SIMILAR PATTERNS OF AMINO ACIDS FOR 5CSY_B_ACRB601_1

List of similar pattern of amino acids derived from ASSAM search

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 link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. 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.
1amy 1,4-ALPHA-D-GLUCAN
GLUCANOHYDROLASE

(Hordeum vulgare) 		PF00128
(Alpha-amylase)
PF07821
(Alpha-amyl_C2) 		5 ARG A 177
ASP A 179
GLU A 204
HIS A 288
ASP A 289
 None
 0.31A 5csyB-1amyA:
4.8		 5csyB-1amyA:
21.13
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.
1bf2 ISOAMYLASE

(Pseudomonas
amyloderamosa) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 ARG A 373
ASP A 375
GLU A 435
HIS A 509
ASP A 510
 None
 0.48A 5csyB-1bf2A:
12.7		 5csyB-1bf2A:
20.59
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.
1bpl ALPHA-1,4-GLUCAN-4-G
LUCANOHYDROLASE

(Bacillus
licheniformis) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		5 ARG B 229
ASP B 231
GLU B 261
HIS B 327
ASP B 328
 None
 0.56A 5csyB-1bplB:
6.0		 5csyB-1bplB:
20.00
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.
1e43 ALPHA-AMYLASE

(Bacillus
amyloliquefaciens) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		5 ARG A 229
ASP A 231
GLU A 261
HIS A 327
ASP A 328
 None
 0.48A 5csyB-1e43A:
6.0		 5csyB-1e43A:
22.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1fp9 4-ALPHA-GLUCANOTRANS
FERASE

(Thermus
thermophilus) 		PF02446
(Glyco_hydro_77) 		6 ARG A 291
ASP A 293
GLY A 343
PHE A 366
HIS A 394
ASP A 395
 None
 1.06A 5csyB-1fp9A:
48.4		 5csyB-1fp9A:
38.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1fp9 4-ALPHA-GLUCANOTRANS
FERASE

(Thermus
thermophilus) 		PF02446
(Glyco_hydro_77) 		5 GLN A 256
TRP A 258
ASP A 293
GLY A 343
PHE A 366
 None
 0.95A 5csyB-1fp9A:
48.4		 5csyB-1fp9A:
38.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1fp9 4-ALPHA-GLUCANOTRANS
FERASE

(Thermus
thermophilus) 		PF02446
(Glyco_hydro_77) 		6 TRP A 258
ASP A 293
GLU A 340
GLY A 343
PHE A 366
HIS A 394
 None
 1.13A 5csyB-1fp9A:
48.4		 5csyB-1fp9A:
38.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1fp9 4-ALPHA-GLUCANOTRANS
FERASE

(Thermus
thermophilus) 		PF02446
(Glyco_hydro_77) 		6 TRP A 258
ASP A 293
GLY A 343
PHE A 366
HIS A 394
ASP A 395
 None
 1.10A 5csyB-1fp9A:
48.4		 5csyB-1fp9A:
38.04
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.
1h3g CYCLOMALTODEXTRINASE

(Flavobacterium
sp. 92) 		PF00128
(Alpha-amylase)
PF09087
(Cyc-maltodext_N)
PF10438
(Cyc-maltodext_C) 		5 ARG A 309
ASP A 311
GLU A 340
HIS A 417
ASP A 418
 None
 0.52A 5csyB-1h3gA:
18.4		 5csyB-1h3gA:
21.58
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.
1iv8 MALTOOLIGOSYL
TREHALOSE SYNTHASE

(Sulfolobus
acidocaldarius) 		PF00128
(Alpha-amylase)
PF09196
(DUF1953) 		5 ARG A 226
ASP A 228
GLU A 255
HIS A 442
ASP A 443
 None
 0.48A 5csyB-1iv8A:
7.3		 5csyB-1iv8A:
22.55
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.
1iv8 MALTOOLIGOSYL
TREHALOSE SYNTHASE

(Sulfolobus
acidocaldarius) 		PF00128
(Alpha-amylase)
PF09196
(DUF1953) 		5 ASP A 394
ASP A 228
GLU A 255
HIS A 442
ASP A 443
 MLY  A 390 ( 3.8A)
None
None
None
None
 0.84A 5csyB-1iv8A:
7.3		 5csyB-1iv8A:
22.55
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.
1j0h NEOPULLULANASE

(Geobacillus
stearothermophilus) 		PF00128
(Alpha-amylase)
PF02903
(Alpha-amylase_N)
PF16657
(Malt_amylase_C) 		5 ARG A 326
ASP A 328
GLU A 357
HIS A 423
ASP A 424
 None
 0.48A 5csyB-1j0hA:
19.8		 5csyB-1j0hA:
24.70
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.
1jae ALPHA-AMYLASE

(Tenebrio
molitor) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C) 		5 ARG A 183
ASP A 185
GLU A 222
HIS A 286
ASP A 287
 CL  A 501 (-4.0A)
None
None
None
None
 0.42A 5csyB-1jaeA:
5.0		 5csyB-1jaeA:
21.81
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.
1jxk ALPHA-AMYLASE,
SALIVARY

(Homo sapiens) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C) 		5 ARG A 195
ASP A 197
GLU A 233
HIS A 299
ASP A 300
 CL  A 493 (-4.0A)
None
None
None
None
 0.38A 5csyB-1jxkA:
5.1		 5csyB-1jxkA:
22.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kcl CYCLODEXTRIN
GLYCOSYLTRANSFERASE

(Bacillus
circulans) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C) 		5 ARG A 227
ASP A 229
GLU A 257
HIS A 327
ASP A 328
 GLC  A1695 ( 4.1A)
GLC  A1695 (-3.2A)
GLC  A1695 ( 2.6A)
GLC  A1695 (-4.1A)
GLC  A1695 ( 3.0A)
 0.78A 5csyB-1kclA:
19.5		 5csyB-1kclA:
21.70
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.
1lwh 4-ALPHA-GLUCANOTRANS
FERASE

(Thermotoga
maritima) 		PF00128
(Alpha-amylase)
PF09178
(DUF1945) 		5 ARG A 184
ASP A 186
GLU A 216
HIS A 277
ASP A 278
 None
 0.60A 5csyB-1lwhA:
20.4		 5csyB-1lwhA:
20.92
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.
1m53 ISOMALTULOSE
SYNTHASE

(Klebsiella sp.
LX3) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		5 ARG A 239
ASP A 241
GLU A 295
HIS A 368
ASP A 369
 None
 0.46A 5csyB-1m53A:
17.2		 5csyB-1m53A:
20.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mwo ALPHA AMYLASE

(Pyrococcus
woesei) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		5 ARG A 196
ASP A 198
GLU A 222
HIS A 288
ASP A 289
 ZN  A 441 ( 4.8A)
ZN  A 441 ( 4.2A)
ZN  A 441 (-2.0A)
None
ZN  A 441 (-4.0A)
 0.51A 5csyB-1mwoA:
5.4		 5csyB-1mwoA:
21.51
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.
1ose PORCINE
ALPHA-AMYLASE

(Sus scrofa) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C) 		5 ARG A 195
ASP A 197
GLU A 233
HIS A 299
ASP A 300
 AC1  A 992 ( 3.7A)
AC1  A 992 ( 3.3A)
AC1  A 992 ( 2.7A)
AC1  A 992 ( 3.9A)
AC1  A 992 (-3.0A)
 0.36A 5csyB-1oseA:
5.1		 5csyB-1oseA:
22.15
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.
1qho ALPHA-AMYLASE

(Geobacillus
stearothermophilus) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C) 		5 ARG A 226
ASP A 228
GLU A 256
HIS A 328
ASP A 329
 ABD  A1200 (-3.3A)
ABD  A1200 (-3.1A)
ABD  A1200 (-2.9A)
ABD  A1200 (-3.8A)
ABD  A1200 (-2.9A)
 0.43A 5csyB-1qhoA:
19.9		 5csyB-1qhoA:
21.86
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.
1qho ALPHA-AMYLASE

(Geobacillus
stearothermophilus) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C) 		5 ARG A 226
GLU A 256
GLY A 259
HIS A 328
ASP A 329
 ABD  A1200 (-3.3A)
ABD  A1200 (-2.9A)
ABD  A1200 (-3.3A)
ABD  A1200 (-3.8A)
ABD  A1200 (-2.9A)
 0.80A 5csyB-1qhoA:
19.9		 5csyB-1qhoA:
21.86
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.
1sma MALTOGENIC AMYLASE

(Thermus sp.
IM6501) 		PF00128
(Alpha-amylase)
PF02903
(Alpha-amylase_N)
PF16657
(Malt_amylase_C) 		5 ARG A 326
ASP A 328
GLU A 357
HIS A 423
ASP A 424
 None
 0.61A 5csyB-1smaA:
19.5		 5csyB-1smaA:
22.54
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.
1su7 CARBON MONOXIDE
DEHYDROGENASE 2

(Carboxydothermus
hydrogenoformans) 		PF03063
(Prismane) 		5 ASP A 454
GLN A 453
GLY A 477
HIS A 522
HIS A 259
 None
 1.17A 5csyB-1su7A:
undetectable		 5csyB-1su7A:
21.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1tz7 4-ALPHA-GLUCANOTRANS
FERASE

(Aquifex
aeolicus) 		PF02446
(Glyco_hydro_77) 		9 GLN A 249
ARG A 284
ASP A 286
GLU A 333
GLY A 336
PHE A 359
HIS A 368
HIS A 384
ASP A 385
 None
 0.86A 5csyB-1tz7A:
49.4		 5csyB-1tz7A:
38.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1tz7 4-ALPHA-GLUCANOTRANS
FERASE

(Aquifex
aeolicus) 		PF02446
(Glyco_hydro_77) 		9 GLN A 249
TRP A 251
ASP A 286
GLU A 333
GLY A 336
PHE A 359
HIS A 368
HIS A 384
ASP A 385
 None
 0.81A 5csyB-1tz7A:
49.4		 5csyB-1tz7A:
38.95
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.
1ua7 ALPHA-AMYLASE

(Bacillus
subtilis) 		PF00128
(Alpha-amylase) 		5 ARG A 174
ASP A 176
GLU A 208
HIS A 268
ASP A 269
 ACI  A 504 (-3.5A)
ACI  A 504 (-3.0A)
ACI  A 504 ( 2.9A)
ACI  A 504 (-3.8A)
ACI  A 504 ( 2.8A)
 0.48A 5csyB-1ua7A:
5.4		 5csyB-1ua7A:
22.76
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.
1ud3 AMYLASE

(Bacillus sp.
KSM-K38) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		5 ARG A 229
ASP A 231
GLU A 261
HIS A 327
ASP A 328
 None
 0.41A 5csyB-1ud3A:
5.2		 5csyB-1ud3A:
21.03
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.
1uok OLIGO-1,6-GLUCOSIDAS
E

(Bacillus cereus) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		6 ARG A 197
ASP A 199
GLU A 255
HIS A 283
HIS A 328
ASP A 329
 None
 0.92A 5csyB-1uokA:
18.2		 5csyB-1uokA:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w9x ALPHA AMYLASE

(Bacillus
halmapalus) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		5 ARG A 234
ASP A 236
GLU A 266
HIS A 332
ASP A 333
 AC1  A1492 (-3.3A)
AC1  A1492 (-3.0A)
AC1  A1492 (-2.8A)
AC1  A1492 (-3.9A)
AC1  A1492 ( 3.0A)
 0.50A 5csyB-1w9xA:
5.0		 5csyB-1w9xA:
21.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1x1n 4-ALPHA-GLUCANOTRANS
FERASE

(Solanum
tuberosum) 		PF02446
(Glyco_hydro_77) 		7 ARG A 319
ASP A 321
GLY A 371
PHE A 394
HIS A 404
HIS A 420
ASP A 421
 None
GOL  A1001 (-4.9A)
GOL  A1003 (-3.7A)
GOL  A1003 (-3.7A)
GOL  A1003 (-4.1A)
GOL  A1001 (-4.0A)
GOL  A1001 (-2.6A)
 1.19A 5csyB-1x1nA:
53.1		 5csyB-1x1nA:
68.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1x1n 4-ALPHA-GLUCANOTRANS
FERASE

(Solanum
tuberosum) 		PF02446
(Glyco_hydro_77) 		5 TRP A 286
GLU A 368
GLY A 371
PHE A 394
HIS A 404
 GOL  A1002 (-3.4A)
None
GOL  A1003 (-3.7A)
GOL  A1003 (-3.7A)
GOL  A1003 (-4.1A)
 0.73A 5csyB-1x1nA:
53.1		 5csyB-1x1nA:
68.13
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.
2aaa ALPHA-AMYLASE

(Aspergillus
niger) 		PF00128
(Alpha-amylase)
PF09260
(DUF1966) 		5 ARG A 204
ASP A 206
GLU A 230
HIS A 296
ASP A 297
 CA  A 486 ( 4.5A)
CA  A 486 (-3.0A)
CA  A 486 (-2.5A)
None
CA  A 486 ( 4.6A)
 0.46A 5csyB-2aaaA:
19.1		 5csyB-2aaaA:
24.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bxy MALTOOLIGOSYLTREHALO
SE TREHALOHYDROLASE

(Deinococcus
radiodurans) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48)
PF11941
(DUF3459) 		5 ARG A 273
ASP A 275
GLU A 308
HIS A 399
ASP A 400
 None
 0.41A 5csyB-2bxyA:
7.8		 5csyB-2bxyA:
23.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d3l GLUCAN
1,4-ALPHA-MALTOHEXAO
SIDASE

(Bacillus sp.
707) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		5 ARG A 234
ASP A 236
GLU A 266
HIS A 332
ASP A 333
 None
None
None
None
GLC  A 605 (-3.5A)
 0.58A 5csyB-2d3lA:
5.3		 5csyB-2d3lA:
21.09
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.
2e8y AMYX PROTEIN

(Bacillus
subtilis) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 ARG A 404
ASP A 406
GLU A 435
HIS A 524
ASP A 525
 None
 0.54A 5csyB-2e8yA:
19.4		 5csyB-2e8yA:
21.88
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.
2pwh SUCROSE ISOMERASE

([Pseudomonas]
mesoacidophila) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		6 ARG A 198
ASP A 200
GLU A 254
GLY A 257
HIS A 326
ASP A 327
 None
 0.68A 5csyB-2pwhA:
4.0		 5csyB-2pwhA:
21.04
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.
2qps ALPHA-AMYLASE TYPE A
ISOZYME

(Hordeum vulgare) 		PF00128
(Alpha-amylase)
PF07821
(Alpha-amyl_C2) 		5 ARG A 178
ASP A 180
GLU A 205
HIS A 290
ASP A 291
 None
 0.52A 5csyB-2qpsA:
5.1		 5csyB-2qpsA:
22.40
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.
2vr5 GLYCOGEN OPERON
PROTEIN GLGX

(Sulfolobus
solfataricus) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C)
PF02922
(CBM_48) 		5 ARG A 361
ASP A 363
GLU A 399
HIS A 470
ASP A 471
 A16  A1722 ( 3.6A)
A16  A1722 (-1.8A)
A16  A1722 (-4.0A)
A16  A1722 (-4.0A)
A16  A1722 (-3.4A)
 0.50A 5csyB-2vr5A:
6.7		 5csyB-2vr5A:
20.57
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.
2wan PULLULANASE

(Bacillus
acidopullulyticus) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 ARG A 620
ASP A 622
GLU A 651
HIS A 735
ASP A 736
 None
 0.34A 5csyB-2wanA:
19.0		 5csyB-2wanA:
20.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2x1i 4-ALPHA-GLUCANOTRANS
FERASE

(Thermus
brockianus) 		PF02446
(Glyco_hydro_77) 		6 ARG A 291
ASP A 293
GLY A 343
PHE A 366
HIS A 394
ASP A 395
 None
 0.89A 5csyB-2x1iA:
48.8		 5csyB-2x1iA:
37.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2x1i 4-ALPHA-GLUCANOTRANS
FERASE

(Thermus
brockianus) 		PF02446
(Glyco_hydro_77) 		6 ASP A 293
GLU A 340
GLY A 343
PHE A 366
HIS A 394
ASP A 395
 None
 0.93A 5csyB-2x1iA:
48.8		 5csyB-2x1iA:
37.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2x1i 4-ALPHA-GLUCANOTRANS
FERASE

(Thermus
brockianus) 		PF02446
(Glyco_hydro_77) 		6 GLN A 256
TRP A 258
ASP A 293
GLU A 340
GLY A 343
PHE A 366
 None
 1.18A 5csyB-2x1iA:
48.8		 5csyB-2x1iA:
37.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2x1i 4-ALPHA-GLUCANOTRANS
FERASE

(Thermus
brockianus) 		PF02446
(Glyco_hydro_77) 		6 TRP A 258
ASP A 293
GLU A 340
GLY A 343
PHE A 366
ASP A 395
 None
 1.11A 5csyB-2x1iA:
48.8		 5csyB-2x1iA:
37.48
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.
2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE

(Streptococcus
pneumoniae) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48)
PF03714
(PUD) 		5 ARG A 776
ASP A 778
GLU A 807
HIS A 894
ASP A 895
 None
BGC  A2144 (-2.8A)
GLC  A2150 ( 4.5A)
None
GLC  A2150 ( 4.3A)
 0.34A 5csyB-2ya1A:
16.3		 5csyB-2ya1A:
20.35
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.
2ya2 PUTATIVE ALKALINE
AMYLOPULLULANASE

(Streptococcus
pneumoniae) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 ARG A 321
ASP A 323
GLU A 352
HIS A 439
ASP A 440
 NOJ  A1689 (-3.5A)
NOJ  A1689 (-2.8A)
NOJ  A1689 (-3.0A)
NOJ  A1689 (-3.8A)
NOJ  A1689 (-2.9A)
 0.29A 5csyB-2ya2A:
14.8		 5csyB-2ya2A:
20.95
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.
2yoc PULLULANASE

(Klebsiella
oxytoca) 		PF02922
(CBM_48)
PF03714
(PUD)
PF11852
(DUF3372) 		5 ARG A 663
ASP A 665
GLU A 694
HIS A 821
ASP A 822
 None
 0.83A 5csyB-2yocA:
2.9		 5csyB-2yocA:
20.02
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.
2z1k (NEO)PULLULANASE

(Thermus
thermophilus) 		PF00128
(Alpha-amylase) 		5 ARG A 200
ASP A 202
GLU A 232
HIS A 314
ASP A 315
 GLC  A 603 (-3.4A)
GLC  A 603 (-2.6A)
GLC  A 501 ( 2.9A)
GLC  A 603 (-4.0A)
GLC  A 603 ( 2.9A)
 0.51A 5csyB-2z1kA:
4.7		 5csyB-2z1kA:
22.74
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.
3aib GLUCOSYLTRANSFERASE-
SI

(Streptococcus
mutans) 		PF02324
(Glyco_hydro_70) 		5 ARG A 475
ASP A 477
GLU A 515
HIS A 587
ASP A 588
 None
 0.77A 5csyB-3aibA:
2.0		 5csyB-3aibA:
21.04
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.
3axi OLIGO-1,6-GLUCOSIDAS
E IMA1

(Saccharomyces
cerevisiae) 		PF00128
(Alpha-amylase) 		5 ARG A 213
ASP A 215
HIS A 305
HIS A 351
ASP A 352
 GLC  A 601 (-3.0A)
GLC  A 601 (-2.9A)
None
GLC  A 601 (-3.9A)
GLC  A 601 (-2.8A)
 0.82A 5csyB-3axiA:
7.7		 5csyB-3axiA:
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.
3bc9 ALPHA AMYLASE,
CATALYTIC REGION

(Halothermothrix
orenii) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		5 ARG A 348
ASP A 350
GLU A 380
HIS A 446
ASP A 447
 ACI  A 806 (-3.3A)
ACI  A 806 (-3.1A)
GLD  A 807 ( 2.8A)
ACI  A 806 (-4.1A)
ACI  A 806 (-2.9A)
 0.35A 5csyB-3bc9A:
5.8		 5csyB-3bc9A:
21.48
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.
3bmw CYCLOMALTODEXTRIN
GLUCANOTRANSFERASE

(Thermoanaerobacterium
thermosulfurigenes) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG) 		5 ARG A 228
ASP A 230
GLU A 258
HIS A 328
ASP A 329
 ACI  A 694 (-3.4A)
ACI  A 694 (-3.2A)
G6D  A 693 ( 2.8A)
ACI  A 694 (-3.9A)
ACI  A 694 ( 2.8A)
 0.47A 5csyB-3bmwA:
20.0		 5csyB-3bmwA:
20.92
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.
3dhu ALPHA-AMYLASE

(Lactobacillus
plantarum) 		PF00128
(Alpha-amylase) 		6 TRP A 137
ARG A 169
ASP A 171
GLU A 200
HIS A 276
ASP A 277
 None
 0.53A 5csyB-3dhuA:
23.1		 5csyB-3dhuA:
22.54
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.
3faw RETICULOCYTE BINDING
PROTEIN

(Streptococcus
agalactiae) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 ARG A 800
ASP A 802
GLU A 831
HIS A 918
ASP A 919
 None
 0.93A 5csyB-3fawA:
16.0		 5csyB-3fawA:
20.42
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.
3gbd SUCROSE ISOMERASE
SMUA FROM
PROTAMINOBACTER
RUBRUM

(Serratia
plymuthica) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		5 ARG A 212
ASP A 214
GLU A 268
HIS A 341
ASP A 342
 None
EDO  A8003 ( 2.7A)
EDO  A8001 (-3.1A)
None
EDO  A8002 ( 3.5A)
 0.47A 5csyB-3gbdA:
17.5		 5csyB-3gbdA:
19.87
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.
3hje 704AA LONG
HYPOTHETICAL
GLYCOSYLTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF00128
(Alpha-amylase)
PF09196
(DUF1953) 		6 ASP A 392
ARG A 220
ASP A 222
GLU A 249
HIS A 440
ASP A 441
 None
None
GOL  A 802 (-2.8A)
GOL  A 804 (-3.8A)
None
GOL  A 802 ( 3.7A)
 0.88A 5csyB-3hjeA:
13.2		 5csyB-3hjeA:
22.35
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.
3k8k ALPHA-AMYLASE, SUSG

(Bacteroides
thetaiotaomicron) 		PF00128
(Alpha-amylase) 		5 ARG A 386
ASP A 388
GLU A 431
HIS A 497
ASP A 498
 None
ACT  A 961 (-2.8A)
ACT  A 961 ( 4.3A)
None
EDO  A 901 (-4.4A)
 0.51A 5csyB-3k8kA:
4.8		 5csyB-3k8kA:
22.54
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.
3m07 PUTATIVE ALPHA
AMYLASE

(Salmonella
enterica) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		5 TRP A 227
ARG A 259
ASP A 261
GLU A 296
ASP A 393
 BTB  A 605 (-3.1A)
None
BTB  A 605 (-2.9A)
MG  A 597 (-3.9A)
BTB  A 605 (-4.1A)
 1.06A 5csyB-3m07A:
19.8		 5csyB-3m07A:
23.62
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.
3m07 PUTATIVE ALPHA
AMYLASE

(Salmonella
enterica) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		5 TRP A 227
ARG A 259
ASP A 261
GLU A 296
HIS A 392
 BTB  A 605 (-3.1A)
None
BTB  A 605 (-2.9A)
MG  A 597 (-3.9A)
BTB  A 605 (-4.1A)
 0.62A 5csyB-3m07A:
19.8		 5csyB-3m07A:
23.62
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.
3qgv ALPHA AMYLASE

(Pyrococcus
woesei) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		5 ARG A 196
ASP A 198
GLU A 222
HIS A 288
ASP A 289
 TRS  A 505 (-3.0A)
TRS  A 505 (-2.7A)
TRS  A 505 (-2.7A)
TRS  A 505 (-4.2A)
TRS  A 505 (-3.0A)
 0.49A 5csyB-3qgvA:
5.4		 5csyB-3qgvA:
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.
3ucq AMYLOSUCRASE

(Deinococcus
geothermalis) 		PF00128
(Alpha-amylase) 		5 ARG A 282
ASP A 284
GLU A 326
HIS A 395
ASP A 396
 GOL  A 721 (-3.4A)
GOL  A 720 (-3.0A)
TRS  A 700 (-4.2A)
GOL  A 721 (-4.6A)
TRS  A 700 (-3.1A)
 0.29A 5csyB-3ucqA:
18.4		 5csyB-3ucqA:
22.39
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.
3vgf MALTO-OLIGOSYLTREHAL
OSE TREHALOHYDROLASE

(Sulfolobus
solfataricus) 		PF00128
(Alpha-amylase)
PF09071
(Alpha-amyl_C) 		5 TRP A 215
ARG A 250
GLU A 283
HIS A 376
ASP A 377
 GLC  A 604 (-3.3A)
GLC  A 604 (-3.1A)
GLC  A 604 (-2.6A)
GLC  A 604 (-4.0A)
GLC  A 604 (-2.7A)
 0.59A 5csyB-3vgfA:
18.0		 5csyB-3vgfA:
21.91
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.
3vm5 ALPHA-AMYLASE

(Oryzias latipes) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C) 		5 ARG A 195
ASP A 197
GLU A 233
HIS A 299
ASP A 300
 CL  A 507 (-3.9A)
None
None
None
None
 0.45A 5csyB-3vm5A:
5.3		 5csyB-3vm5A:
21.84
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.
3vm7 ALPHA-AMYLASE

(Malbranchea
cinnamomea) 		PF00128
(Alpha-amylase)
PF09260
(DUF1966) 		5 ARG A 223
ASP A 225
GLU A 249
HIS A 315
ASP A 316
 None
GLC  A 503 (-3.5A)
GLC  A 503 (-2.6A)
None
GLC  A 503 (-3.0A)
 0.45A 5csyB-3vm7A:
19.6		 5csyB-3vm7A:
22.12
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.
3vtr N-ACETYLGLUCOSAMINID
ASE

(Ostrinia
furnacalis) 		PF00728
(Glyco_hydro_20)
PF14845
(Glycohydro_20b2) 		5 LEU A 334
ARG A 220
GLY A 332
HIS A 246
ASP A 299
 None
TCG  A 601 (-2.7A)
None
None
None
 1.03A 5csyB-3vtrA:
11.0		 5csyB-3vtrA:
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.
3wdj TYPE I PULLULANASE

(Anoxybacillus
sp. LM18-11) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 ARG A 411
ASP A 413
GLU A 442
HIS A 525
ASP A 526
 MTT  A 802 (-3.4A)
MTT  A 802 (-2.8A)
MTT  A 802 (-3.0A)
MTT  A 802 (-3.9A)
MTT  A 802 (-2.9A)
 0.31A 5csyB-3wdjA:
17.6		 5csyB-3wdjA:
21.23
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.
3wn6 ALPHA-AMYLASE

(Oryza sativa) 		PF00128
(Alpha-amylase)
PF07821
(Alpha-amyl_C2) 		5 ARG A 201
ASP A 203
GLU A 228
HIS A 313
ASP A 314
 None
GOL  A 505 (-3.4A)
None
GOL  A 505 (-4.3A)
GOL  A 505 (-2.9A)
 0.41A 5csyB-3wn6A:
4.3		 5csyB-3wn6A:
23.22
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.
3wy2 ALPHA-GLUCOSIDASE

(Halomonas sp.
H11) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		5 ARG A 200
ASP A 202
GLU A 271
GLY A 228
HIS A 332
 BGC  A 605 (-3.0A)
BGC  A 605 (-2.4A)
BGC  A 605 (-3.3A)
None
BGC  A 605 (-3.9A)
 1.08A 5csyB-3wy2A:
17.5		 5csyB-3wy2A:
22.13
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.
3wy2 ALPHA-GLUCOSIDASE

(Halomonas sp.
H11) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		5 ARG A 200
ASP A 202
GLU A 271
HIS A 332
ASP A 333
 BGC  A 605 (-3.0A)
BGC  A 605 (-2.4A)
BGC  A 605 (-3.3A)
BGC  A 605 (-3.9A)
BGC  A 605 (-2.9A)
 0.46A 5csyB-3wy2A:
17.5		 5csyB-3wy2A:
22.13
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.
3wy2 ALPHA-GLUCOSIDASE

(Halomonas sp.
H11) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		5 ARG A 200
ASP A 202
GLY A 273
HIS A 332
ASP A 333
 BGC  A 605 (-3.0A)
BGC  A 605 (-2.4A)
None
BGC  A 605 (-3.9A)
BGC  A 605 (-2.9A)
 0.69A 5csyB-3wy2A:
17.5		 5csyB-3wy2A:
22.13
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.
4aee ALPHA AMYLASE,
CATALYTIC REGION

(Staphylothermus
marinus) 		PF00128
(Alpha-amylase) 		5 ARG A 440
ASP A 442
GLU A 471
HIS A 535
ASP A 536
 None
 0.42A 5csyB-4aeeA:
2.1		 5csyB-4aeeA:
21.53
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.
4aef NEOPULLULANASE
(ALPHA-AMYLASE II)

(Pyrococcus
furiosus) 		PF00128
(Alpha-amylase)
PF02903
(Alpha-amylase_N)
PF16561
(AMPK1_CBM) 		5 ARG A 409
ASP A 411
GLU A 437
HIS A 501
ASP A 502
 None
 0.48A 5csyB-4aefA:
3.9		 5csyB-4aefA:
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.
4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E

(Lactobacillus
acidophilus) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		5 ARG A 196
ASP A 198
GLU A 240
HIS A 315
ASP A 316
 GOL  A1542 ( 4.4A)
GOL  A1542 (-2.7A)
GOL  A1542 ( 3.6A)
None
GOL  A1548 (-3.5A)
 0.35A 5csyB-4aieA:
4.1		 5csyB-4aieA:
22.27
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.
4aio LIMIT DEXTRINASE

(Hordeum vulgare) 		PF02922
(CBM_48)
PF11852
(DUF3372) 		5 ARG A 471
ASP A 473
GLU A 510
HIS A 641
ASP A 642
 None
GOL  A1888 (-3.0A)
GOL  A1888 ( 4.9A)
None
None
 0.70A 5csyB-4aioA:
5.1		 5csyB-4aioA:
21.14
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.
4ays AMYLOSUCRASE

(Deinococcus
radiodurans) 		PF00128
(Alpha-amylase) 		5 ARG A 274
ASP A 276
GLU A 318
HIS A 387
ASP A 388
 None
 0.85A 5csyB-4aysA:
13.8		 5csyB-4aysA:
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.
4e2o ALPHA-AMYLASE

(Geobacillus
thermoleovorans) 		PF00128
(Alpha-amylase) 		5 ARG A 215
ASP A 217
GLU A 246
HIS A 313
ASP A 314
 ACI  A 505 (-3.3A)
ACI  A 505 (-3.1A)
G6D  A 506 (-2.7A)
ACI  A 505 (-3.7A)
ACI  A 505 (-2.8A)
 0.41A 5csyB-4e2oA:
6.0		 5csyB-4e2oA:
22.15
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.
4m8u OLIGO-1,6-GLUCOSIDAS
E 1

(Bacillus
subtilis) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		6 ARG A 197
ASP A 199
GLU A 255
HIS A 283
HIS A 331
ASP A 332
 TRS  A 601 ( 4.8A)
TRS  A 601 (-2.7A)
TRS  A 601 ( 2.7A)
GOL  A 606 (-3.8A)
None
GOL  A 602 (-2.8A)
 0.88A 5csyB-4m8uA:
17.3		 5csyB-4m8uA:
20.69
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.
4okd ISOAMYLASE

(Chlamydomonas
reinhardtii) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 ARG A 450
ASP A 452
GLU A 527
HIS A 619
ASP A 620
 GLC  A1001 (-3.3A)
GLC  A1001 (-2.0A)
GLC  A1001 (-3.2A)
GLC  A1001 (-4.0A)
GLC  A1001 (-2.7A)
 0.47A 5csyB-4okdA:
17.6		 5csyB-4okdA:
21.16
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.
4s3p 4-ALPHA-GLUCANOTRANS
FERASE

(Escherichia
coli) 		PF02446
(Glyco_hydro_77) 		6 ARG A 446
ASP A 448
GLU A 496
GLY A 499
PHE A 522
HIS A 547
 None
 0.95A 5csyB-4s3pA:
32.4		 5csyB-4s3pA:
23.42
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.
4s3p 4-ALPHA-GLUCANOTRANS
FERASE

(Escherichia
coli) 		PF02446
(Glyco_hydro_77) 		5 ARG A 446
ASP A 448
PHE A 522
HIS A 547
ASP A 548
 None
 0.89A 5csyB-4s3pA:
32.4		 5csyB-4s3pA:
23.42
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.
4s3p 4-ALPHA-GLUCANOTRANS
FERASE

(Escherichia
coli) 		PF02446
(Glyco_hydro_77) 		5 GLN A 411
TRP A 413
GLU A 496
GLY A 499
PHE A 522
 None
 0.75A 5csyB-4s3pA:
32.4		 5csyB-4s3pA:
23.42
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.
4s3p 4-ALPHA-GLUCANOTRANS
FERASE

(Escherichia
coli) 		PF02446
(Glyco_hydro_77) 		6 TRP A 413
ARG A 446
GLU A 496
GLY A 499
PHE A 522
HIS A 547
 None
 0.79A 5csyB-4s3pA:
32.4		 5csyB-4s3pA:
23.42
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.
4s3p 4-ALPHA-GLUCANOTRANS
FERASE

(Escherichia
coli) 		PF02446
(Glyco_hydro_77) 		5 TRP A 413
ARG A 446
PHE A 522
HIS A 547
ASP A 548
 None
 0.87A 5csyB-4s3pA:
32.4		 5csyB-4s3pA:
23.42
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.
4tvc DEXTRANSUCRASE

(Leuconostoc
mesenteroides) 		PF02324
(Glyco_hydro_70) 		5 ARG A2208
ASP A2210
GLU A2248
HIS A2321
ASP A2322
 None
GOL  A3008 (-2.7A)
GOL  A3008 ( 4.5A)
None
None
 0.79A 5csyB-4tvcA:
3.2		 5csyB-4tvcA:
18.88
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.
4uzu ALPHA-AMYLASE

(Geobacillus
stearothermophilus) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		5 ARG A 230
ASP A 232
GLU A 262
HIS A 328
ASP A 329
 NA  A1490 ( 4.1A)
NA  A1490 (-2.9A)
NA  A1490 (-2.7A)
None
NA  A1490 ( 4.5A)
 0.49A 5csyB-4uzuA:
5.0		 5csyB-4uzuA:
22.52
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.
4xb3 GLUCAN
1,6-ALPHA-GLUCOSIDAS
E

(Streptococcus
mutans) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		5 ARG A 192
ASP A 194
HIS A 264
HIS A 312
ASP A 313
 None
 0.81A 5csyB-4xb3A:
20.0		 5csyB-4xb3A:
22.08
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.
5a2a APO FORM OF
ANOXYBACILLUS
ALPHA-AMYLASES

(Anoxybacillus
ayderensis) 		PF00128
(Alpha-amylase) 		5 ARG A 211
ASP A 213
GLU A 242
HIS A 309
ASP A 310
 ACT  A1479 ( 4.9A)
ACT  A1479 (-2.6A)
ACT  A1479 ( 4.5A)
None
ACT  A1479 ( 4.9A)
 0.46A 5csyB-5a2aA:
5.9		 5csyB-5a2aA:
22.60
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.
5brq GLYCOSIDE HYDROLASE
FAMILY 13

(Bacillus
licheniformis) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		5 ARG A 201
ASP A 203
GLU A 254
HIS A 282
HIS A 328
 None
 1.13A 5csyB-5brqA:
17.0		 5csyB-5brqA:
21.33
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.
5brq GLYCOSIDE HYDROLASE
FAMILY 13

(Bacillus
licheniformis) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		5 ASP A 203
GLU A 254
HIS A 282
HIS A 328
ASP A 329
 None
 0.95A 5csyB-5brqA:
17.0		 5csyB-5brqA:
21.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5csu 4-ALPHA-GLUCANOTRANS
FERASE DPE1,
CHLOROPLASTIC/AMYLOP
LASTIC

(Arabidopsis
thaliana) 		PF02446
(Glyco_hydro_77) 		12 ASP A 329
LEU A 330
GLN A 336
TRP A 338
ARG A 371
ASP A 373
GLU A 420
GLY A 423
PHE A 446
HIS A 456
HIS A 472
ASP A 473
 GLC  A 608 ( 3.5A)
BGC  A 609 ( 3.6A)
AGL  A 607 ( 3.6A)
HMC  A 606 ( 3.6A)
HMC  A 606 ( 3.7A)
HMC  A 606 ( 3.0A)
AGL  A 607 ( 2.7A)
GLC  A 608 ( 3.6A)
BGC  A 609 ( 4.1A)
BGC  A 609 ( 4.3A)
HMC  A 606 ( 3.8A)
HMC  A 606 ( 2.8A)
 0.31A 5csyB-5csuA:
60.3		 5csyB-5csuA:
100.00
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.
5d0f UNCHARACTERIZED
PROTEIN

([Candida]
glabrata) 		PF06202
(GDE_C)
PF14699
(hGDE_N)
PF14701
(hDGE_amylase)
PF14702
(hGDE_central) 		5 TRP A 496
ARG A 533
ASP A 535
HIS A 669
ASP A 670
 MTT  A2001 (-3.5A)
None
MTT  A2001 (-3.0A)
None
MTT  A2001 (-3.3A)
 0.80A 5csyB-5d0fA:
11.6		 5csyB-5d0fA:
17.37
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.
5do8 LMO0184 PROTEIN

(Listeria
monocytogenes) 		no annotation 6 ARG B 195
ASP B 197
GLU B 254
HIS B 282
HIS B 327
ASP B 328
 BGC  B 601 (-3.4A)
BGC  B 601 (-3.7A)
BGC  B 601 ( 2.7A)
None
BGC  B 601 (-3.9A)
BGC  B 601 ( 2.8A)
 1.27A 5csyB-5do8B:
17.2		 5csyB-5do8B:
20.12
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.
5jbe INACTIVE
GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF02324
(Glyco_hydro_70) 		5 ARG A1013
ASP A1015
GLU A1053
HIS A1124
ASP A1125
 None
None
None
None
GLC  A1711 ( 3.2A)
 0.38A 5csyB-5jbeA:
3.0		 5csyB-5jbeA:
20.42
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.
5jjh 4-ALPHA-GLUCANOTRANS
FERASE

(Corynebacterium
glutamicum) 		PF02446
(Glyco_hydro_77) 		5 ARG A 458
ASP A 460
GLU A 508
PHE A 534
HIS A 560
 None
 1.15A 5csyB-5jjhA:
32.3		 5csyB-5jjhA:
22.40
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.
5jjh 4-ALPHA-GLUCANOTRANS
FERASE

(Corynebacterium
glutamicum) 		PF02446
(Glyco_hydro_77) 		5 ARG A 458
ASP A 460
PHE A 534
HIS A 560
ASP A 561
 None
 0.68A 5csyB-5jjhA:
32.3		 5csyB-5jjhA:
22.40
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.
5m99 ALPHA-AMYLASE

(Thermotoga
petrophila) 		PF00128
(Alpha-amylase) 		5 ARG B 211
ASP B 213
GLU B 253
HIS B 304
ASP B 305
 K  B 605 ( 4.8A)
EDO  B 616 ( 2.8A)
K  B 605 ( 4.7A)
None
K  B 605 ( 4.7A)
 0.45A 5csyB-5m99B:
18.7		 5csyB-5m99B:
20.16
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.
5n6v AMYLOSUCRASE

(Neisseria
polysaccharea) 		no annotation 5 ARG A 284
ASP A 286
GLU A 328
HIS A 392
ASP A 393
 TRS  A 701 ( 4.6A)
TRS  A 701 (-2.8A)
TRS  A 701 (-2.8A)
None
TRS  A 701 ( 4.6A)
 0.44A 5csyB-5n6vA:
14.9		 5csyB-5n6vA:
9.16
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.
5ot1 PULLULANASE TYPE II,
GH13 FAMILY

(Thermococcus
kodakarensis) 		no annotation 5 ARG A 501
ASP A 503
GLU A 534
HIS A 600
ASP A 601
 None
 0.42A 5csyB-5ot1A:
19.6		 5csyB-5ot1A:
10.53
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.
5ww1 PULULLANASE

(Paenibacillus
barengoltzii) 		no annotation 5 ARG A 371
ASP A 373
GLU A 402
HIS A 492
ASP A 493
 None
None
GLC  A 701 ( 4.8A)
None
GLC  A 701 ( 4.6A)
 0.31A 5csyB-5ww1A:
4.2		 5csyB-5ww1A:
9.79
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.
5x7u TREHALOSE SYNTHASE

(Thermobaculum
terrenum) 		no annotation 5 ARG A 200
ASP A 202
GLU A 244
HIS A 309
ASP A 310
 TRS  A 600 ( 4.8A)
TRS  A 600 (-2.8A)
TRS  A 600 (-2.7A)
None
TRS  A 600 ( 4.7A)
 0.38A 5csyB-5x7uA:
17.0		 5csyB-5x7uA:
8.16
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.
5z0u NEOPULLULANASE 1

(Thermoactinomyces
vulgaris) 		no annotation 5 ARG A 354
ASP A 356
GLU A 396
HIS A 471
ASP A 472
 None
 0.45A 5csyB-5z0uA:
19.8		 5csyB-5z0uA:
10.75