SIMILAR PATTERNS OF AMINO ACIDS FOR 5GQB_A_GCSA602

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.
1bqg D-GLUCARATE
DEHYDRATASE


(Pseudomonas
putida)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
3 TRP A 246
GLU A 222
ASP A 241
None
0.62A 5gqbA-1bqgA:
5.7
5gqbA-1bqgA:
24.00
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.
1e6z CHITINASE B

(Serratia
marcescens)
PF00704
(Glyco_hydro_18)
3 TRP A  97
GLU A 144
ASP A 215
NAG  A 503 ( 3.7A)
NGO  A 502 (-3.4A)
NGO  A 502 ( 3.1A)
0.35A 5gqbA-1e6zA:
34.8
5gqbA-1e6zA:
23.92
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.
1f26 NITRIC OXIDE
REDUCTASE


(Fusarium
oxysporum)
PF00067
(p450)
3 TRP A 337
GLU A 277
ASP A 341
None
0.99A 5gqbA-1f26A:
undetectable
5gqbA-1f26A:
22.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1flg PROTEIN
(QUINOPROTEIN
ETHANOL
DEHYDROGENASE)


(Pseudomonas
aeruginosa)
PF01011
(PQQ)
PF13360
(PQQ_2)
3 TRP A 370
GLU A 383
ASP A 313
None
1.05A 5gqbA-1flgA:
undetectable
5gqbA-1flgA:
22.68
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.
1h39 SQUALENE--HOPENE
CYCLASE


(Alicyclobacillus
acidocaldarius)
PF13243
(SQHop_cyclase_C)
PF13249
(SQHop_cyclase_N)
3 TRP A 302
GLU A 291
ASP A  57
None
0.70A 5gqbA-1h39A:
undetectable
5gqbA-1h39A:
22.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hkk CHITOTRIOSIDASE-1

(Homo sapiens)
PF00704
(Glyco_hydro_18)
3 TRP A  99
GLU A 140
ASP A 213
NAA  A1390 ( 4.3A)
AMI  A1388 ( 3.3A)
AMI  A1388 ( 2.9A)
0.35A 5gqbA-1hkkA:
44.5
5gqbA-1hkkA:
22.05
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.
1itx GLYCOSYL HYDROLASE

(Bacillus
circulans)
PF00704
(Glyco_hydro_18)
3 TRP A 164
GLU A 204
ASP A 280
None
GOL  A1007 (-3.7A)
None
0.23A 5gqbA-1itxA:
46.7
5gqbA-1itxA:
29.65
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.
1jct GLUCARATE
DEHYDRATASE


(Escherichia
coli)
PF13378
(MR_MLE_C)
3 TRP A 240
GLU A 216
ASP A 235
None
None
MG  A 498 ( 2.6A)
0.53A 5gqbA-1jctA:
5.2
5gqbA-1jctA:
21.35
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.
1kfw CHITINASE B

(Arthrobacter
sp. TAD20)
PF00704
(Glyco_hydro_18)
3 TRP A 136
GLU A 192
ASP A 272
None
GOL  A 530 (-3.9A)
GOL  A 530 (-3.7A)
0.31A 5gqbA-1kfwA:
41.3
5gqbA-1kfwA:
26.51
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.
1t5o TRANSLATION
INITIATION FACTOR
EIF2B, SUBUNIT DELTA


(Archaeoglobus
fulgidus)
PF01008
(IF-2B)
3 TRP A 272
GLU A 332
ASP A 239
None
0.73A 5gqbA-1t5oA:
2.1
5gqbA-1t5oA:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tz6 PUTATIVE SUGAR
KINASE


(Salmonella
enterica)
PF00294
(PfkB)
3 TRP A 166
GLU A 171
ASP A 134
None
1.00A 5gqbA-1tz6A:
undetectable
5gqbA-1tz6A:
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.
1wb0 CHITOTRIOSIDASE 1

(Homo sapiens)
PF00704
(Glyco_hydro_18)
3 TRP A  99
GLU A 140
ASP A 213
None
0.37A 5gqbA-1wb0A:
44.2
5gqbA-1wb0A:
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.
1wno CHITINASE

(Aspergillus
fumigatus)
PF00704
(Glyco_hydro_18)
3 TRP A  99
GLU A 139
ASP A 208
None
0.50A 5gqbA-1wnoA:
43.3
5gqbA-1wnoA:
24.19
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.
2eve HYPOTHETICAL PROTEIN
PSPTO5229


(Pseudomonas
syringae group
genomosp. 3)
PF01878
(EVE)
3 TRP A 142
GLU A  46
ASP A 103
None
1.06A 5gqbA-2eveA:
undetectable
5gqbA-2eveA:
13.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2g6t UNCHARACTERIZED
PROTEIN, HOMOLOG
HI1244 FROM
HAEMOPHILUS
INFLUENZAE


(Clostridium
acetobutylicum)
PF08942
(DUF1919)
3 TRP A   7
GLU A  77
ASP A  51
None
1.02A 5gqbA-2g6tA:
undetectable
5gqbA-2g6tA:
18.92
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.
2h0b NEUREXIN-1-ALPHA

(Bos taurus)
PF02210
(Laminin_G_2)
3 TRP A 367
GLU A 281
ASP A 369
None
0.98A 5gqbA-2h0bA:
undetectable
5gqbA-2h0bA:
15.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2le1 UNCHARACTERIZED
PROTEIN


(Thermobifida
fusca)
PF10604
(Polyketide_cyc2)
3 TRP A  18
GLU A  70
ASP A  23
None
0.83A 5gqbA-2le1A:
undetectable
5gqbA-2le1A:
13.92
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.
2o0h DNA PACKAGING
PROTEIN GP17


(Escherichia
virus T4)
PF03237
(Terminase_6)
3 TRP A 221
GLU A 208
ASP A 201
None
0.99A 5gqbA-2o0hA:
undetectable
5gqbA-2o0hA:
21.69
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.
2q3h RAS HOMOLOG GENE
FAMILY, MEMBER U


(Homo sapiens)
PF00071
(Ras)
3 TRP A 143
GLU A 146
ASP A 108
None
1.04A 5gqbA-2q3hA:
2.6
5gqbA-2q3hA:
15.34
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.
2qom SERINE PROTEASE ESPP

(Escherichia
coli)
PF03797
(Autotransporter)
3 TRP A1166
GLU A1168
ASP A1031
None
1.02A 5gqbA-2qomA:
undetectable
5gqbA-2qomA:
20.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2wk2 CHITINASE A

(Serratia
marcescens)
PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N)
3 TRP A 275
GLU A 315
ASP A 391
SN5  A1566 (-3.3A)
SN5  A1566 ( 2.9A)
NGT  A1565 (-2.9A)
0.18A 5gqbA-2wk2A:
65.8
5gqbA-2wk2A:
72.96
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.
2x40 BETA-GLUCOSIDASE

(Thermotoga
neapolitana)
PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like)
3 TRP A 687
GLU A 195
ASP A 678
None
0.97A 5gqbA-2x40A:
3.4
5gqbA-2x40A:
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.
2ybu ACIDIC MAMMALIAN
CHITINASE


(Homo sapiens)
PF00704
(Glyco_hydro_18)
3 TRP A  99
GLU A 140
ASP A 213
CX9  A1399 ( 3.4A)
CX9  A1398 (-3.7A)
CX9  A1398 ( 4.4A)
0.27A 5gqbA-2ybuA:
43.9
5gqbA-2ybuA:
24.33
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.
2ywv PHOSPHORIBOSYLAMINOI
MIDAZOLE
SUCCINOCARBOXAMIDE
SYNTHETASE


(Geobacillus
kaustophilus)
PF01259
(SAICAR_synt)
3 TRP A 203
GLU A 110
ASP A 176
None
None
SO4  A 543 ( 4.6A)
1.05A 5gqbA-2ywvA:
undetectable
5gqbA-2ywvA:
18.92
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.
3b7f GLYCOSYL HYDROLASE,
BNR REPEAT


(Cupriavidus
pinatubonensis)
no annotation 3 TRP A 293
GLU A 370
ASP A 288
None
EDO  A 400 ( 3.2A)
EDO  A 400 (-3.6A)
0.97A 5gqbA-3b7fA:
undetectable
5gqbA-3b7fA:
22.68
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.
3c1a PUTATIVE
OXIDOREDUCTASE


(Magnetospirillum
magnetotacticum)
PF01408
(GFO_IDH_MocA)
3 TRP A 263
GLU A 153
ASP A 245
None
0.95A 5gqbA-3c1aA:
undetectable
5gqbA-3c1aA:
21.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3c26 PUTATIVE
ACETYLTRANSFERASE
TA0821


(Thermoplasma
acidophilum)
PF00583
(Acetyltransf_1)
3 TRP A  55
GLU A  77
ASP A 177
EDO  A 269 (-4.9A)
EDO  A 269 ( 4.8A)
None
1.04A 5gqbA-3c26A:
undetectable
5gqbA-3c26A:
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.
3dbk ELASTASE

(Pseudomonas
aeruginosa)
PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C)
3 TRP A  90
GLU A 249
ASP A 243
None
1.01A 5gqbA-3dbkA:
undetectable
5gqbA-3dbkA:
19.96
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.
3e23 UNCHARACTERIZED
PROTEIN RPA2492


(Rhodopseudomonas
palustris)
PF08241
(Methyltransf_11)
3 TRP A 163
GLU A 170
ASP A 118
SO4  A 224 ( 4.3A)
None
None
1.06A 5gqbA-3e23A:
undetectable
5gqbA-3e23A:
17.00
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.
3fg6 ADSEVERIN

(Homo sapiens)
PF00626
(Gelsolin)
3 TRP A 715
GLU A 642
ASP A 638
None
0.95A 5gqbA-3fg6A:
undetectable
5gqbA-3fg6A:
20.31
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.
3g6l CHITINASE

(Clonostachys
rosea)
PF00704
(Glyco_hydro_18)
3 TRP A 134
GLU A 174
ASP A 243
None
0.73A 5gqbA-3g6lA:
43.8
5gqbA-3g6lA:
25.95
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.
3g7l CHROMO
DOMAIN-CONTAINING
PROTEIN 1


(Schizosaccharomyces
pombe)
PF00385
(Chromo)
3 TRP A  44
GLU A  55
ASP A  20
None
0.91A 5gqbA-3g7lA:
undetectable
5gqbA-3g7lA:
7.82
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.
3gyc PUTATIVE GLYCOSIDE
HYDROLASE


(Parabacteroides
distasonis)
PF12876
(Cellulase-like)
3 TRP A 141
GLU A 331
ASP A 183
None
0.91A 5gqbA-3gycA:
6.5
5gqbA-3gycA:
23.76
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.
3mqt MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN


(Shewanella
pealeana)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
3 TRP A 311
GLU A 334
ASP A 206
None
MG  A1243 ( 4.9A)
MG  A1243 (-3.3A)
0.81A 5gqbA-3mqtA:
8.5
5gqbA-3mqtA:
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.
3mzn GLUCARATE
DEHYDRATASE


(Chromohalobacter
salexigens)
PF13378
(MR_MLE_C)
3 TRP A 236
GLU A 212
ASP A 231
None
0.60A 5gqbA-3mznA:
6.2
5gqbA-3mznA:
21.08
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.
3nua PHOSPHORIBOSYLAMINOI
MIDAZOLE-SUCCINOCARB
OXAMIDE SYNTHASE


(Clostridium
perfringens)
PF01259
(SAICAR_synt)
3 TRP A 202
GLU A 110
ASP A 176
None
None
AMP  A 242 (-3.4A)
1.06A 5gqbA-3nuaA:
undetectable
5gqbA-3nuaA:
18.87
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.
3nxl GLUCARATE
DEHYDRATASE


(Burkholderia
lata)
PF13378
(MR_MLE_C)
3 TRP A 260
GLU A 236
ASP A 255
None
None
MG  A 476 (-2.8A)
0.50A 5gqbA-3nxlA:
5.1
5gqbA-3nxlA:
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.
3nzg PUTATIVE RACEMASE

(Pseudovibrio
sp. JE062)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
3 TRP A 316
GLU A 339
ASP A 211
None
GOL  A 601 (-2.6A)
MG  A 507 ( 2.7A)
1.00A 5gqbA-3nzgA:
6.2
5gqbA-3nzgA:
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.
3p0w MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN


(Ralstonia
pickettii)
PF13378
(MR_MLE_C)
3 TRP A 256
GLU A 232
ASP A 251
None
None
MG  A 471 ( 2.6A)
0.57A 5gqbA-3p0wA:
5.2
5gqbA-3p0wA:
22.70
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.
3pfr MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN


(Actinobacillus
succinogenes)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
3 TRP A 241
GLU A 217
ASP A 236
None
None
MG  A 456 ( 2.7A)
0.47A 5gqbA-3pfrA:
5.5
5gqbA-3pfrA:
23.48
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.
3qok PUTATIVE CHITINASE
II


(Klebsiella
pneumoniae)
PF00704
(Glyco_hydro_18)
3 TRP A 114
GLU A 153
ASP A 223
None
0.43A 5gqbA-3qokA:
36.8
5gqbA-3qokA:
24.62
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.
3slt SERINE PROTEASE ESPP

(Escherichia
coli)
PF03797
(Autotransporter)
3 TRP A1166
GLU A1168
ASP A1031
None
0.96A 5gqbA-3sltA:
undetectable
5gqbA-3sltA:
22.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t0q AGR253WP

(Eremothecium
gossypii)
PF00225
(Kinesin)
3 TRP A 490
GLU A 597
ASP A 443
None
1.03A 5gqbA-3t0qA:
undetectable
5gqbA-3t0qA:
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.
3ujz METALLOPROTEASE STCE

(Escherichia
coli)
PF10462
(Peptidase_M66)
3 TRP A 478
GLU A 263
ASP A 481
None
0.87A 5gqbA-3ujzA:
undetectable
5gqbA-3ujzA:
20.82
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.
3va8 PROBABLE DEHYDRATASE

(Fusarium
graminearum)
PF13378
(MR_MLE_C)
3 TRP A 225
GLU A 201
ASP A 220
None
None
MG  A 425 ( 2.4A)
0.67A 5gqbA-3va8A:
3.8
5gqbA-3va8A:
22.09
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.
3vdg PROBABLE GLUCARATE
DEHYDRATASE


(Mycolicibacterium
smegmatis)
PF13378
(MR_MLE_C)
3 TRP A 227
GLU A 203
ASP A 222
None
None
NA  A 502 (-2.9A)
0.60A 5gqbA-3vdgA:
5.4
5gqbA-3vdgA:
22.84
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.
3w4r CHITINASE

(Ostrinia
furnacalis)
PF00704
(Glyco_hydro_18)
3 TRP A 107
GLU A 148
ASP A 218
None
0.41A 5gqbA-3w4rA:
43.0
5gqbA-3w4rA:
22.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w5n PUTATIVE
RHAMNOSIDASE


(Streptomyces
avermitilis)
PF05592
(Bac_rhamnosid)
PF08531
(Bac_rhamnosid_N)
PF17389
(Bac_rhamnosid6H)
PF17390
(Bac_rhamnosid_C)
3 TRP A 107
GLU A 109
ASP A 360
None
0.95A 5gqbA-3w5nA:
3.5
5gqbA-3w5nA:
19.60
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.
3wl1 CHITINASE

(Ostrinia
furnacalis)
PF00704
(Glyco_hydro_18)
3 TRP A 107
GLU A 148
ASP A 218
NAG  A 505 ( 3.4A)
NAG  A 501 (-2.7A)
NAG  A 501 ( 3.2A)
0.41A 5gqbA-3wl1A:
43.1
5gqbA-3wl1A:
24.03
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.
3zlb PHOSPHOGLYCERATE
KINASE


(Streptococcus
pneumoniae)
PF00162
(PGK)
3 TRP A 139
GLU A 121
ASP A 132
None
1.07A 5gqbA-3zlbA:
undetectable
5gqbA-3zlbA:
23.88
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.
4a5q CHI1

(Yersinia
entomophaga)
PF00704
(Glyco_hydro_18)
3 TRP A 215
GLU A 256
ASP A 326
None
0.78A 5gqbA-4a5qA:
36.3
5gqbA-4a5qA:
26.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dhg MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN


(Thermobispora
bispora)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
3 TRP A 222
GLU A 198
ASP A 217
None
0.55A 5gqbA-4dhgA:
5.5
5gqbA-4dhgA:
22.65
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.
4dws CHI2

(Yersinia
entomophaga)
PF00704
(Glyco_hydro_18)
3 TRP A 308
GLU A 349
ASP A 425
None
0.61A 5gqbA-4dwsA:
36.8
5gqbA-4dwsA:
29.76
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.
4dyk AMIDOHYDROLASE

(Pseudomonas
aeruginosa)
PF01979
(Amidohydro_1)
3 TRP A 298
GLU A 295
ASP A 341
None
1.02A 5gqbA-4dykA:
6.7
5gqbA-4dykA:
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.
4g8t GLUCARATE
DEHYDRATASE


(Actinobacillus
succinogenes)
PF13378
(MR_MLE_C)
3 TRP A 236
GLU A 212
ASP A 231
None
None
NA  A 502 (-2.3A)
0.55A 5gqbA-4g8tA:
3.2
5gqbA-4g8tA:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gyp GLUCARATE
DEHYDRATASE-RELATED
PROTEIN


(Escherichia
coli)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
3 TRP C 239
GLU C 215
ASP C 234
None
0.64A 5gqbA-4gypC:
5.4
5gqbA-4gypC:
20.84
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.
4hn8 D-GLUCARATE
DEHYDRATASE


(Pseudomonas
mendocina)
PF13378
(MR_MLE_C)
3 TRP A 257
GLU A 233
ASP A 252
None
0.55A 5gqbA-4hn8A:
5.0
5gqbA-4hn8A:
21.74
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.
4hyr GLUCARATE
DEHYDRATASE


(Acidaminococcus
intestini)
PF13378
(MR_MLE_C)
3 TRP A 236
GLU A 212
ASP A 231
None
0.55A 5gqbA-4hyrA:
6.4
5gqbA-4hyrA:
22.88
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.
4jdq SLR1964 PROTEIN

(Synechocystis
sp. PCC 6803)
no annotation 3 TRP A   9
GLU A  13
ASP A  98
None
0.92A 5gqbA-4jdqA:
undetectable
5gqbA-4jdqA:
13.42
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.
4mae METHANOL
DEHYDROGENASE


(Methylacidiphilum
fumariolicum)
PF13360
(PQQ_2)
3 TRP A 351
GLU A 364
ASP A 296
None
1.03A 5gqbA-4maeA:
undetectable
5gqbA-4maeA:
24.42
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.
4n5x CALCIUM-BINDING
MITOCHONDRIAL
CARRIER PROTEIN
SCAMC-1


(Homo sapiens)
PF13499
(EF-hand_7)
3 TRP A 144
GLU A  88
ASP A 149
None
0.87A 5gqbA-4n5xA:
undetectable
5gqbA-4n5xA:
16.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p47 TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT


(Ochrobactrum
anthropi)
PF03480
(DctP)
3 TRP A 249
GLU A 261
ASP A 254
None
1.04A 5gqbA-4p47A:
undetectable
5gqbA-4p47A:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pj3 INTRON-BINDING
PROTEIN AQUARIUS


(Homo sapiens)
PF13086
(AAA_11)
PF13087
(AAA_12)
PF16399
(Aquarius_N)
3 TRP A 175
GLU A 186
ASP A 315
None
1.01A 5gqbA-4pj3A:
undetectable
5gqbA-4pj3A:
16.79
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.
4q22 GLYCOSIDE HYDROLASE
FAMILY 18


(Serratia
proteamaculans)
PF00704
(Glyco_hydro_18)
3 TRP A 114
GLU A 153
ASP A 223
None
ACT  A 502 (-3.8A)
GOL  A 504 (-2.7A)
0.56A 5gqbA-4q22A:
36.8
5gqbA-4q22A:
25.52
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.
4rqo L-SERINE DEHYDRATASE

(Legionella
pneumophila)
PF03313
(SDH_alpha)
PF03315
(SDH_beta)
3 TRP A 201
GLU A 198
ASP A   7
None
0.99A 5gqbA-4rqoA:
undetectable
5gqbA-4rqoA:
22.22
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.
4txg CHITINASE

(Chromobacterium
violaceum)
PF00704
(Glyco_hydro_18)
PF06483
(ChiC)
3 TRP A 255
GLU A 314
ASP A 398
None
CS  A 803 (-2.9A)
CS  A 812 (-4.0A)
0.50A 5gqbA-4txgA:
32.5
5gqbA-4txgA:
24.76
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.
4w5u CHITINASE

(Streptomyces
thermoviolaceus)
no annotation 3 TRP B 142
GLU B 183
ASP B 251
MLI  B 501 ( 3.8A)
None
MLI  B 501 ( 4.7A)
0.30A 5gqbA-4w5uB:
45.4
5gqbA-4w5uB:
29.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w7g DYNEIN LIGHT
INTERMEDIATE CHAIN


(Chaetomium
thermophilum)
PF05783
(DLIC)
3 TRP A 159
GLU A 158
ASP A 117
None
1.02A 5gqbA-4w7gA:
undetectable
5gqbA-4w7gA:
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.
4x33 DIPHTHAMIDE
BIOSYNTHESIS PROTEIN
3
PROTEIN ATS1


(Saccharomyces
cerevisiae)
PF00415
(RCC1)
PF05207
(zf-CSL)
3 TRP B 229
GLU B 271
ASP A   5
None
0.99A 5gqbA-4x33B:
undetectable
5gqbA-4x33B:
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.
4xqk LLABIII

(Lactococcus
lactis)
PF00271
(Helicase_C)
PF02384
(N6_Mtase)
PF04851
(ResIII)
PF13156
(Mrr_cat_2)
3 TRP A1048
GLU A1105
ASP A1073
None
0.95A 5gqbA-4xqkA:
undetectable
5gqbA-4xqkA:
16.63
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.
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE


(Bacillus cereus)
PF05547
(Peptidase_M6)
3 TRP A 405
GLU A 649
ASP A 657
None
0.94A 5gqbA-4yu5A:
undetectable
5gqbA-4yu5A:
22.46
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.
4zcv CALCIUM-BINDING
MITOCHONDRIAL
CARRIER PROTEIN
SCAMC-1


(Homo sapiens)
PF13499
(EF-hand_7)
3 TRP A 144
GLU A  88
ASP A 149
None
0.95A 5gqbA-4zcvA:
undetectable
5gqbA-4zcvA:
16.08
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.
4zke SUPERKILLER PROTEIN
7


(Saccharomyces
cerevisiae)
PF00009
(GTP_EFTU)
3 TRP A 498
GLU A 440
ASP A 435
TRP  A 498 ( 0.5A)
GLU  A 440 ( 0.6A)
ASP  A 435 ( 0.6A)
1.01A 5gqbA-4zkeA:
undetectable
5gqbA-4zkeA:
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.
4zmh UNCHARACTERIZED
PROTEIN


(Saccharophagus
degradans)
PF15979
(Glyco_hydro_115)
3 TRP A 487
GLU A 484
ASP A 168
None
1.03A 5gqbA-4zmhA:
4.2
5gqbA-4zmhA:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ztu DNA POLYMERASE
SUBUNIT GAMMA-2,
MITOCHONDRIAL


(Homo sapiens)
PF03129
(HGTP_anticodon)
3 TRP B 295
GLU B 298
ASP B  89
None
0.85A 5gqbA-4ztuB:
undetectable
5gqbA-4ztuB:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c24 HIV-1 REVERSE
TRANSCRIPTASE, P51
SUBUNIT


(Human
immunodeficiency
virus 1)
PF00078
(RVT_1)
PF06815
(RVT_connect)
PF06817
(RVT_thumb)
3 TRP B 414
GLU B 413
ASP B  76
None
0.97A 5gqbA-5c24B:
undetectable
5gqbA-5c24B:
20.28
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.
5c53 POL GAMMA B

(Homo sapiens)
PF03129
(HGTP_anticodon)
3 TRP B 295
GLU B 298
ASP B  89
None
0.80A 5gqbA-5c53B:
undetectable
5gqbA-5c53B:
19.82
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.
5cj5 ALPHA-1,4-GLUCAN:MAL
TOSE-1-PHOSPHATE
MALTOSYLTRANSFERASE


(Mycolicibacterium
thermoresistibile)
PF00128
(Alpha-amylase)
PF11896
(DUF3416)
3 TRP A 350
GLU A 394
ASP A 310
None
1.03A 5gqbA-5cj5A:
11.4
5gqbA-5cj5A:
21.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5df0 AC-CHIA

(Autographa
californica
multiple
nucleopolyhedrovirus)
PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N)
3 TRP A 265
GLU A 305
ASP A 382
NAG  A 603 ( 3.9A)
58Y  A 605 (-3.1A)
58Y  A 605 ( 3.0A)
0.17A 5gqbA-5df0A:
62.6
5gqbA-5df0A:
61.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dte MONOSACCHARIDE-TRANS
PORTING ATPASE


(Actinobacillus
succinogenes)
PF13407
(Peripla_BP_4)
3 TRP A 200
GLU A  69
ASP A 118
ALL  A 401 (-3.6A)
ALL  A 401 (-3.3A)
ALL  A 401 (-3.0A)
1.01A 5gqbA-5dteA:
undetectable
5gqbA-5dteA:
20.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5gpr CHITINASE

(Ostrinia
furnacalis)
PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N)
3 TRP A 268
GLU A 308
ASP A 384
TRP  A 268 ( 0.5A)
GLU  A 308 ( 0.6A)
ASP  A 384 ( 0.5A)
0.28A 5gqbA-5gprA:
67.9
5gqbA-5gprA:
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.
5gzt CHITINASE

(Paenibacillus
sp. FPU-7)
PF00704
(Glyco_hydro_18)
3 TRP B 652
GLU B 691
ASP B 767
None
0.33A 5gqbA-5gztB:
41.7
5gqbA-5gztB:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gzt CHITINASE

(Paenibacillus
sp. FPU-7)
PF00704
(Glyco_hydro_18)
3 TRP B1138
GLU B1177
ASP B1253
None
0.45A 5gqbA-5gztB:
41.7
5gqbA-5gztB:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gzu CHITINASE

(Paenibacillus
sp. FPU-7)
PF00704
(Glyco_hydro_18)
3 TRP A 652
GLU A 691
ASP A 767
None
0.45A 5gqbA-5gzuA:
43.3
5gqbA-5gzuA:
23.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gzu CHITINASE

(Paenibacillus
sp. FPU-7)
PF00704
(Glyco_hydro_18)
3 TRP A1138
GLU A1177
ASP A1253
None
0.34A 5gqbA-5gzuA:
43.3
5gqbA-5gzuA:
23.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h0q LIPID BINDING
PROTEIN


(Grifola
frondosa)
no annotation 3 TRP A 155
GLU A  79
ASP A 161
None
1.06A 5gqbA-5h0qA:
undetectable
5gqbA-5h0qA:
17.72
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.
5hyh UNCHARACTERIZED
PROTEIN


(Streptomyces
venezuelae)
PF11583
(AurF)
3 TRP A  82
GLU A  71
ASP A  87
None
0.86A 5gqbA-5hyhA:
undetectable
5gqbA-5hyhA:
19.93
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.
5i67 PHOSPHOENOLPYRUVATE
CARBOXYKINASE [GTP]


(Mycobacterium
tuberculosis)
PF00821
(PEPCK_C)
PF17297
(PEPCK_N)
3 TRP A 288
GLU A 259
ASP A 526
None
0.89A 5gqbA-5i67A:
undetectable
5gqbA-5i67A:
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.
5ihx TYROSINE--TRNA
LIGASE,
MITOCHONDRIAL


(Aspergillus
nidulans)
PF00579
(tRNA-synt_1b)
3 TRP A 281
GLU A 238
ASP A 323
None
1.05A 5gqbA-5ihxA:
undetectable
5gqbA-5ihxA:
23.44
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.
5jzw AEROLYSIN

(Aeromonas
hydrophila)
PF01117
(Aerolysin)
PF03440
(APT)
3 TRP A 359
GLU A  84
ASP A   7
None
0.84A 5gqbA-5jzwA:
undetectable
5gqbA-5jzwA:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mdq CHITOPORIN

(Vibrio harveyi)
no annotation 3 TRP A 185
GLU A 204
ASP A 147
None
None
NA  A 401 ( 4.7A)
1.02A 5gqbA-5mdqA:
undetectable
5gqbA-5mdqA:
9.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n8n EVPB FAMILY TYPE VI
SECRETION PROTEIN


(Pseudomonas
aeruginosa)
no annotation 3 TRP B 138
GLU B 181
ASP B 236
None
0.99A 5gqbA-5n8nB:
undetectable
5gqbA-5n8nB:
10.74
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.
5nf4 MINOR FIMBRIUM TIP
SUBUNIT MFA3


(Porphyromonas
gingivalis)
no annotation 3 TRP A 341
GLU A  61
ASP A 195
None
0.98A 5gqbA-5nf4A:
4.1
5gqbA-5nf4A:
7.58
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.
5pfr BROMODOMAIN ADJACENT
TO ZINC FINGER
DOMAIN PROTEIN 2B


(Homo sapiens)
PF00439
(Bromodomain)
3 TRP A1965
GLU A1927
ASP A1869
None
0.96A 5gqbA-5pfrA:
undetectable
5gqbA-5pfrA:
13.42
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.
5ukw GLUCOSE-6-PHOSPHATE
1-DEHYDROGENASE


(Homo sapiens)
PF00479
(G6PD_N)
PF02781
(G6PD_C)
3 TRP A  53
GLU A  94
ASP A  58
None
0.83A 5gqbA-5ukwA:
undetectable
5gqbA-5ukwA:
19.83
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.
5xwq FUNGAL CHITINASE
FROM RHIZOMUCOR
MIEHEI (NATIVE
PROTEIN)


(Rhizomucor
miehei)
no annotation 3 TRP A 142
GLU A 182
ASP A 257
None
0.23A 5gqbA-5xwqA:
37.3
5gqbA-5xwqA:
9.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y29 INSECT GROUP II
CHITINASE


(Ostrinia
furnacalis)
no annotation 3 TRP A1691
GLU A1733
ASP A1804
None
0.12A 5gqbA-5y29A:
43.9
5gqbA-5y29A:
10.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y2a INSECT GROUP II
CHITINASE


(Ostrinia
furnacalis)
no annotation 3 TRP A2138
GLU A2180
ASP A2251
None
0.22A 5gqbA-5y2aA:
43.1
5gqbA-5y2aA:
9.58
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.
5zl9 CHITINASE AB

(Serratia
marcescens)
no annotation 3 TRP A 275
GLU A 315
ASP A 393
None
GOL  A 706 (-3.3A)
GOL  A 703 (-3.0A)
0.21A 5gqbA-5zl9A:
64.5
5gqbA-5zl9A:
24.00
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.
6fgh BROMODOMAIN ADJACENT
TO ZINC FINGER
DOMAIN PROTEIN 2A


(Homo sapiens)
no annotation 3 TRP A1894
GLU A1856
ASP A1798
None
0.98A 5gqbA-6fghA:
undetectable
5gqbA-6fghA:
8.62