SIMILAR PATTERNS OF AMINO ACIDS FOR 2V3D_A_NBVA1503_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.
1bqc PROTEIN
(BETA-MANNANASE)

(Thermobifida
fusca) 		PF00150
(Cellulase) 		6 ASN A 127
GLU A 128
HIS A 196
TYR A 198
GLU A 225
TRP A 254
 None
 0.67A 2v3dA-1bqcA:
7.1		 2v3dA-1bqcA:
20.58
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.
1ece ENDOCELLULASE E1

(Acidothermus
cellulolyticus) 		PF00150
(Cellulase) 		6 ASN A 161
GLU A 162
HIS A 238
TYR A 240
GLU A 282
TRP A 319
 BGC  A 403 (-3.5A)
BGC  A 402 ( 2.5A)
None
BGC  A 402 ( 4.7A)
BGC  A 403 (-2.8A)
BGC  A 403 ( 4.2A)
 0.73A 2v3dA-1eceA:
6.6		 2v3dA-1eceA:
21.40
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.
1egz ENDOGLUCANASE Z

(Dickeya
chrysanthemi) 		PF00150
(Cellulase) 		5 ASN A 132
GLU A 133
HIS A 192
GLU A 220
TRP A 254
 None
 0.50A 2v3dA-1egzA:
17.3		 2v3dA-1egzA:
19.05
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.
1eqc EXO-(B)-(1,3)-GLUCAN
ASE

(Candida
albicans) 		PF00150
(Cellulase) 		6 ASN A 191
GLU A 192
HIS A 253
TYR A 255
GLU A 292
TRP A 363
 CTS  A 401 (-3.1A)
CTS  A 401 (-3.3A)
None
CTS  A 401 (-3.7A)
CTS  A 401 (-2.8A)
CTS  A 401 (-3.5A)
 0.69A 2v3dA-1eqcA:
16.5		 2v3dA-1eqcA:
21.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f4h BETA-GALACTOSIDASE

(Escherichia
coli) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		6 ASP A 201
ASN A 460
TYR A 503
GLU A 537
TRP A 568
ASN A 102
 None
None
None
None
None
MG  A3001 (-4.1A)
 1.40A 2v3dA-1f4hA:
13.1		 2v3dA-1f4hA:
19.48
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.
1g01 ENDOGLUCANASE

(Bacillus sp.
KSM-635) 		PF00150
(Cellulase)
PF03424
(CBM_17_28) 		5 ASN A 372
GLU A 373
HIS A 442
GLU A 485
TRP A 519
 CD  A 591 ( 4.8A)
CD  A 591 (-2.2A)
None
CD  A 591 (-2.8A)
None
 0.59A 2v3dA-1g01A:
16.3		 2v3dA-1g01A:
21.22
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.
1gzj EGI

(Thermoascus
aurantiacus) 		PF00150
(Cellulase) 		6 ASN A 132
GLU A 133
HIS A 198
TYR A 200
GLU A 240
TRP A 273
 None
 0.79A 2v3dA-1gzjA:
17.0		 2v3dA-1gzjA:
19.80
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.
1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II

(Saccharomyces
cerevisiae) 		PF00150
(Cellulase) 		6 ASN A 231
GLU A 232
HIS A 295
TYR A 297
GLU A 334
TRP A 409
 None
GOL  A1450 ( 4.7A)
None
GOL  A1450 ( 4.8A)
GOL  A1450 ( 4.1A)
GOL  A1450 (-3.5A)
 0.73A 2v3dA-1h4pA:
15.8		 2v3dA-1h4pA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1px8 BETA-XYLOSIDASE

(Thermoanaerobacterium
saccharolyticum) 		PF01229
(Glyco_hydro_39) 		6 ASN A 159
GLU A 160
HIS A 228
TYR A 230
GLU A 277
TRP A 315
 XYP  A 601 (-3.1A)
XYP  A 601 (-2.2A)
XYP  A 601 ( 4.8A)
None
XYP  A 601 (-2.7A)
XYP  A 601 (-4.1A)
 0.73A 2v3dA-1px8A:
13.3		 2v3dA-1px8A:
21.80
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.
1px8 BETA-XYLOSIDASE

(Thermoanaerobacterium
saccharolyticum) 		PF01229
(Glyco_hydro_39) 		6 ASN A 159
GLU A 160
PHE A 115
HIS A 228
GLU A 277
TRP A 315
 XYP  A 601 (-3.1A)
XYP  A 601 (-2.2A)
XYP  A 601 (-4.5A)
XYP  A 601 ( 4.8A)
XYP  A 601 (-2.7A)
XYP  A 601 (-4.1A)
 0.76A 2v3dA-1px8A:
13.3		 2v3dA-1px8A:
21.80
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.
1qnr ENDO-1,4-B-D-MANNANA
SE

(Trichoderma
reesei) 		PF00150
(Cellulase) 		6 ASN A 168
GLU A 169
HIS A 241
TYR A 243
GLU A 276
TRP A 306
 None
MAB  A 401 ( 2.8A)
None
GOL  A 410 (-3.6A)
GOL  A 410 (-3.8A)
GOL  A 410 (-3.6A)
 0.95A 2v3dA-1qnrA:
6.1		 2v3dA-1qnrA:
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.
1rh9 ENDO-BETA-MANNANASE

(Solanum
lycopersicum) 		PF00150
(Cellulase) 		6 ASN A 203
GLU A 204
HIS A 277
TYR A 279
GLU A 318
TRP A 360
 None
 0.81A 2v3dA-1rh9A:
19.2		 2v3dA-1rh9A:
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.
1tvp CELLULASE

(Pseudoalteromonas
haloplanktis) 		PF00150
(Cellulase) 		5 ASN A 134
GLU A 135
HIS A 194
GLU A 222
TRP A 256
 None
EPE  A 700 (-3.4A)
None
EPE  A 700 (-3.5A)
EPE  A 700 (-3.7A)
 0.49A 2v3dA-1tvpA:
17.1		 2v3dA-1tvpA:
19.13
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.
1wky ENDO-BETA-1,4-MANNAN
ASE

(Bacillus sp.
JAMB-602) 		PF00150
(Cellulase) 		6 ASN A 157
GLU A 158
HIS A 223
TYR A 225
GLU A 253
TRP A 282
 NA  A 505 ( 4.7A)
NA  A 505 (-2.9A)
None
None
NA  A 505 (-2.8A)
None
 0.68A 2v3dA-1wkyA:
15.9		 2v3dA-1wkyA:
20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yq2 BETA-GALACTOSIDASE

(Arthrobacter
sp. C2-2) 		PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		6 ASP A 201
ASN A 441
TYR A 483
GLU A 521
TRP A 552
ASN A 100
 NA  A7501 (-2.7A)
None
None
None
NA  A7501 (-4.7A)
NA  A7501 (-4.9A)
 1.27A 2v3dA-1yq2A:
12.8		 2v3dA-1yq2A:
19.28
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.
2bs9 BETA-XYLOSIDASE

(Geobacillus
stearothermophilus) 		PF01229
(Glyco_hydro_39) 		6 ASN A 159
GLU A 160
HIS A 228
TYR A 230
GLU A 278
TRP A 316
 None
 0.70A 2v3dA-2bs9A:
21.1		 2v3dA-2bs9A:
21.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bs9 BETA-XYLOSIDASE

(Geobacillus
stearothermophilus) 		PF01229
(Glyco_hydro_39) 		6 ASN A 159
GLU A 160
PHE A 115
HIS A 228
GLU A 278
TRP A 316
 None
 0.82A 2v3dA-2bs9A:
21.1		 2v3dA-2bs9A:
21.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c0h MANNAN
ENDO-1,4-BETA-MANNOS
IDASE

(Mytilus edulis) 		PF00150
(Cellulase) 		6 ASN A 176
GLU A 177
HIS A 277
TYR A 279
GLU A 308
TRP A 337
 None
 0.80A 2v3dA-2c0hA:
15.7		 2v3dA-2c0hA:
22.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e0p ENDOGLUCANASE

(Ruminiclostridium
thermocellum) 		PF12891
(Glyco_hydro_44) 		6 ASN A 185
GLU A 186
HIS A 283
TYR A 285
GLU A 359
TRP A 392
 CTT  A 800 (-3.2A)
CTT  A 800 ( 2.9A)
CTT  A 800 ( 4.9A)
CTT  A 800 (-4.0A)
CTT  A 800 (-2.6A)
CTT  A 800 ( 3.9A)
 0.76A 2v3dA-2e0pA:
13.5		 2v3dA-2e0pA:
22.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jep XYLOGLUCANASE

(Paenibacillus
pabuli) 		PF00150
(Cellulase) 		6 ASN A 181
GLU A 182
HIS A 264
TYR A 266
GLU A 323
TRP A 361
 None
CA  A1398 ( 4.5A)
None
EDO  A1396 (-3.9A)
EDO  A1396 (-4.4A)
EDO  A1396 (-3.6A)
 0.84A 2v3dA-2jepA:
8.3		 2v3dA-2jepA:
22.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2whl BETA-MANNANASE

(Salipaludibacillus
agaradhaerens) 		PF00150
(Cellulase) 		6 ASN A 126
GLU A 127
HIS A 192
TYR A 194
GLU A 222
TRP A 251
 None
None
None
None
None
MAN  A1301 (-4.5A)
 0.73A 2v3dA-2whlA:
15.2		 2v3dA-2whlA:
20.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2wnw ACTIVATED BY
TRANSCRIPTION FACTOR
SSRB

(Salmonella
enterica) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		9 ASP A  94
TRP A 144
ASN A 195
GLU A 196
HIS A 268
TYR A 270
GLU A 294
TRP A 331
ASN A 346
 GOL  A1449 (-2.7A)
GOL  A1449 (-4.2A)
GOL  A1449 (-3.5A)
GOL  A1449 (-3.7A)
GOL  A1449 ( 4.8A)
None
GOL  A1449 (-2.3A)
GOL  A1449 (-4.1A)
GOL  A1449 (-4.4A)
 0.38A 2v3dA-2wnwA:
49.3		 2v3dA-2wnwA:
32.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2wnw ACTIVATED BY
TRANSCRIPTION FACTOR
SSRB

(Salmonella
enterica) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		6 ASP A  94
TRP A 144
ASN A 195
GLU A 294
TRP A 331
ASN A 342
 GOL  A1449 (-2.7A)
GOL  A1449 (-4.2A)
GOL  A1449 (-3.5A)
GOL  A1449 (-2.3A)
GOL  A1449 (-4.1A)
None
 1.25A 2v3dA-2wnwA:
49.3		 2v3dA-2wnwA:
32.16
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.
2y24 XYLANASE

(Dickeya
chrysanthemi) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		7 TRP A 113
ASN A 164
GLU A 165
HIS A 230
TYR A 232
GLU A 253
TRP A 289
 XYP  A1001 (-3.9A)
XYP  A1001 (-3.1A)
XYP  A1001 ( 2.4A)
None
IMD  A1417 (-3.8A)
XYP  A1001 (-2.8A)
XYP  A1001 (-4.2A)
 0.58A 2v3dA-2y24A:
35.3		 2v3dA-2y24A:
23.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a3h ENDOGLUCANASE

(Salipaludibacillus
agaradhaerens) 		PF00150
(Cellulase) 		5 ASN A 138
GLU A 139
HIS A 200
GLU A 228
TRP A 262
 CTR  A   1 (-3.1A)
CTR  A   1 ( 2.4A)
None
CTR  A   1 ( 2.7A)
CTR  A   1 (-3.5A)
 0.55A 2v3dA-3a3hA:
16.1		 2v3dA-3a3hA:
19.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3axx 458AA LONG
HYPOTHETICAL
ENDO-1,4-BETA-GLUCAN
ASE

(Pyrococcus
horikoshii) 		PF00150
(Cellulase) 		6 ASN A 200
GLU A 201
HIS A 297
TYR A 299
GLU A 342
TRP A 377
 None
CBI  A 459 ( 4.0A)
None
None
None
None
 0.77A 2v3dA-3axxA:
7.8		 2v3dA-3axxA:
23.19
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.
3bga BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		6 ASP A 227
ASN A 483
TYR A 525
GLU A 548
TRP A 579
ASN A 121
 NA  A   4 (-2.8A)
None
None
None
None
MG  A   1 ( 4.8A)
 1.38A 2v3dA-3bgaA:
13.2		 2v3dA-3bgaA:
19.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3clw CONSERVED EXPORTED
PROTEIN

(Bacteroides
fragilis) 		PF14587
(Glyco_hydr_30_2) 		6 ASN A 208
GLU A 209
HIS A 300
TYR A 302
GLU A 335
TRP A 380
 None
 0.38A 2v3dA-3clwA:
31.5		 2v3dA-3clwA:
23.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fw6 CELLULASE

(uncultured
bacterium) 		PF12891
(Glyco_hydro_44) 		6 ASN A 220
GLU A 221
HIS A 328
TYR A 330
GLU A 393
TRP A 426
 None
 0.75A 2v3dA-3fw6A:
15.3		 2v3dA-3fw6A:
22.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gyc PUTATIVE GLYCOSIDE
HYDROLASE

(Parabacteroides
distasonis) 		PF12876
(Cellulase-like) 		5 TRP A 141
ASN A 186
GLU A 187
HIS A 260
GLU A 331
 None
 0.53A 2v3dA-3gycA:
17.5		 2v3dA-3gycA:
20.74
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.
3ik2 ENDOGLUCANASE A

(Clostridium
acetobutylicum) 		PF12891
(Glyco_hydro_44) 		6 ASN A 179
GLU A 180
HIS A 277
TYR A 279
GLU A 352
TRP A 385
 None
 0.73A 2v3dA-3ik2A:
15.3		 2v3dA-3ik2A:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jug BETA-MANNANASE

(Bacillus sp.
N16-5) 		PF00150
(Cellulase) 		6 ASN A 157
GLU A 158
HIS A 223
TYR A 225
GLU A 253
TRP A 282
 None
 0.72A 2v3dA-3jugA:
15.1		 2v3dA-3jugA:
20.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3keh GLUCOCEREBROSIDASE

(Homo sapiens) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		7 ASP A 127
TRP A 179
ASN A 234
GLU A 235
HIS A 311
GLU A 340
TRP A 381
 None
 0.32A 2v3dA-3kehA:
65.1		 2v3dA-3kehA:
99.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3keh GLUCOCEREBROSIDASE

(Homo sapiens) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		6 ASP A 127
TRP A 179
ASN A 234
GLU A 340
TRP A 381
ASN A 392
 None
 1.32A 2v3dA-3kehA:
65.1		 2v3dA-3kehA:
99.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3keh GLUCOCEREBROSIDASE

(Homo sapiens) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		7 ASP A 127
TRP A 179
ASN A 234
HIS A 311
TYR A 313
GLU A 340
TRP A 381
 None
 0.73A 2v3dA-3kehA:
65.1		 2v3dA-3kehA:
99.60
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.
3kl0 GLUCURONOXYLANASE
XYNC

(Bacillus
subtilis) 		PF17189
(Glyco_hydro_30C) 		7 TRP A  85
ASN A 139
GLU A 140
HIS A 202
TYR A 204
GLU A 229
TRP A 268
 None
None
HIS  A 405 (-2.7A)
None
HIS  A 405 ( 3.5A)
HIS  A 406 (-3.2A)
HIS  A 406 ( 3.2A)
 0.46A 2v3dA-3kl0A:
32.8		 2v3dA-3kl0A:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mmw ENDOGLUCANASE

(Thermotoga
maritima) 		PF00150
(Cellulase) 		6 ASN A 135
GLU A 136
HIS A 196
TYR A 198
GLU A 253
TRP A 286
 CD  A 320 ( 4.9A)
CD  A 320 (-2.5A)
None
None
CD  A 320 (-2.9A)
None
 0.79A 2v3dA-3mmwA:
16.4		 2v3dA-3mmwA:
20.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ndy ENDOGLUCANASE D

(Clostridium
cellulovorans) 		PF00150
(Cellulase) 		5 ASN A 151
GLU A 152
HIS A 227
GLU A 275
TRP A 308
 BTB  A   1 ( 4.6A)
BTB  A   1 ( 4.0A)
None
BTB  A   1 (-3.7A)
BTB  A   1 (-3.7A)
 0.62A 2v3dA-3ndyA:
8.1		 2v3dA-3ndyA:
21.24
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.
3pz9 MANNAN
ENDO-1,4-BETA-MANNOS
IDASE. GLYCOSYL
HYDROLASE FAMILY 5

(Thermotoga
petrophila) 		PF00150
(Cellulase) 		6 ASN A 197
GLU A 198
HIS A 278
TYR A 280
GLU A 317
TRP A 350
 None
 0.85A 2v3dA-3pz9A:
7.9		 2v3dA-3pz9A:
19.22
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.
3pzu ENDOGLUCANASE

(Bacillus
subtilis) 		PF00150
(Cellulase) 		5 ASN A 168
GLU A 169
HIS A 229
GLU A 257
TRP A 291
 None
 0.57A 2v3dA-3pzuA:
16.4		 2v3dA-3pzuA:
19.92
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.
3qr3 ENDOGLUCANASE EG-II

(Trichoderma
reesei) 		PF00150
(Cellulase) 		6 ASN A 147
GLU A 148
HIS A 218
TYR A 220
GLU A 259
TRP A 292
 None
SO4  A 346 ( 4.1A)
None
SO4  A 346 (-4.6A)
SO4  A 346 (-3.6A)
SO4  A 346 (-3.3A)
 0.74A 2v3dA-3qr3A:
5.4		 2v3dA-3qr3A:
22.71
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.
3rjy ENDOGLUCANASE
FNCEL5A

(Fervidobacterium
nodosum) 		PF00150
(Cellulase) 		6 ASN A 166
GLU A 167
HIS A 226
TYR A 228
GLU A 283
TRP A 316
 None
GLC  A 402 (-2.9A)
None
GLC  A 402 ( 3.4A)
GLC  A 403 (-2.5A)
GLC  A 403 (-3.4A)
 0.75A 2v3dA-3rjyA:
18.3		 2v3dA-3rjyA:
20.04
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.
3vup BETA-1,4-MANNANASE

(Aplysia kurodai) 		PF00150
(Cellulase) 		6 ASN A 161
GLU A 162
HIS A 262
TYR A 264
GLU A 293
TRP A 322
 TRS  A 401 (-2.7A)
TRS  A 401 (-3.0A)
None
TRS  A 401 ( 4.8A)
TRS  A 401 (-2.7A)
TRS  A 401 (-3.8A)
 0.77A 2v3dA-3vupA:
15.2		 2v3dA-3vupA:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w6m 458AA LONG
HYPOTHETICAL
ENDO-1,4-BETA-GLUCAN
ASE

(Pyrococcus
horikoshii) 		PF00150
(Cellulase) 		6 ASN A 200
GLU A 201
HIS A 297
TYR A 299
GLU A 342
TRP A 377
 None
 0.77A 2v3dA-3w6mA:
7.3		 2v3dA-3w6mA:
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.
3wfl BETA-MANNANASE

(Talaromyces
trachyspermus) 		PF00150
(Cellulase) 		6 ASN A 200
GLU A 201
HIS A 274
TYR A 276
GLU A 309
TRP A 339
 TRS  A 402 (-2.7A)
TRS  A 402 (-2.7A)
None
TRS  A 402 (-4.5A)
TRS  A 402 (-2.8A)
TRS  A 402 ( 3.7A)
 0.86A 2v3dA-3wflA:
7.5		 2v3dA-3wflA:
20.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wh9 ENDO-BETA-1,4-MANNAN
ASE

(Aspergillus
niger) 		PF00150
(Cellulase) 		6 ASN A 167
GLU A 168
HIS A 241
TYR A 243
GLU A 276
TRP A 306
 TRS  A 404 (-2.7A)
TRS  A 404 (-2.9A)
None
TRS  A 404 ( 4.5A)
TRS  A 404 (-2.8A)
TRS  A 404 (-3.7A)
 0.80A 2v3dA-3wh9A:
7.8		 2v3dA-3wh9A:
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.
3wsu BETA-MANNANASE

(Streptomyces
thermolilacinus) 		PF00150
(Cellulase) 		6 ASN A 177
GLU A 178
HIS A 244
TYR A 246
GLU A 273
ASN A 308
 NA  A 402 ( 4.8A)
NA  A 402 (-2.8A)
None
GOL  A 403 (-4.6A)
NA  A 402 (-2.8A)
None
 1.14A 2v3dA-3wsuA:
16.1		 2v3dA-3wsuA:
21.83
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.
3wsu BETA-MANNANASE

(Streptomyces
thermolilacinus) 		PF00150
(Cellulase) 		6 ASN A 177
GLU A 178
HIS A 244
TYR A 246
GLU A 273
TRP A 303
 NA  A 402 ( 4.8A)
NA  A 402 (-2.8A)
None
GOL  A 403 (-4.6A)
NA  A 402 (-2.8A)
None
 0.66A 2v3dA-3wsuA:
16.1		 2v3dA-3wsuA:
21.83
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.
3ziz GH5
ENDO-BETA-1,4-MANNAN
ASE

(Podospora
anserina) 		PF00150
(Cellulase) 		6 ASN A 168
GLU A 169
HIS A 241
TYR A 243
GLU A 276
TRP A 308
 TRS  A1352 (-2.7A)
TRS  A1352 (-2.8A)
None
TRS  A1352 ( 4.5A)
TRS  A1352 (-2.8A)
TRS  A1352 (-3.7A)
 0.80A 2v3dA-3zizA:
8.3		 2v3dA-3zizA:
20.19
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.
3zmr CELLULASE (GLYCOSYL
HYDROLASE FAMILY 5)

(Bacteroides
ovatus) 		PF00150
(Cellulase)
PF13004
(BACON) 		5 ASN A 296
GLU A 297
HIS A 371
TYR A 373
GLU A 430
 BGC  A1518 (-2.8A)
BGC  A1518 (-2.6A)
BGC  A1518 ( 4.8A)
BGC  A1518 ( 4.4A)
GLC  A1519 (-2.8A)
 0.50A 2v3dA-3zmrA:
16.0		 2v3dA-3zmrA:
20.96
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.
4awe ENDO-BETA-D-1,4-MANN
ANASE

(Neurospora
sitophila) 		PF00150
(Cellulase) 		6 ASN A 180
GLU A 181
HIS A 266
TYR A 268
GLU A 301
TRP A 344
 TRS  A1391 (-2.7A)
TRS  A1391 ( 2.7A)
None
TRS  A1391 (-4.4A)
TRS  A1391 (-2.8A)
TRS  A1391 (-3.8A)
 0.84A 2v3dA-4aweA:
7.5		 2v3dA-4aweA:
20.39
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.
4ccd GALACTOCEREBROSIDASE

(Mus musculus) 		PF02057
(Glyco_hydro_59)
PF17387
(Glyco_hydro_59M) 		6 TRP A 135
ASN A 181
GLU A 182
HIS A 237
TYR A 238
GLU A 258
 2DG  A1001 (-4.1A)
2DG  A1001 ( 4.2A)
2DG  A1001 (-3.5A)
None
2DG  A1001 (-4.8A)
2DG  A1001 (-1.6A)
 0.61A 2v3dA-4ccdA:
28.6		 2v3dA-4ccdA:
20.68
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.
4ccd GALACTOCEREBROSIDASE

(Mus musculus) 		PF02057
(Glyco_hydro_59)
PF17387
(Glyco_hydro_59M) 		6 TRP A 135
ASN A 181
GLU A 182
HIS A 237
TYR A 238
SER A 261
 2DG  A1001 (-4.1A)
2DG  A1001 ( 4.2A)
2DG  A1001 (-3.5A)
None
2DG  A1001 (-4.8A)
2DG  A1001 (-2.6A)
 1.11A 2v3dA-4ccdA:
28.6		 2v3dA-4ccdA:
20.68
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.
4cu8 GLYCOSIDE HYDROLASE
2

(Streptococcus
pneumoniae) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		5 ASN A 563
GLU A 564
TYR A 624
GLU A 645
TRP A 708
 DGJ  A1985 (-2.8A)
EDO  A2021 ( 3.0A)
EDO  A2021 ( 4.4A)
DGJ  A1985 (-2.9A)
DGJ  A1985 (-3.7A)
 0.63A 2v3dA-4cu8A:
15.5		 2v3dA-4cu8A:
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.
4ee9 ENDOGLUCANASE

(uncultured
bacterium) 		PF00150
(Cellulase) 		5 ASN A 134
GLU A 135
HIS A 199
GLU A 245
TRP A 276
 TRS  A 401 (-3.0A)
TRS  A 401 (-2.9A)
None
TRS  A 401 (-2.8A)
TRS  A 401 (-3.8A)
 0.52A 2v3dA-4ee9A:
18.8		 2v3dA-4ee9A:
21.82
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.
4fk9 CELLULOSE-BINDING
FAMILY II

(Streptomyces
sp. SirexAA-E) 		PF00150
(Cellulase) 		6 ASN A 177
GLU A 178
HIS A 244
TYR A 246
GLU A 273
ASN A 308
 None
 1.14A 2v3dA-4fk9A:
15.4		 2v3dA-4fk9A:
20.74
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.
4fk9 CELLULOSE-BINDING
FAMILY II

(Streptomyces
sp. SirexAA-E) 		PF00150
(Cellulase) 		6 ASN A 177
GLU A 178
HIS A 244
TYR A 246
GLU A 273
TRP A 303
 None
 0.65A 2v3dA-4fk9A:
15.4		 2v3dA-4fk9A:
20.74
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.
4fmv GLUCURONOARABINOXYLA
N
ENDO-1,4-BETA-XYLANA
SE

([Clostridium]
papyrosolvens) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		7 TRP A  88
ASN A 142
GLU A 143
HIS A 205
TYR A 207
GLU A 232
TRP A 265
 None
 0.28A 2v3dA-4fmvA:
33.7		 2v3dA-4fmvA:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hu0 CELLULASE

(uncultured
bacterium) 		PF00150
(Cellulase) 		6 ASN A 192
GLU A 193
HIS A 258
TYR A 260
GLU A 289
TRP A 328
 CTT  A 401 (-2.8A)
CTT  A 401 (-2.8A)
None
CTT  A 401 (-4.3A)
CTT  A 401 (-2.9A)
CTT  A 401 (-3.8A)
 0.64A 2v3dA-4hu0A:
6.8		 2v3dA-4hu0A:
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.
4lx4 ENDOGLUCANASE(ENDO-1
,4-BETA-GLUCANASE)PR
OTEIN

(Pseudomonas
stutzeri) 		PF00150
(Cellulase) 		6 ASN A 143
GLU A 144
HIS A 206
TYR A 208
GLU A 252
TRP A 283
 TRS  A 401 (-2.5A)
TRS  A 401 (-1.8A)
TRS  A 401 ( 4.8A)
TRS  A 401 ( 4.9A)
TRS  A 401 (-2.6A)
TRS  A 401 ( 3.4A)
 0.79A 2v3dA-4lx4A:
17.7		 2v3dA-4lx4A:
19.92
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.
4lyp EXO-BETA-1,4-MANNOSI
DASE

(Rhizomucor
miehei) 		no annotation 5 ASN A 201
GLU A 202
HIS A 255
GLU A 301
TRP A 354
 TRS  A 503 ( 4.6A)
GAI  A 501 ( 2.7A)
None
TRS  A 503 (-2.6A)
TRS  A 503 (-2.9A)
 0.57A 2v3dA-4lypA:
19.6		 2v3dA-4lypA:
20.07
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.
4m1r CELLULASE 5

(soil metagenome) 		PF00150
(Cellulase) 		5 ASN A 131
GLU A 132
HIS A 192
GLU A 220
TRP A 254
 TRS  A 301 (-3.3A)
TRS  A 301 (-2.7A)
None
TRS  A 301 (-2.7A)
TRS  A 301 (-4.1A)
 0.53A 2v3dA-4m1rA:
16.7		 2v3dA-4m1rA:
19.69
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.
4m29 BETA-XYLOSIDASE

(Caulobacter
vibrioides) 		PF01229
(Glyco_hydro_39) 		6 ASN A 162
GLU A 163
HIS A 229
TYR A 231
GLU A 280
TRP A 318
 None
 0.71A 2v3dA-4m29A:
20.0		 2v3dA-4m29A:
22.02
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.
4m29 BETA-XYLOSIDASE

(Caulobacter
vibrioides) 		PF01229
(Glyco_hydro_39) 		6 ASN A 162
GLU A 163
PHE A 119
HIS A 229
GLU A 280
TRP A 318
 None
 0.78A 2v3dA-4m29A:
20.0		 2v3dA-4m29A:
22.02
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.
4nf7 ENDO-1,4-BETA-GLUCAN
ASE CEL5C

(Butyrivibrio
proteoclasticus) 		PF00150
(Cellulase) 		5 ASN A 188
GLU A 189
HIS A 273
GLU A 321
TRP A 355
 None
 0.60A 2v3dA-4nf7A:
17.7		 2v3dA-4nf7A:
20.91
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.
4oou BETA-1,4-MANNANASE

(Cryptopygus
antarcticus) 		no annotation 6 ASN B 180
GLU B 181
HIS B 280
TYR B 282
GLU B 312
TRP B 341
 TRS  B 401 (-2.8A)
TRS  B 401 (-3.0A)
None
None
TRS  B 401 (-2.9A)
TRS  B 401 (-4.1A)
 0.80A 2v3dA-4oouB:
5.8		 2v3dA-4oouB:
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.
4qaw XYN30D

(Paenibacillus
barcinonensis) 		PF03422
(CBM_6)
PF17189
(Glyco_hydro_30C) 		7 TRP A  84
ASN A 137
GLU A 138
HIS A 201
TYR A 203
GLU A 228
TRP A 267
 None
 0.51A 2v3dA-4qawA:
33.4		 2v3dA-4qawA:
21.37
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.
4qp0 ENDO-BETA-MANNANASE

(Rhizomucor
miehei) 		PF00150
(Cellulase) 		6 ASN A 174
GLU A 175
HIS A 256
TYR A 258
GLU A 293
TRP A 324
 None
 0.82A 2v3dA-4qp0A:
7.6		 2v3dA-4qp0A:
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.
4tuf MAJOR EXTRACELLULAR
ENDOGLUCANASE

(Xanthomonas
campestris) 		PF00150
(Cellulase) 		6 ASN A 181
GLU A 182
HIS A 261
TYR A 263
GLU A 303
TRP A 337
 None
 0.89A 2v3dA-4tufA:
7.3		 2v3dA-4tufA:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uq9 CARBOHYDRATE BINDING
FAMILY 6

(Ruminiclostridium
thermocellum) 		PF17189
(Glyco_hydro_30C) 		7 TRP A  81
ASN A 135
GLU A 136
HIS A 198
TYR A 200
GLU A 225
TRP A 264
 None
 0.44A 2v3dA-4uq9A:
33.3		 2v3dA-4uq9A:
24.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4v2x ENDO-BETA-1,4-GLUCAN
ASE (CELLULASE B)

(Bacillus
halodurans) 		PF00150
(Cellulase)
PF03442
(CBM_X2) 		6 ASN A 173
GLU A 174
HIS A 249
TYR A 251
GLU A 296
TRP A 335
 None
CAC  A1574 (-3.5A)
None
CAC  A1574 ( 4.1A)
CAC  A1574 ( 4.8A)
None
 0.81A 2v3dA-4v2xA:
8.5		 2v3dA-4v2xA:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w7v CELLULASE

(Xanthomonas
citri) 		PF00150
(Cellulase) 		6 ASN A 133
GLU A 134
HIS A 204
TYR A 206
GLU A 246
TRP A 279
 None
CBI  A 401 (-2.8A)
None
CBI  A 401 (-4.5A)
None
CBI  A 402 (-4.2A)
 0.71A 2v3dA-4w7vA:
9.6		 2v3dA-4w7vA:
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.
4w87 XYLOGLUCAN-SPECIFIC
ENDO-BETA-1,4-GLUCAN
ASE

(uncultured
bacterium) 		PF00150
(Cellulase) 		6 ASN A 239
GLU A 240
HIS A 314
TYR A 316
GLU A 362
TRP A 395
 None
BGC  A 502 ( 3.2A)
None
None
None
None
 0.85A 2v3dA-4w87A:
18.1		 2v3dA-4w87A:
22.48
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.
4w8b EXO-XYLOGLUCANASE

(uncultured
bacterium) 		PF00150
(Cellulase) 		6 ASN A 292
GLU A 293
HIS A 368
TYR A 370
GLU A 431
TRP A 471
 GLC  A 601 (-3.1A)
GLC  A 601 (-3.0A)
None
GLC  A 601 (-4.5A)
GLC  A 601 (-2.8A)
GLC  A 601 ( 4.0A)
 0.71A 2v3dA-4w8bA:
17.8		 2v3dA-4w8bA:
22.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xzb CELA

(Geobacillus sp.
70PC53) 		PF00150
(Cellulase) 		5 ASN A 141
GLU A 142
HIS A 203
GLU A 231
TRP A 265
 None
 0.61A 2v3dA-4xzbA:
16.6		 2v3dA-4xzbA:
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.
4xzw ENDO-GLUCANASE
CHIMERA C10

(Geobacillus sp.
70PC53;
uncultured
bacterium) 		PF00150
(Cellulase) 		5 ASN A 141
GLU A 142
HIS A 202
GLU A 230
TRP A 264
 None
EPE  A 404 (-3.3A)
None
EPE  A 404 (-4.3A)
EPE  A 404 ( 4.1A)
 0.54A 2v3dA-4xzwA:
17.0		 2v3dA-4xzwA:
20.83
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.
4yzt CELLULOSE HYDROLASE

(Bacillus
licheniformis) 		PF00150
(Cellulase)
PF03442
(CBM_X2) 		6 ASN A 158
GLU A 159
HIS A 220
TYR A 222
GLU A 268
TRP A 301
 BGC  A 803 (-2.9A)
BGC  A 803 (-2.4A)
BGC  A 803 (-4.3A)
BGC  A 803 ( 4.9A)
BGC  A 803 (-2.8A)
BGC  A 803 (-3.6A)
 0.75A 2v3dA-4yztA:
17.3		 2v3dA-4yztA:
21.44
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.
4zn2 PSLG

(Pseudomonas
aeruginosa) 		PF00150
(Cellulase) 		5 ASN A 164
GLU A 165
HIS A 237
TYR A 239
GLU A 276
 None
 0.60A 2v3dA-4zn2A:
21.1		 2v3dA-4zn2A:
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.
5c70 GLUCURONIDASE

(Aspergillus
oryzae) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N) 		6 ASP A 162
ASN A 413
GLU A 414
TYR A 469
GLU A 505
TRP A 550
 None
 0.90A 2v3dA-5c70A:
17.7		 2v3dA-5c70A:
20.87
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.
5cxp POSSIBLE XYLAN
DEGRADATION ENZYME
(GLYCOSYL HYDROLASE
FAMILY 30-LIKE
DOMAIN AND RICIN
B-LIKE DOMAIN)

(Clostridium
acetobutylicum) 		PF02055
(Glyco_hydro_30) 		7 TRP A  87
ASN A 140
GLU A 141
HIS A 207
TYR A 209
GLU A 230
TRP A 263
 P6G  A 622 (-4.0A)
P6G  A 622 (-3.3A)
NA  A 607 ( 2.1A)
None
P6G  A 622 ( 3.4A)
P6G  A 622 ( 2.7A)
P6G  A 622 (-3.5A)
 0.55A 2v3dA-5cxpA:
34.6		 2v3dA-5cxpA:
23.54
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.
5d8w ENDOGLUCANASE

(Ganoderma
lucidum) 		PF00150
(Cellulase) 		6 ASN A 163
GLU A 164
HIS A 235
TYR A 237
GLU A 276
TRP A 309
 None
 0.80A 2v3dA-5d8wA:
7.3		 2v3dA-5d8wA:
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.
5d9n B-1,4-ENDOGLUCANASE

(Prevotella
bryantii) 		PF00150
(Cellulase) 		5 ASN A 161
GLU A 162
HIS A 238
GLU A 280
TRP A 324
 None
XYS  A 408 ( 3.7A)
None
CA  A 401 ( 4.9A)
None
 0.60A 2v3dA-5d9nA:
7.4		 2v3dA-5d9nA:
18.96
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.
5e0c CELLULASE

(Bacillus sp.
BG-CS10) 		PF00150
(Cellulase)
PF03442
(CBM_X2) 		6 ASN A 148
GLU A 149
HIS A 224
TYR A 226
GLU A 271
TRP A 310
 None
 0.82A 2v3dA-5e0cA:
7.7		 2v3dA-5e0cA:
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.
5e9c HEPARANASE

(Homo sapiens) 		PF03662
(Glyco_hydro_79n) 		5 ASN A 224
GLU A 225
HIS A 296
TYR A 298
GLU A 343
 IDR  A 606 (-3.2A)
5KV  A 608 (-2.8A)
None
IDR  A 606 (-4.4A)
IDR  A 606 (-2.4A)
 0.60A 2v3dA-5e9cA:
5.9		 2v3dA-5e9cA:
24.05
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.
5ecu CELLULASE

(Caldicellulosiruptor
saccharolyticus) 		PF00150
(Cellulase)
PF03424
(CBM_17_28) 		5 ASN A 187
GLU A 188
HIS A 255
GLU A 285
TRP A 319
 CA  A 643 ( 4.8A)
CA  A 643 (-2.5A)
None
CA  A 643 ( 2.9A)
EDO  A 614 (-3.6A)
 0.55A 2v3dA-5ecuA:
16.2		 2v3dA-5ecuA:
21.05
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.
5fip GH5 CELLULASE

(unidentified) 		PF00150
(Cellulase)
PF03424
(CBM_17_28) 		5 ASN A 191
GLU A 192
HIS A 259
GLU A 294
TRP A 328
 None
None
None
None
IPA  A1394 (-4.3A)
 0.57A 2v3dA-5fipA:
16.3		 2v3dA-5fipA:
21.00
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.
5g56 CARBOHYDRATE BINDING
FAMILY 6

(Ruminiclostridium
thermocellum) 		PF00150
(Cellulase)
PF03422
(CBM_6) 		5 ASN A 170
GLU A 171
HIS A 253
TYR A 255
GLU A 279
 None
MPD  A1746 (-2.7A)
None
MPD  A1746 (-3.8A)
None
 0.27A 2v3dA-5g56A:
14.5		 2v3dA-5g56A:
20.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hos CELLULASE

(Xanthomonas
citri) 		PF00150
(Cellulase) 		5 ASN A 137
GLU A 138
HIS A 208
GLU A 250
TRP A 283
 None
 0.51A 2v3dA-5hosA:
7.7		 2v3dA-5hosA:
21.32
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.
5i2u CELLULASE

(soil metagenome) 		PF00150
(Cellulase) 		6 ASN A 142
GLU A 143
HIS A 202
TYR A 204
GLU A 230
TRP A 264
 GOL  A 402 (-3.5A)
GOL  A 402 (-2.9A)
None
GOL  A 402 ( 4.9A)
GOL  A 402 (-2.6A)
GOL  A 402 ( 3.9A)
 0.78A 2v3dA-5i2uA:
16.7		 2v3dA-5i2uA:
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.
5i6s ENDOGLUCANASE

(Talaromyces
verruculosus) 		PF00150
(Cellulase) 		6 ASN A 141
GLU A 142
HIS A 207
TYR A 209
GLU A 249
TRP A 282
 None
 0.86A 2v3dA-5i6sA:
18.0		 2v3dA-5i6sA:
19.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5i77 ENDO-BETA-1,
4-GLUCANASE

(Aspergillus
niger) 		PF00150
(Cellulase) 		5 ASN A 159
GLU A 160
HIS A 225
GLU A 267
TRP A 300
 None
PEG  A 403 ( 2.7A)
None
PEG  A 403 (-2.9A)
PEG  A 403 ( 4.1A)
 0.60A 2v3dA-5i77A:
8.4		 2v3dA-5i77A:
20.36
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.
5ihs ENDOGLUCANASE,
GLYCOSIDE HYDROLASE
FAMILY 5 PROTEIN

(Cytophaga
hutchinsonii) 		PF00150
(Cellulase) 		5 ASN A 158
GLU A 159
HIS A 219
GLU A 247
TRP A 281
 None
 0.45A 2v3dA-5ihsA:
7.1		 2v3dA-5ihsA:
20.62
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.
5j7z PUTATIVE SECRETED
ENDOGLYCOSYLCERAMIDA
SE

(Rhodococcus
hoagii) 		PF00150
(Cellulase) 		5 ASN A 213
GLU A 214
HIS A 291
TYR A 293
TRP A 365
 BGC  A 604 (-3.2A)
18C  A 607 (-3.0A)
None
18C  A 607 (-4.0A)
BGC  A 604 (-3.6A)
 0.57A 2v3dA-5j7zA:
7.0		 2v3dA-5j7zA:
22.03
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.
5jvk UNCHARACTERIZED
PROTEIN

(Bacteroides
cellulosilyticus) 		no annotation 5 ASN A 248
GLU A 249
HIS A 314
TYR A 316
GLU A 366
 GOL  A 654 (-3.6A)
None
None
None
GOL  A 654 (-3.9A)
 0.57A 2v3dA-5jvkA:
23.1		 2v3dA-5jvkA:
21.39
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.
5la0 CARBOHYDRATE BINDING
FAMILY 6

(Ruminiclostridium
thermocellum) 		PF00150
(Cellulase)
PF03422
(CBM_6) 		5 ASN A 170
GLU A 171
HIS A 253
TYR A 255
GLU A 279
 ARA  A 605 (-4.3A)
None
None
None
ARA  A 605 ( 4.4A)
 0.30A 2v3dA-5la0A:
14.7		 2v3dA-5la0A:
21.92
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.
5ngk GLUCOSYLCERAMIDASE

(Bacteroides
thetaiotaomicron) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		8 ASP A 131
TRP A 179
ASN A 237
GLU A 238
HIS A 314
TYR A 316
GLU A 339
TRP A 377
 None
 0.38A 2v3dA-5ngkA:
46.2		 2v3dA-5ngkA:
27.70
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.
5ta1 GLYCOSIDE HYDROLASE

(Bacteroides
uniformis) 		no annotation 5 ASN A 199
GLU A 200
HIS A 278
TYR A 280
GLU A 322
 EDO  A 706 ( 4.0A)
GOL  A 704 ( 2.8A)
None
GOL  A 704 (-4.6A)
GOL  A 704 (-3.3A)
 0.59A 2v3dA-5ta1A:
15.0		 2v3dA-5ta1A:
21.17
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.
5wh8 PUTATIVE
CARBOHYDRATE-ACTIVE
ENZYME

(uncultured
organism) 		no annotation 5 ASN A 195
GLU A 196
HIS A 256
GLU A 284
TRP A 318
 None
EDO  A 411 ( 4.1A)
None
EDO  A 411 (-3.3A)
EDO  A 411 (-2.7A)
 0.57A 2v3dA-5wh8A:
17.5		 2v3dA-5wh8A:
10.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y6t ENDO-1,4-BETA-MANNAN
ASE

(Eisenia fetida) 		no annotation 6 ASN A 178
GLU A 179
HIS A 278
TYR A 280
GLU A 309
TRP A 338
 TRS  A 401 (-2.8A)
TRS  A 401 (-2.8A)
None
TRS  A 401 (-4.8A)
TRS  A 401 (-2.6A)
TRS  A 401 (-3.7A)
 0.85A 2v3dA-5y6tA:
6.6		 2v3dA-5y6tA:
9.48
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.
6etz BETA-GALACTOSIDASE

(Arthrobacter
sp. 32cB) 		no annotation 6 ASP A 207
ASN A 440
TYR A 482
GLU A 517
TRP A 548
ASN A 110
 NA  A1105 (-2.6A)
None
None
None
None
None
 1.23A 2v3dA-6etzA:
13.2		 2v3dA-6etzA:
12.81