
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.
5X6Y_C_SAMC901_0
(MRNA CAPPING ENZYME
P5)		 1ggv DIENELACTONE
HYDROLASE
(Pseudomonas
putida) 		5 / 11 VAL A 147
GLY A 148
GLU A 150
SER A 178
ASP A 171
 SEB  A 123 ( 4.3A)
None
None
None
None
 1.15A 5x6yC-1ggvA:
2.1		 5x6yC-1ggvA:
14.05
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.
5X7P_B_ACRB1421_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)		 1ggv DIENELACTONE
HYDROLASE
(Pseudomonas
putida) 		4 / 6 GLU A  36
TYR A 145
GLY A 168
GLY A 169
 SEB  A 123 ( 4.2A)
SEB  A 123 ( 4.5A)
None
None
 0.75A 5x7pB-1ggvA:
undetectable		 5x7pB-1ggvA:
12.82
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.
5XU8_A_DX4A701_0
(UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 2)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		4 / 8 GLY A 362
SER A 306
ALA A 286
PHE A 277
 SEB  A 360 ( 4.1A)
None
None
None
 0.66A 5xu8A-5ydjA:
undetectable		 5xu8A-5ydjA:
undetectable
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.
6APH_A_ADNA501_1
(ADENOSYLHOMOCYSTEINA
SE)		 4kry ACETYL ESTERASE
(Escherichia
coli) 		5 / 12 LEU A 100
THR A 102
ASP A 122
LEU A 125
GLY A  93
 None
None
None
None
SEB  A 165 ( 3.6A)
 1.29A 6aphA-4kryA:
5.9		 6aphA-4kryA:
21.76
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.
6EP4_A_DMEA601_1
(CHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 5 TRP A 245
TYR A 291
GLU A 359
TYR A 493
HIS A 600
 SEB  A 360 ( 4.2A)
None
SEB  A 360 ( 3.3A)
None
SEB  A 360 ( 4.2A)
 0.61A 6ep4A-5ydjA:
66.2		 6ep4A-5ydjA:
24.10
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.
6EQP_A_BUWA601_1
(CHOLINESTERASE)		 5ydj ACETYLCHOLINESTERASE
(Anopheles
gambiae) 		5 / 8 TRP A 245
GLY A 280
TRP A 393
PHE A 490
TYR A 493
 SEB  A 360 ( 4.2A)
SEB  A 360 ( 3.0A)
None
None
None
 0.62A 6eqpA-5ydjA:
undetectable		 6eqpA-5ydjA:
24.10
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.
6FGD_A_ACTA806_0
(GEPHYRIN)		 4zrs ESTERASE
(uncultured
bacterium) 		4 / 4 MET A  79
GLY A  80
HIS A  73
GLY A  75
 None
None
None
SEB  A 151 ( 3.8A)
 1.45A 6fgdA-4zrsA:
3.7		 6fgdA-4zrsA:
22.00