SIMILAR PATTERNS OF AMINO ACIDS FOR 5WBV_A_SAMA402

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.
1b4e PROTEIN
(5-AMINOLEVULINIC
ACID DEHYDRATASE)

(Escherichia
coli) 		PF00490
(ALAD) 		5 SER A  82
GLY A  97
ALA A 100
CYH A 122
CYH A 120
 None
None
None
ZN  A 405 (-2.3A)
ZN  A 405 (-2.1A)
 1.44A 5wbvA-1b4eA:
0.0		 5wbvA-1b4eA:
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.
1db3 GDP-MANNOSE
4,6-DEHYDRATASE

(Escherichia
coli) 		PF16363
(GDP_Man_Dehyd) 		5 TYR A 156
SER A 154
ALA A 106
SER A  97
GLU A 134
 None
 1.28A 5wbvA-1db3A:
0.0		 5wbvA-1db3A:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ex0 COAGULATION FACTOR
XIII A CHAIN

(Homo sapiens) 		PF00868
(Transglut_N)
PF00927
(Transglut_C)
PF01841
(Transglut_core) 		5 GLY A 410
ALA A 412
PHE A 430
CYH A 314
CYH A 374
 None
 1.20A 5wbvA-1ex0A:
0.0		 5wbvA-1ex0A:
16.41
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.
1hjv CHITINASE-3 LIKE
PROTEIN 1

(Homo sapiens) 		PF00704
(Glyco_hydro_18) 		5 SER A 252
GLY A 348
ALA A 349
PHE A 200
SER A 175
 None
 1.29A 5wbvA-1hjvA:
undetectable		 5wbvA-1hjvA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hkk CHITOTRIOSIDASE-1

(Homo sapiens) 		PF00704
(Glyco_hydro_18) 		5 SER A 258
GLY A 354
ALA A 355
PHE A 206
SER A 181
 None
 1.26A 5wbvA-1hkkA:
0.0		 5wbvA-1hkkA:
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.
1lox 15-LIPOXYGENASE

(Oryctolagus
cuniculus) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		5 TYR A 461
SER A 459
GLY A 236
ALA A 237
PHE A 233
 None
 0.98A 5wbvA-1loxA:
undetectable		 5wbvA-1loxA:
17.65
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		5 SER A 543
ALA A 654
SER A 706
TYR A 703
CYH A 665
 None
 1.40A 5wbvA-1ofeA:
0.0		 5wbvA-1ofeA:
10.46
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.
1ukf AVIRULENCE PROTEIN
AVRPPH3

(Pseudomonas
savastanoi) 		PF03543
(Peptidase_C58) 		5 SER A 109
ALA A  88
PHE A 226
CYH A 218
GLU A 219
 None
 1.25A 5wbvA-1ukfA:
0.0		 5wbvA-1ukfA:
19.58
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.
1wb0 CHITOTRIOSIDASE 1

(Homo sapiens) 		PF00704
(Glyco_hydro_18) 		5 SER A 258
GLY A 356
ALA A 357
PHE A 206
SER A 181
 None
 1.21A 5wbvA-1wb0A:
undetectable		 5wbvA-1wb0A:
20.51
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.
2cb9 FENGYCIN SYNTHETASE

(Bacillus
subtilis) 		PF00975
(Thioesterase) 		5 GLY A 199
ALA A 200
SER A  84
TYR A 113
PHE A 166
 None
None
ACY  A1225 (-2.5A)
None
None
 1.02A 5wbvA-2cb9A:
undetectable		 5wbvA-2cb9A:
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.
2d3t FATTY OXIDATION
COMPLEX ALPHA
SUBUNIT

(Pseudomonas
fragi) 		PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 GLY A 321
ALA A 400
SER A 333
HIS A 457
GLU A 356
 NAD  A1001 ( 4.0A)
NAD  A1001 (-4.7A)
None
None
None
 1.38A 5wbvA-2d3tA:
undetectable		 5wbvA-2d3tA:
16.34
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.
2nnj CYTOCHROME P450 2C8

(Homo sapiens) 		PF00067
(p450) 		5 TYR A  80
GLY A  79
ALA A  82
SER A 429
GLU A 400
 None
None
None
HEM  A 500 (-2.9A)
None
 1.47A 5wbvA-2nnjA:
undetectable		 5wbvA-2nnjA:
20.22
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.
2rgj FLAVIN-CONTAINING
MONOOXYGENASE

(Pseudomonas
aeruginosa) 		PF01494
(FAD_binding_3) 		5 GLY A  63
ALA A  58
SER A  18
HIS A  24
GLU A 119
 None
 1.35A 5wbvA-2rgjA:
undetectable		 5wbvA-2rgjA:
18.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vqd BIOTIN CARBOXYLASE

(Pseudomonas
aeruginosa) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 GLY A 163
ALA A 160
SER A 118
PHE A 286
GLU A 276
 None
None
None
None
MG  A1449 ( 2.7A)
 1.47A 5wbvA-2vqdA:
undetectable		 5wbvA-2vqdA:
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.
2ww2 ALPHA-1,2-MANNOSIDAS
E

(Bacteroides
thetaiotaomicron) 		PF07971
(Glyco_hydro_92) 		5 SER A 755
ALA A 499
PHE A 548
SER A 546
GLU A 552
 None
 1.49A 5wbvA-2ww2A:
undetectable		 5wbvA-2ww2A:
16.22
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.
2yd0 ENDOPLASMIC
RETICULUM
AMINOPEPTIDASE 1

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		5 GLY A 377
ALA A 442
PHE A 360
TYR A 293
GLU A 354
 None
None
None
None
BES  A1950 (-3.3A)
 1.42A 5wbvA-2yd0A:
undetectable		 5wbvA-2yd0A:
14.43
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.
3e3m TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Ruegeria
pomeroyi) 		PF13377
(Peripla_BP_3) 		5 GLY A 226
ALA A 227
SER A 256
PHE A 190
GLU A 222
 None
 1.26A 5wbvA-3e3mA:
undetectable		 5wbvA-3e3mA:
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.
3gg4 GLYCEROL KINASE

(Yersinia
pseudotuberculosis) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 GLY A 485
ALA A 482
PHE A  78
HIS A 257
CYH A 182
 None
 1.42A 5wbvA-3gg4A:
undetectable		 5wbvA-3gg4A:
19.02
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.
3grk ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(NADH)

(Brucella
melitensis) 		PF13561
(adh_short_C2) 		5 TYR A 150
SER A 191
GLY A 253
ALA A 217
GLU A 153
 None
 1.30A 5wbvA-3grkA:
undetectable		 5wbvA-3grkA:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hsk ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE

(Candida
albicans) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		5 SER A 106
GLY A  10
ALA A  36
PHE A  97
SER A  96
 None
NAP  A 366 (-3.3A)
NAP  A 366 (-3.4A)
None
None
 1.42A 5wbvA-3hskA:
undetectable		 5wbvA-3hskA:
21.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iab RIBONUCLEASES P/MRP
PROTEIN SUBUNIT POP7

(Saccharomyces
cerevisiae) 		PF12328
(Rpp20) 		5 GLY B  67
ALA B  71
SER B  43
HIS B  81
PHE B  82
 A  R  91 ( 3.2A)
A  R  91 ( 3.7A)
U  R  89 ( 2.8A)
None
None
 1.25A 5wbvA-3iabB:
undetectable		 5wbvA-3iabB:
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.
3l01 GLGA GLYCOGEN
SYNTHASE

(Pyrococcus
abyssi) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		5 GLY A 342
ALA A 345
PHE A 412
SER A 411
GLU A  20
 K  A5600 (-4.4A)
None
None
None
None
 1.31A 5wbvA-3l01A:
undetectable		 5wbvA-3l01A:
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.
3lew SUSD-LIKE
CARBOHYDRATE BINDING
PROTEIN

(Bacteroides
vulgatus) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		5 GLY A  67
ALA A  68
PHE A 307
SER A 306
PHE A 352
 None
 1.30A 5wbvA-3lewA:
undetectable		 5wbvA-3lewA:
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.
3n71 HISTONE LYSINE
METHYLTRANSFERASE
SMYD1

(Mus musculus) 		PF00856
(SET)
PF01753
(zf-MYND) 		5 HIS A 206
TYR A 252
PHE A 272
CYH A 274
CYH A 276
 None
SFG  A 491 (-4.8A)
SFG  A 491 (-3.7A)
ZN  A 497 (-2.2A)
ZN  A 497 (-2.5A)
 1.08A 5wbvA-3n71A:
5.9		 5wbvA-3n71A:
19.20
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.
3nqi PUTATIVE LIPOPROTEIN

(Bacteroides
fragilis) 		no annotation 5 GLY A 100
SER A 210
HIS A 169
TYR A 151
PHE A 171
 None
PEG  A 329 (-3.6A)
None
None
None
 1.37A 5wbvA-3nqiA:
undetectable		 5wbvA-3nqiA:
19.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4au7 HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H2

(Mus musculus) 		PF00856
(SET) 		10 TYR A 114
GLY A 120
ALA A 121
PHE A 160
HIS A 183
TYR A 217
PHE A 222
CYH A 229
GLU A 230
CYH A 231
 SAH  A1247 ( 3.6A)
SAH  A1247 (-3.2A)
SAH  A1247 (-4.1A)
None
SAH  A1247 (-4.6A)
None
SAH  A1247 (-4.0A)
ZN  A1248 ( 2.3A)
EDO  A1251 ( 2.8A)
ZN  A1248 ( 2.2A)
 0.38A 5wbvA-4au7A:
33.3		 5wbvA-4au7A:
60.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4au7 HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H2

(Mus musculus) 		PF00856
(SET) 		10 TYR A 114
GLY A 120
ALA A 121
SER A 161
HIS A 183
TYR A 217
PHE A 222
CYH A 229
GLU A 230
CYH A 231
 SAH  A1247 ( 3.6A)
SAH  A1247 (-3.2A)
SAH  A1247 (-4.1A)
None
SAH  A1247 (-4.6A)
None
SAH  A1247 (-4.0A)
ZN  A1248 ( 2.3A)
EDO  A1251 ( 2.8A)
ZN  A1248 ( 2.2A)
 0.63A 5wbvA-4au7A:
33.3		 5wbvA-4au7A:
60.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4au7 HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H2

(Mus musculus) 		PF00856
(SET) 		5 TYR A 114
SER A 115
CYH A 229
GLU A 230
CYH A 231
 SAH  A1247 ( 3.6A)
EDO  A1251 (-3.1A)
ZN  A1248 ( 2.3A)
EDO  A1251 ( 2.8A)
ZN  A1248 ( 2.2A)
 1.45A 5wbvA-4au7A:
33.3		 5wbvA-4au7A:
60.00
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.
4c2k 3-KETOACYL-COA
THIOLASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 SER A 186
GLY A 248
ALA A 247
HIS A 352
GLU A 321
 None
 1.35A 5wbvA-4c2kA:
undetectable		 5wbvA-4c2kA:
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.
4c8y CAS6A

(Thermus
thermophilus) 		PF10040
(CRISPR_Cas6) 		5 TYR A 231
SER A 124
GLY A 191
ALA A 190
PHE A  48
 None
 1.04A 5wbvA-4c8yA:
undetectable		 5wbvA-4c8yA:
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.
4gkv ALCOHOL
DEHYDROGENASE,
PROPANOL-PREFERRING

(Escherichia
coli) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A  62
ALA A  80
HIS A  58
CYH A  37
CYH A 145
 None
None
ZN  A 402 (-3.3A)
ZN  A 402 ( 2.4A)
ZN  A 402 ( 2.3A)
 1.45A 5wbvA-4gkvA:
undetectable		 5wbvA-4gkvA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4id9 SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE

(Agrobacterium
fabrum) 		PF01370
(Epimerase) 		5 GLY A 247
ALA A 246
SER A  94
HIS A  63
GLU A 140
 None
 1.25A 5wbvA-4id9A:
undetectable		 5wbvA-4id9A:
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.
4lfe GERANYLGERANYL
DIPHOSPHATE SYNTHASE

(Streptococcus
uberis) 		PF00348
(polyprenyl_synt) 		5 GLY A 117
ALA A 115
HIS A  12
GLU A  17
CYH A  16
 None
 1.36A 5wbvA-4lfeA:
undetectable		 5wbvA-4lfeA:
20.94
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.
4lg9 F-BOX-LIKE/WD
REPEAT-CONTAINING
PROTEIN TBL1XR1

(Homo sapiens) 		PF00400
(WD40) 		5 SER A 447
GLY A 485
SER A 479
CYH A 490
GLU A 488
 None
 1.47A 5wbvA-4lg9A:
undetectable		 5wbvA-4lg9A:
20.29
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.
4lir NUCLEOPORIN NUP53

(Homo sapiens) 		PF05172
(Nup35_RRM) 		5 SER A 174
GLY A 197
ALA A 194
HIS A 212
CYH A 243
 None
 1.45A 5wbvA-4lirA:
undetectable		 5wbvA-4lirA:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mz0 CURL

(Moorea
producens) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 SER A 447
GLY A 393
ALA A 392
SER A 211
GLU A 355
 None
 1.43A 5wbvA-4mz0A:
undetectable		 5wbvA-4mz0A:
14.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p5i CHEMOKINE BINDING
PROTEIN

(Orf virus) 		PF02250
(Orthopox_35kD) 		5 GLY A 269
SER A 125
HIS A  21
PHE A  17
GLU A  13
 None
 1.18A 5wbvA-4p5iA:
undetectable		 5wbvA-4p5iA:
19.54
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.
4qyr AT-LESS POLYKETIDE
SYNTHASE

(Streptomyces
platensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 SER A2959
GLY A2900
ALA A2899
SER A2713
GLU A2855
 None
 1.45A 5wbvA-4qyrA:
undetectable		 5wbvA-4qyrA:
15.81
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.
4tkt AT-LESS POLYKETIDE
SYNTHASE

(Streptomyces
platensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 SER A3559
GLY A3504
ALA A3503
SER A3322
GLU A3466
 None
 1.49A 5wbvA-4tktA:
undetectable		 5wbvA-4tktA:
18.76
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.
4trq NUCLEAR MRNA EXPORT
PROTEIN SAC3
NUCLEAR MRNA EXPORT
PROTEIN THP1

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF03399
(SAC3_GANP)
PF01399
(PCI) 		5 SER A 407
ALA A 399
PHE A 429
HIS B 395
GLU B 336
 None
 1.34A 5wbvA-4trqA:
undetectable		 5wbvA-4trqA:
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.
4u60 STRUCTURAL PROTEIN
VP1

(Human
polyomavirus 8) 		PF00718
(Polyoma_coat) 		5 TYR A  91
SER A 268
GLY A 207
ALA A 208
CYH A 215
 None
 1.23A 5wbvA-4u60A:
undetectable		 5wbvA-4u60A:
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.
4w6z ALCOHOL
DEHYDROGENASE 1

(Saccharomyces
cerevisiae) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A  70
ALA A  88
HIS A  66
CYH A  43
CYH A 153
 None
None
ZN  A 401 ( 3.1A)
ZN  A 401 (-2.2A)
ZN  A 401 (-2.3A)
 1.37A 5wbvA-4w6zA:
undetectable		 5wbvA-4w6zA:
19.94
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.
4w6z ALCOHOL
DEHYDROGENASE 1

(Saccharomyces
cerevisiae) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 SER A  40
GLY A  70
ALA A  88
CYH A  43
CYH A 153
 None
None
None
ZN  A 401 (-2.2A)
ZN  A 401 (-2.3A)
 1.33A 5wbvA-4w6zA:
undetectable		 5wbvA-4w6zA:
19.94
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.
4win GMP SYNTHETASE

(Plasmodium
falciparum) 		PF00117
(GATase) 		5 GLY A 101
SER A  61
HIS A 170
CYH A 190
CYH A 193
 None
 1.42A 5wbvA-4winA:
undetectable		 5wbvA-4winA:
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.
4yfg RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE DELTA

(Mus musculus) 		no annotation 5 TYR B 386
ALA B 333
SER B 376
HIS B 355
PHE B 388
 None
 1.40A 5wbvA-4yfgB:
undetectable		 5wbvA-4yfgB:
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.
4zo6 LIN1840 PROTEIN

(Listeria
innocua) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 GLY A  58
ALA A  57
PHE A  88
SER A  63
PHE A 135
 None
None
None
None
BGC  A 802 (-4.3A)
 0.99A 5wbvA-4zo6A:
undetectable		 5wbvA-4zo6A:
16.48
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.
5a6f GATING RING OF
POTASSIUM CHANNEL
SUBFAMILY T MEMBER 1

(Gallus gallus) 		PF03493
(BK_channel_a) 		5 TYR C 788
GLY C 786
PHE C 790
PHE C 826
CYH C 825
 None
 1.47A 5wbvA-5a6fC:
undetectable		 5wbvA-5a6fC:
17.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5by3 BTGH115A

(Bacteroides
thetaiotaomicron) 		PF15979
(Glyco_hydro_115) 		5 TYR A 211
GLY A 164
ALA A 208
PHE A 238
PHE A 222
 None
 1.32A 5wbvA-5by3A:
undetectable		 5wbvA-5by3A:
15.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5cpr HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1

(Homo sapiens) 		PF00856
(SET) 		6 TYR B 203
SER B 204
GLY B 209
CYH B 319
GLU B 320
CYH B 321
 SAM  B 402 (-3.7A)
None
SAM  B 402 (-3.4A)
ZN  B 401 ( 2.3A)
SAM  B 402 (-4.6A)
ZN  B 401 ( 2.2A)
 1.17A 5wbvA-5cprB:
37.6		 5wbvA-5cprB:
97.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5cpr HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1

(Homo sapiens) 		PF00856
(SET) 		11 TYR B 203
SER B 205
GLY B 209
ALA B 210
PHE B 250
HIS B 273
TYR B 307
PHE B 312
CYH B 319
GLU B 320
CYH B 321
 SAM  B 402 (-3.7A)
SAM  B 402 (-2.7A)
SAM  B 402 (-3.4A)
SAM  B 402 (-3.9A)
None
SAM  B 402 (-4.5A)
539  B 403 ( 3.9A)
SAM  B 402 (-3.7A)
ZN  B 401 ( 2.3A)
SAM  B 402 (-4.6A)
ZN  B 401 ( 2.2A)
 0.49A 5wbvA-5cprB:
37.6		 5wbvA-5cprB:
97.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5cpr HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1

(Homo sapiens) 		PF00856
(SET) 		11 TYR B 203
SER B 205
GLY B 209
ALA B 210
SER B 251
HIS B 273
TYR B 307
PHE B 312
CYH B 319
GLU B 320
CYH B 321
 SAM  B 402 (-3.7A)
SAM  B 402 (-2.7A)
SAM  B 402 (-3.4A)
SAM  B 402 (-3.9A)
SAM  B 402 (-3.9A)
SAM  B 402 (-4.5A)
539  B 403 ( 3.9A)
SAM  B 402 (-3.7A)
ZN  B 401 ( 2.3A)
SAM  B 402 (-4.6A)
ZN  B 401 ( 2.2A)
 0.60A 5wbvA-5cprB:
37.6		 5wbvA-5cprB:
97.80
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.
5dfm MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TELOMERASE-A
SSOCIATED PROTEIN 19

(Escherichia
coli;
Tetrahymena
thermophila) 		PF13416
(SBP_bac_8) 		5 SER A 337
GLY A  68
ALA A  71
TYR A 381
GLU A  45
 None
 1.11A 5wbvA-5dfmA:
undetectable		 5wbvA-5dfmA:
18.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e6k POLYKETIDE SYNTHASE
PKSL

(Bacillus
subtilis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 SER A 408
GLY A 353
ALA A 352
SER A 171
GLU A 315
 None
 1.48A 5wbvA-5e6kA:
undetectable		 5wbvA-5e6kA:
18.70
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.
5eno MULTIDRUG EFFLUX
PUMP SUBUNIT
ACRB,MULTIDRUG
EFFLUX PUMP SUBUNIT
ACRB

(Escherichia
coli) 		PF00873
(ACR_tran) 		5 SER A  46
GLY A 619
ALA A 618
SER A  79
GLU A 130
 None
 1.47A 5wbvA-5enoA:
undetectable		 5wbvA-5enoA:
17.05
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.
5eny POLYKETIDE SYNTHASE
PKSL

(Bacillus
subtilis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 SER A 408
GLY A 353
ALA A 352
SER A 171
GLU A 315
 None
 1.48A 5wbvA-5enyA:
undetectable		 5wbvA-5enyA:
17.50
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.
5erb POLYKETIDE SYNTHASE

(Bacillus
amyloliquefaciens) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 SER A 430
GLY A 367
ALA A 366
SER A 185
GLU A 329
 None
 1.45A 5wbvA-5erbA:
undetectable		 5wbvA-5erbA:
18.20
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.
5gnw BLR0248 PROTEIN

(Bradyrhizobium
diazoefficiens) 		no annotation 5 TYR C 118
GLY C 114
ALA C  26
PHE C  96
CYH C  18
 None
 1.17A 5wbvA-5gnwC:
undetectable		 5wbvA-5gnwC:
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.
5n8p S-LAYER PROTEIN

(Caulobacter
vibrioides) 		PF00353
(HemolysinCabind) 		5 SER A 661
GLY A 705
ALA A 704
SER A 687
GLU A 624
 None
 1.46A 5wbvA-5n8pA:
undetectable		 5wbvA-5n8pA:
11.39
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.
5n97 S-LAYER PROTEIN RSAA

(Caulobacter
vibrioides) 		PF00353
(HemolysinCabind) 		5 SER A 661
GLY A 705
ALA A 704
SER A 687
GLU A 624
 None
 1.46A 5wbvA-5n97A:
undetectable		 5wbvA-5n97A:
13.16
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.
5nit GLUCOSE OXIDASE

(Aspergillus
niger) 		no annotation 5 TYR A  54
SER A  53
GLY A 101
ALA A 228
GLU A   5
 None
 1.41A 5wbvA-5nitA:
undetectable		 5wbvA-5nitA:
17.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tf4 ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADH]

(Bartonella
henselae) 		PF13561
(adh_short_C2) 		5 TYR A 150
SER A 191
GLY A 253
ALA A 217
GLU A 153
 None
 1.31A 5wbvA-5tf4A:
undetectable		 5wbvA-5tf4A:
23.57
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.
5xep CHITINASE-3-LIKE
PROTEIN 1

(Mus musculus) 		no annotation 5 SER A 253
GLY A 349
ALA A 350
PHE A 201
SER A 176
 None
 1.17A 5wbvA-5xepA:
undetectable		 5wbvA-5xepA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6azt ASPARAGINYL
ENDOPEPTIDASE 1

(Helianthus
annuus) 		no annotation 5 SER A 248
GLY A 243
ALA A 244
HIS A 178
GLU A 218
 None
None
None
SNN  A 177 (-3.6A)
None
 1.36A 5wbvA-6aztA:
undetectable		 5wbvA-6aztA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ac5 KEX1(DELTA)P

(Saccharomyces
cerevisiae) 		PF00450
(Peptidase_S10) 		3 HIS A 448
GLU A  88
ASN A  74
 None
 0.91A 5wbvA-1ac5A:
0.0		 5wbvA-1ac5A:
21.79
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.
1axn ANNEXIN III

(Homo sapiens) 		PF00191
(Annexin) 		3 HIS A 295
GLU A 257
ASN A 246
 None
 0.85A 5wbvA-1axnA:
0.0		 5wbvA-1axnA:
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.
1gco GLUCOSE
DEHYDROGENASE

(Bacillus
megaterium) 		PF13561
(adh_short_C2) 		3 HIS A 147
GLU A  96
ASN A 196
 None
None
NAD  A 601 (-3.9A)
 0.98A 5wbvA-1gcoA:
0.0		 5wbvA-1gcoA:
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.
1gxs P-(S)-HYDROXYMANDELO
NITRILE LYASE CHAIN
A
P-(S)-HYDROXYMANDELO
NITRILE LYASE CHAIN
B

(Sorghum
bicolor;
Sorghum bicolor) 		PF00450
(Peptidase_S10)
PF00450
(Peptidase_S10) 		3 HIS B 414
GLU A  76
ASN A  61
 DKA  A 701 (-4.0A)
None
DKA  A 701 (-3.8A)
 0.95A 5wbvA-1gxsB:
0.0		 5wbvA-1gxsB:
19.32
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.
1iqo HYPOTHETICAL PROTEIN
MTH1880

(Methanothermobacter) 		PF05370
(DUF749) 		3 HIS A  87
GLU A  39
ASN A  60
 None
 0.97A 5wbvA-1iqoA:
undetectable		 5wbvA-1iqoA:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1k77 HYPOTHETICAL PROTEIN
YGBM

(Escherichia
coli) 		PF01261
(AP_endonuc_2) 		3 HIS A 202
GLU A 143
ASN A  60
 None
MG  A 300 ( 2.7A)
None
 0.79A 5wbvA-1k77A:
undetectable		 5wbvA-1k77A:
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.
1ofm CHONDROITINASE B

(Pedobacter
heparinus) 		PF14592
(Chondroitinas_B) 		3 HIS A 272
GLU A 245
ASN A 213
 None
ASG  A 608 (-3.7A)
None
 0.93A 5wbvA-1ofmA:
0.0		 5wbvA-1ofmA:
19.79
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.
1q47 SEMAPHORIN 3A

(Mus musculus) 		PF01403
(Sema) 		3 HIS A 515
GLU A 478
ASN A  44
 None
 0.92A 5wbvA-1q47A:
0.0		 5wbvA-1q47A:
19.00
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.
1rtw TRANSCRIPTIONAL
ACTIVATOR, PUTATIVE

(Pyrococcus
furiosus) 		PF03070
(TENA_THI-4) 		3 HIS A  20
GLU A  25
ASN A  35
 None
 1.02A 5wbvA-1rtwA:
0.0		 5wbvA-1rtwA:
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.
1tuu ACETATE KINASE

(Methanosarcina
thermophila) 		PF00871
(Acetate_kinase) 		3 HIS A 180
GLU A 384
ASN A   7
 SO4  A 400 (-3.9A)
None
None
 0.91A 5wbvA-1tuuA:
undetectable		 5wbvA-1tuuA:
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.
1ujn DEHYDROQUINATE
SYNTHASE

(Thermus
thermophilus) 		PF01761
(DHQ_synthase) 		3 HIS A 243
GLU A  62
ASN A 141
 None
 0.87A 5wbvA-1ujnA:
undetectable		 5wbvA-1ujnA:
19.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ujn DEHYDROQUINATE
SYNTHASE

(Thermus
thermophilus) 		PF01761
(DHQ_synthase) 		3 HIS A 247
GLU A  62
ASN A 141
 None
 0.75A 5wbvA-1ujnA:
undetectable		 5wbvA-1ujnA:
19.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vgq FORMYL-COENZYME A
TRANSFERASE

(Oxalobacter
formigenes) 		PF02515
(CoA_transf_3) 		3 HIS A 404
GLU A 411
ASN A  32
 None
 0.95A 5wbvA-1vgqA:
undetectable		 5wbvA-1vgqA:
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.
1vsg VARIANT SURFACE
GLYCOPROTEIN MITAT
1.2

(Trypanosoma
brucei) 		PF00913
(Trypan_glycop) 		3 HIS A  71
GLU A 313
ASN A 306
 None
NAG  A 366 (-3.5A)
None
 0.92A 5wbvA-1vsgA:
undetectable		 5wbvA-1vsgA:
21.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wyt GLYCINE
DEHYDROGENASE
(DECARBOXYLATING)
SUBUNIT 1
GLYCINE
DEHYDROGENASE
SUBUNIT 2
(P-PROTEIN)

(Thermus
thermophilus;
Thermus
thermophilus) 		PF02347
(GDC-P)
PF02347
(GDC-P) 		3 HIS B 166
GLU B 136
ASN A 318
 None
 0.78A 5wbvA-1wytB:
undetectable		 5wbvA-1wytB:
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.
2a5v CARBONIC ANHYDRASE
(CARBONATE
DEHYDRATASE)
(CARBONIC
DEHYDRATASE)

(Mycobacterium
tuberculosis) 		PF00484
(Pro_CA) 		3 HIS A 104
GLU A 153
ASN A 111
 ZN  A 401 ( 3.3A)
None
None
 0.96A 5wbvA-2a5vA:
undetectable		 5wbvA-2a5vA:
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.
2d3a GLUTAMINE SYNTHETASE

(Zea mays) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		3 HIS A 249
GLU A 192
ASN A 244
 MN  A1002 ( 3.5A)
MN  A1003 ( 3.0A)
P3S  A5001 ( 4.7A)
 1.01A 5wbvA-2d3aA:
undetectable		 5wbvA-2d3aA:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2eql HORSE MILK LYSOZYME

(Equus caballus) 		PF00062
(Lys) 		3 HIS A 114
GLU A  33
ASN A  37
 None
 1.00A 5wbvA-2eqlA:
undetectable		 5wbvA-2eqlA:
17.22
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.
2fl3 R.HINP1I RESTRICTION
ENDONUCLEASE

(Haemophilus
influenzae) 		PF11463
(R-HINP1I) 		3 HIS A 118
GLU A 145
ASN A 111
 None
 0.92A 5wbvA-2fl3A:
undetectable		 5wbvA-2fl3A:
22.67
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.
2kld POLYCYSTIN-2

(Homo sapiens) 		no annotation 3 HIS A 775
GLU A 774
ASN A 737
 None
 1.01A 5wbvA-2kldA:
undetectable		 5wbvA-2kldA:
18.32
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.
2qjj MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Novosphingobium
aromaticivorans) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 HIS A 343
GLU A 169
ASN A  37
 None
 0.97A 5wbvA-2qjjA:
undetectable		 5wbvA-2qjjA:
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.
2rjt BETA-KETOACYL-ACP
SYNTHASE II

(Streptococcus
pneumoniae) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		3 HIS A 337
GLU A 346
ASN A 168
 None
 0.98A 5wbvA-2rjtA:
undetectable		 5wbvA-2rjtA:
19.91
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.
2uu7 GLUTAMINE SYNTHETASE

(Canis lupus) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		3 HIS A 253
GLU A 196
ASN A 248
 None
MG  A 401 (-3.2A)
None
 0.92A 5wbvA-2uu7A:
undetectable		 5wbvA-2uu7A:
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.
2w48 SORBITOL OPERON
REGULATOR

(Klebsiella
pneumoniae) 		PF04198
(Sugar-bind)
PF13936
(HTH_38) 		3 HIS A  98
GLU A  66
ASN A  60
 None
 0.74A 5wbvA-2w48A:
undetectable		 5wbvA-2w48A:
19.34
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.
2wvl MANNOSYL-3-PHOSPHOGL
YCERATE SYNTHASE

(Thermus
thermophilus) 		PF09488
(Osmo_MPGsynth) 		3 HIS A 115
GLU A  96
ASN A  63
 None
 1.00A 5wbvA-2wvlA:
undetectable		 5wbvA-2wvlA:
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.
2x05 EXO-BETA-D-GLUCOSAMI
NIDASE

(Amycolatopsis
orientalis) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		3 HIS A 682
GLU A 623
ASN A 763
 None
 0.95A 5wbvA-2x05A:
undetectable		 5wbvA-2x05A:
12.96
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.
2xh1 KYNURENINE/ALPHA-AMI
NOADIPATE
AMINOTRANSFERASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00155
(Aminotran_1_2) 		3 HIS A  95
GLU A 229
ASN A 199
 None
 0.94A 5wbvA-2xh1A:
undetectable		 5wbvA-2xh1A:
18.31
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.
2yqh UDP-N-ACETYLGLUCOSAM
INE
PYROPHOSPHORYLASE

(Candida
albicans) 		PF01704
(UDPGP) 		3 HIS A 363
GLU A 391
ASN A 227
 None
None
GN1  A1001 (-3.1A)
 0.94A 5wbvA-2yqhA:
undetectable		 5wbvA-2yqhA:
18.31
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.
2zu8 MANNOSYL-3-PHOSPHOGL
YCERATE SYNTHASE

(Pyrococcus
horikoshii) 		PF09488
(Osmo_MPGsynth) 		3 HIS A 116
GLU A  97
ASN A  61
 None
 0.96A 5wbvA-2zu8A:
undetectable		 5wbvA-2zu8A:
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.
3aux DNA DOUBLE-STRAND
BREAK REPAIR RAD50
ATPASE

(Methanocaldococcus
jannaschii) 		PF13476
(AAA_23) 		3 HIS A 979
GLU A 947
ASN A  34
 None
None
ADP  A1006 ( 4.8A)
 1.01A 5wbvA-3auxA:
undetectable		 5wbvA-3auxA:
22.19
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.
3c49 POLY(ADP-RIBOSE)
POLYMERASE 3

(Homo sapiens) 		PF00644
(PARP)
PF02877
(PARP_reg) 		3 HIS A 434
GLU A 530
ASN A 195
 None
 0.94A 5wbvA-3c49A:
undetectable		 5wbvA-3c49A:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3clh 3-DEHYDROQUINATE
SYNTHASE

(Helicobacter
pylori) 		PF01761
(DHQ_synthase) 		3 HIS A 248
GLU A  63
ASN A 142
 ZN  A 344 (-2.9A)
NAD  A 400 (-2.7A)
NAD  A 400 (-3.0A)
 0.75A 5wbvA-3clhA:
undetectable		 5wbvA-3clhA:
20.22
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.
3cne PUTATIVE PROTEASE I

(Bacteroides
thetaiotaomicron) 		PF01965
(DJ-1_PfpI) 		3 HIS A 131
GLU A 160
ASN A  46
 None
 1.01A 5wbvA-3cneA:
undetectable		 5wbvA-3cneA:
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.
3fn9 PUTATIVE
BETA-GALACTOSIDASE

(Bacteroides
fragilis) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N) 		3 HIS A 324
GLU A 503
ASN A 418
 None
 0.94A 5wbvA-3fn9A:
undetectable		 5wbvA-3fn9A:
16.50
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.
3ga3 INTERFERON-INDUCED
HELICASE C
DOMAIN-CONTAINING
PROTEIN 1, MDA5

(Homo sapiens) 		PF11648
(RIG-I_C-RD) 		3 HIS A1021
GLU A1017
ASN A1012
 None
 1.02A 5wbvA-3ga3A:
undetectable		 5wbvA-3ga3A:
18.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iie 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE

(Yersinia
pseudotuberculosis) 		PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C) 		3 HIS A 153
GLU A 152
ASN A 227
 None
MG  A 501 (-2.4A)
MG  A 501 ( 4.1A)
 0.89A 5wbvA-3iieA:
undetectable		 5wbvA-3iieA:
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.
3l5a NADH/FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE

(Staphylococcus
aureus) 		PF00724
(Oxidored_FMN) 		3 HIS A 191
GLU A 206
ASN A 146
 None
 0.64A 5wbvA-3l5aA:
undetectable		 5wbvA-3l5aA:
19.63
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.
3lg5 EPI-ISOZIZAENE
SYNTHASE

(Streptomyces
coelicolor) 		no annotation 3 HIS A 264
GLU A 189
ASN A 178
 None
 0.91A 5wbvA-3lg5A:
undetectable		 5wbvA-3lg5A:
19.59
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.
3mti RRNA METHYLASE

(Streptococcus
thermophilus) 		PF06962
(rRNA_methylase) 		3 HIS A 109
GLU A 113
ASN A  78
 None
 0.96A 5wbvA-3mtiA:
undetectable		 5wbvA-3mtiA:
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.
3mx8 RIBONUCLEASE
PANCREATIC, LINKER,
RIBONUCLEASE
PANCREATIC

(Bos taurus) 		PF00074
(RnaseA) 		3 HIS A 176
GLU A 177
ASN A 231
 None
 1.01A 5wbvA-3mx8A:
undetectable		 5wbvA-3mx8A:
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.
3ng0 GLUTAMINE SYNTHETASE

(Synechocystis
sp. PCC 6803) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		3 HIS A 272
GLU A 215
ASN A 267
 MN  A 477 (-3.2A)
MN  A 475 (-3.1A)
None
 0.92A 5wbvA-3ng0A:
undetectable		 5wbvA-3ng0A:
19.57
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.
3ngf AP ENDONUCLEASE,
FAMILY 2

(Brucella
abortus) 		PF01261
(AP_endonuc_2) 		3 HIS A 201
GLU A 142
ASN A  60
 None
MN  A 262 (-2.6A)
None
 0.91A 5wbvA-3ngfA:
undetectable		 5wbvA-3ngfA:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3no4 CREATININE
AMIDOHYDROLASE

(Nostoc
punctiforme) 		PF02633
(Creatininase) 		3 HIS A   4
GLU A  45
ASN A  64
 None
 0.88A 5wbvA-3no4A:
undetectable		 5wbvA-3no4A:
19.08
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.
3o8l 6-PHOSPHOFRUCTOKINAS
E, MUSCLE TYPE

(Oryctolagus
cuniculus) 		PF00365
(PFK) 		3 HIS A 734
GLU A 597
ASN A 628
 None
 1.00A 5wbvA-3o8lA:
undetectable		 5wbvA-3o8lA:
16.03
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.
3okf 3-DEHYDROQUINATE
SYNTHASE

(Vibrio cholerae) 		PF01761
(DHQ_synthase) 		3 HIS A 268
GLU A  77
ASN A 156
 None
NAD  A 367 (-3.0A)
NAD  A 367 ( 3.5A)
 0.51A 5wbvA-3okfA:
undetectable		 5wbvA-3okfA:
20.65
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.
3p1u SUSD HOMOLOG

(Parabacteroides
distasonis) 		PF12741
(SusD-like) 		3 HIS A 383
GLU A 380
ASN A 250
 None
 0.99A 5wbvA-3p1uA:
undetectable		 5wbvA-3p1uA:
19.09
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.
3qki GLUCOSE-6-PHOSPHATE
ISOMERASE

(Plasmodium
falciparum) 		PF00342
(PGI) 		3 HIS A 122
GLU A 103
ASN A 320
 None
 0.91A 5wbvA-3qkiA:
undetectable		 5wbvA-3qkiA:
17.63
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.
3qki GLUCOSE-6-PHOSPHATE
ISOMERASE

(Plasmodium
falciparum) 		PF00342
(PGI) 		3 HIS A 122
GLU A 119
ASN A 106
 None
 0.74A 5wbvA-3qkiA:
undetectable		 5wbvA-3qkiA:
17.63
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.
3thu MANDELATE RACEMASE /
MUCONATE LACTONIZING
ENZYME FAMILY
PROTEIN

(Sphingomonas
sp. SKA58) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 HIS A 344
GLU A 170
ASN A  38
 None
None
GOL  A 406 (-3.7A)
 0.98A 5wbvA-3thuA:
undetectable		 5wbvA-3thuA:
18.54
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.
3u0f BETA-KETOACYL
SYNTHASE

(Brucella
abortus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		3 HIS A 333
GLU A 342
ASN A 165
 None
NA  A 410 (-3.1A)
None
 0.94A 5wbvA-3u0fA:
undetectable		 5wbvA-3u0fA:
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.
3usc HYDROGENASE-1 LARGE
CHAIN

(Escherichia
coli) 		PF00374
(NiFeSe_Hases) 		3 HIS L 351
GLU L 549
ASN L  45
 None
 1.01A 5wbvA-3uscL:
undetectable		 5wbvA-3uscL:
17.01
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.
3vcn MANNONATE
DEHYDRATASE

(Caulobacter
vibrioides) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 HIS A 344
GLU A 170
ASN A  38
 None
None
GOL  A 502 (-3.8A)
 0.94A 5wbvA-3vcnA:
undetectable		 5wbvA-3vcnA:
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.
3vrb FLAVOPROTEIN SUBUNIT
OF COMPLEX II
IRON-SULFUR SUBUNIT
OF SUCCINATE
DEHYDROGENASE

(Ascaris suum;
Ascaris suum) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C)
PF13085
(Fer2_3)
PF13534
(Fer4_17) 		3 HIS A 250
GLU A 545
ASN B  77
 None
 0.93A 5wbvA-3vrbA:
undetectable		 5wbvA-3vrbA:
16.72
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.
3w57 C2 DOMAIN PROTEIN

(Scophthalmus
maximus) 		PF00168
(C2) 		3 HIS A  87
GLU A  55
ASN A  52
 None
 0.98A 5wbvA-3w57A:
undetectable		 5wbvA-3w57A:
18.25
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.
3wfa ALPHA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF10566
(Glyco_hydro_97)
PF14508
(GH97_N)
PF14509
(GH97_C) 		3 HIS A 255
GLU A 245
ASN A 487
 None
 0.99A 5wbvA-3wfaA:
undetectable		 5wbvA-3wfaA:
17.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4au7 HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H2

(Mus musculus) 		PF00856
(SET) 		3 HIS A  32
GLU A 117
ASN A 182
 SAH  A1247 (-3.6A)
SAH  A1247 (-2.8A)
SAH  A1247 (-3.1A)
 0.34A 5wbvA-4au7A:
33.3		 5wbvA-4au7A:
60.00
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.
4az3 LYSOSOMAL PROTECTIVE
PROTEIN 32 KDA CHAIN
LYSOSOMAL PROTECTIVE
PROTEIN 20 KDA CHAIN

(Homo sapiens;
Homo sapiens) 		PF00450
(Peptidase_S10)
PF00450
(Peptidase_S10) 		3 HIS B 429
GLU A  69
ASN A  55
 S35  A1259 ( 3.9A)
None
S35  A1259 ( 3.7A)
 0.96A 5wbvA-4az3B:
undetectable		 5wbvA-4az3B:
21.01
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.
4bax GLUTAMINE SYNTHETASE

(Streptomyces
coelicolor) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		3 HIS A 237
GLU A 180
ASN A 232
 None
 0.87A 5wbvA-4baxA:
undetectable		 5wbvA-4baxA:
22.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4be3 ALGINATE LYASE,
FAMILY PL7

(Zobellia
galactanivorans) 		PF08787
(Alginate_lyase2) 		3 HIS A 149
GLU A 179
ASN A 186
 SRT  A 400 (-3.4A)
None
None
 1.01A 5wbvA-4be3A:
undetectable		 5wbvA-4be3A:
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.
4c6s PROBABLE WRKY
TRANSCRIPTION FACTOR
52

(Arabidopsis
thaliana) 		no annotation 3 HIS A 146
GLU A   9
ASN A  91
 None
 0.91A 5wbvA-4c6sA:
undetectable		 5wbvA-4c6sA:
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.
4ce4 MRPL22
MRPL39

(Sus scrofa;
Sus scrofa) 		PF00237
(Ribosomal_L22)
no annotation 		3 HIS c  91
GLU W 133
ASN W 131
 None
 0.91A 5wbvA-4ce4c:
undetectable		 5wbvA-4ce4c:
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.
4cem REGULATOR OF
NONSENSE TRANSCRIPTS
2

(Homo sapiens) 		PF02854
(MIF4G) 		3 HIS A 314
GLU A 271
ASN A 220
 None
 0.98A 5wbvA-4cemA:
undetectable		 5wbvA-4cemA:
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.
4fi4 MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Caulobacter sp.
K31) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 HIS A 344
GLU A 170
ASN A  38
 None
None
GOL  A 502 (-3.8A)
 0.97A 5wbvA-4fi4A:
undetectable		 5wbvA-4fi4A:
19.58
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.
4i7i RYANODINE RECEPTOR 1

(Oryctolagus
cuniculus) 		PF01365
(RYDR_ITPR)
PF02815
(MIR)
PF08709
(Ins145_P3_rec) 		3 HIS A 255
GLU A 397
ASN A 473
 None
 1.02A 5wbvA-4i7iA:
undetectable		 5wbvA-4i7iA:
18.93
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.
4it1 PUTATIVE GLUCARATE
DEHYDRATASE

(Pseudomonas
fluorescens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 HIS A 320
GLU A 246
ASN A 223
 None
MG  A 501 (-2.8A)
TLA  A 502 (-3.7A)
 0.97A 5wbvA-4it1A:
undetectable		 5wbvA-4it1A:
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.
4jhz BETA-GLUCURONIDASE

(Escherichia
coli) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N) 		3 HIS A 296
GLU A 504
ASN A 412
 None
 0.98A 5wbvA-4jhzA:
undetectable		 5wbvA-4jhzA:
17.64
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.
4jkl BETA-GLUCURONIDASE

(Streptococcus
agalactiae) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N) 		3 HIS A 295
GLU A 501
ASN A 407
 None
 0.98A 5wbvA-4jklA:
undetectable		 5wbvA-4jklA:
17.60
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.
4lnf GLUTAMINE SYNTHETASE

(Bacillus
subtilis) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		3 HIS A 245
GLU A 189
ASN A 240
 PO4  A 504 ( 3.1A)
GLN  A 503 ( 2.7A)
GLN  A 503 (-4.6A)
 0.98A 5wbvA-4lnfA:
undetectable		 5wbvA-4lnfA:
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.
4n0r PUTATIVE GLYCOSIDE
HYDROLASE

(Bacteroides
vulgatus) 		PF13204
(DUF4038)
PF16586
(DUF5060) 		3 HIS A 303
GLU A 228
ASN A 223
 None
 0.79A 5wbvA-4n0rA:
undetectable		 5wbvA-4n0rA:
21.79
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.
4nov XYLOSIDASE/ARABINOFU
RANOSIDASE XSA43E

(Butyrivibrio
proteoclasticus) 		PF04616
(Glyco_hydro_43) 		3 HIS A 258
GLU A 227
ASN A 158
 CA  A 401 (-3.7A)
None
None
 0.84A 5wbvA-4novA:
undetectable		 5wbvA-4novA:
19.50
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.
4uwa RYANODINE RECEPTOR 1

(Oryctolagus
cuniculus) 		PF00622
(SPRY)
PF01365
(RYDR_ITPR)
PF02026
(RyR)
PF02815
(MIR)
PF08709
(Ins145_P3_rec) 		3 HIS A 255
GLU A 397
ASN A 473
 None
 0.89A 5wbvA-4uwaA:
undetectable		 5wbvA-4uwaA:
5.58
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.
4xjx HSDR

(Escherichia
coli) 		PF04313
(HSDR_N)
PF04851
(ResIII)
PF12008
(EcoR124_C) 		3 HIS A 181
GLU A 186
ASN A 214
 None
 1.00A 5wbvA-4xjxA:
undetectable		 5wbvA-4xjxA:
13.84
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.
4xwi 3-DEOXY-MANNO-OCTULO
SONATE
CYTIDYLYLTRANSFERASE

(Pseudomonas
aeruginosa) 		PF02348
(CTP_transf_3) 		3 HIS A 134
GLU A 131
ASN A 234
 None
 1.00A 5wbvA-4xwiA:
undetectable		 5wbvA-4xwiA:
19.21
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.
5axh DEXTRANASE

(Thermoanaerobacter
pseudethanolicus) 		PF13199
(Glyco_hydro_66) 		3 HIS A 190
GLU A 297
ASN A 234
 GLC  A 703 ( 4.0A)
None
None
 1.02A 5wbvA-5axhA:
undetectable		 5wbvA-5axhA:
18.07
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.
5brr TISSUE-TYPE
PLASMINOGEN
ACTIVATOR

(Homo sapiens) 		PF00089
(Trypsin) 		3 HIS E 144
GLU E 145
ASN E 186
 PGE  E 305 (-4.3A)
None
None
 0.96A 5wbvA-5brrE:
undetectable		 5wbvA-5brrE:
19.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5cpr HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1

(Homo sapiens) 		PF00856
(SET) 		3 HIS B  98
GLU B 206
ASN B 272
 SAM  B 402 (-3.7A)
SAM  B 402 (-2.9A)
SAM  B 402 (-3.1A)
 0.22A 5wbvA-5cprB:
37.6		 5wbvA-5cprB:
97.80
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.
5dny DNA DOUBLE-STRAND
BREAK REPAIR PROTEIN
MRE11

(Methanocaldococcus
jannaschii) 		PF00149
(Metallophos) 		3 HIS A   0
GLU A 118
ASN A 232
 None
 0.72A 5wbvA-5dnyA:
undetectable		 5wbvA-5dnyA:
21.01
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.
5e2e BETA-LACTAMASE

(Yersinia
enterocolitica) 		PF13354
(Beta-lactamase2) 		3 HIS A  71
GLU A  98
ASN A  89
 None
 1.02A 5wbvA-5e2eA:
undetectable		 5wbvA-5e2eA:
20.43
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.
5eks 3-DEHYDROQUINATE
SYNTHASE

(Acinetobacter
baumannii) 		PF01761
(DHQ_synthase) 		3 HIS A 263
GLU A  72
ASN A 151
 MG  A 401 (-3.3A)
NAD  A 400 (-3.0A)
NAD  A 400 (-3.4A)
 0.56A 5wbvA-5eksA:
undetectable		 5wbvA-5eksA:
18.80
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.
5f05 PHI CLASS
GLUTATHIONE
TRANSFERASE GSTF5

(Populus
trichocarpa) 		PF00043
(GST_C)
PF02798
(GST_N) 		3 HIS A  46
GLU A  40
ASN A  33
 None
 0.99A 5wbvA-5f05A:
undetectable		 5wbvA-5f05A:
19.32
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.
5fma NEUROGENIC LOCUS
NOTCH HOMOLOG
PROTEIN 1

(Homo sapiens) 		PF00008
(EGF)
PF07645
(EGF_CA) 		3 HIS A 171
GLU A 181
ASN A 197
 None
CA  A1295 (-2.9A)
CA  A1295 (-3.0A)
 1.00A 5wbvA-5fmaA:
undetectable		 5wbvA-5fmaA:
22.38
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.
5fur TRANSCRIPTION
INITIATION FACTOR
TFIID SUBUNIT 2

(Homo sapiens) 		no annotation 3 HIS I 593
GLU I 570
ASN I 599
 None
 0.95A 5wbvA-5furI:
undetectable		 5wbvA-5furI:
11.93
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.
5fyg CYTOCHROME P450

(Marinobacter
hydrocarbonoclasticus) 		PF00067
(p450) 		3 HIS A 412
GLU A 350
ASN A 346
 None
 0.99A 5wbvA-5fygA:
undetectable		 5wbvA-5fygA:
21.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h11 UNCHARACTERIZED
PROTEIN

(Danio rerio) 		PF07393
(Sec10) 		3 HIS A 425
GLU A 422
ASN A 418
 None
None
BR  A 809 ( 4.7A)
 1.00A 5wbvA-5h11A:
undetectable		 5wbvA-5h11A:
18.51
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.
5h7a IMMUNOGLOBULIN
G-BINDING PROTEIN A

(Staphylococcus
aureus) 		no annotation 3 HIS C 138
GLU C 135
ASN C  96
 None
 0.63A 5wbvA-5h7aC:
undetectable		 5wbvA-5h7aC:
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.
5hqn SPHINGOMYELIN
PHOSPHODIESTERASE

(Mus musculus) 		PF00149
(Metallophos) 		3 HIS A 317
GLU A 318
ASN A 381
 PO4  A 710 (-3.7A)
None
None
 0.91A 5wbvA-5hqnA:
undetectable		 5wbvA-5hqnA:
17.92
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.
5hvn 3-DEHYDROQUINATE
SYNTHASE

(Francisella
tularensis) 		PF01761
(DHQ_synthase) 		3 HIS A 264
GLU A  72
ASN A 152
 NAD  A 401 ( 4.6A)
NAD  A 401 (-2.6A)
NAD  A 401 (-3.5A)
 0.69A 5wbvA-5hvnA:
undetectable		 5wbvA-5hvnA:
22.37
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.
5i85 SPHINGOMYELIN
PHOSPHODIESTERASE

(Homo sapiens) 		PF00149
(Metallophos) 		3 HIS A 319
GLU A 320
ASN A 383
 PC  A 727 (-3.7A)
None
None
 0.95A 5wbvA-5i85A:
undetectable		 5wbvA-5i85A:
17.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ijz NADP-SPECIFIC
GLUTAMATE
DEHYDROGENASE

(Corynebacterium
glutamicum) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		3 HIS A  25
GLU A  23
ASN A 102
 None
 0.88A 5wbvA-5ijzA:
undetectable		 5wbvA-5ijzA:
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.
5iry DESMOCOLLIN-1

(Homo sapiens) 		PF00028
(Cadherin) 		3 HIS A 142
GLU A  69
ASN A  12
 None
CA  A 614 ( 2.9A)
CA  A 605 ( 3.9A)
 0.89A 5wbvA-5iryA:
undetectable		 5wbvA-5iryA:
18.86
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.
5iry DESMOCOLLIN-1

(Homo sapiens) 		PF00028
(Cadherin) 		3 HIS A 253
GLU A 179
ASN A 120
 None
CA  A 616 ( 2.6A)
CA  A 615 (-2.2A)
 0.93A 5wbvA-5iryA:
undetectable		 5wbvA-5iryA:
18.86
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.
5kja APOCAROTENOID-15,15'
-OXYGENASE

(Synechocystis
sp. PCC 6803) 		PF03055
(RPE65) 		3 HIS A 304
GLU A 426
ASN A 137
 FE2  A 502 (-3.8A)
None
None
 0.90A 5wbvA-5kjaA:
undetectable		 5wbvA-5kjaA:
20.33
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.
5ldf GLUTAMINE SYNTHETASE

(Salmonella
enterica) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		3 HIS A 269
GLU A 212
ASN A 264
 None
 0.97A 5wbvA-5ldfA:
undetectable		 5wbvA-5ldfA:
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.
5uj6 GLYCOSYL HYDROLASES
FAMILY 2, SUGAR
BINDING DOMAIN
PROTEIN

(Bacteroides
uniformis) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF11721
(Malectin)
PF16355
(DUF4982) 		3 HIS A 329
GLU A 526
ASN A 425
 None
GOL  A 901 (-2.2A)
GOL  A 901 (-3.2A)
 0.99A 5wbvA-5uj6A:
undetectable		 5wbvA-5uj6A:
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.
5v4b F-BOX/WD
REPEAT-CONTAINING
PROTEIN 7

(Homo sapiens) 		PF00400
(WD40)
PF12937
(F-box-like) 		3 HIS B2359
GLU B2328
ASN B2635
 None
 0.95A 5wbvA-5v4bB:
undetectable		 5wbvA-5v4bB:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6az6 GNTR FAMILY
TRANSCRIPTIONAL
REGULATOR

(Streptococcus
agalactiae) 		no annotation 3 HIS A 212
GLU A 102
ASN A 167
 None
 0.94A 5wbvA-6az6A:
undetectable		 5wbvA-6az6A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6bo6 -

(-) 		no annotation 3 HIS A 309
GLU A 516
ASN A 424
 None
E0V  A 701 (-2.6A)
E0V  A 701 (-3.3A)
 1.01A 5wbvA-6bo6A:
undetectable		 5wbvA-6bo6A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c5c 3-DEHYDROQUINATE
SYNTHASE

(Candida
albicans) 		no annotation 3 HIS A 280
GLU A  80
ASN A 159
 None
NAD  A 401 (-2.7A)
NAD  A 401 (-3.2A)
 0.78A 5wbvA-6c5cA:
undetectable		 5wbvA-6c5cA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c66 CRISPR-ASSOCIATED
HELICASE, CAS3
FAMILY

(Thermobifida
fusca) 		no annotation 3 HIS G  74
GLU G  69
ASN G  50
 None
 0.98A 5wbvA-6c66G:
undetectable		 5wbvA-6c66G:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6erc PEROXINECTIN A

(Dictyostelium
discoideum) 		no annotation 3 HIS A  87
GLU A  86
ASN A 375
 None
 1.02A 5wbvA-6ercA:
undetectable		 5wbvA-6ercA:
undetectable