SIMILAR PATTERNS OF AMINO ACIDS FOR 4Z4I_A_IPHA903_0

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.
1e6v METHYL-COENZYME M
REDUCTASE I BETA
SUBUNIT

(Methanopyrus
kandleri) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		3 VAL B  47
ALA B 177
PHE B 420
 None
 0.91A 4z4iA-1e6vB:
undetectable		 4z4iA-1e6vB:
20.48
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.
1eep INOSINE
5'-MONOPHOSPHATE
DEHYDROGENASE

(Borreliella
burgdorferi) 		PF00478
(IMPDH) 		3 VAL A 271
ALA A 261
PHE A  12
 None
 0.91A 4z4iA-1eepA:
undetectable		 4z4iA-1eepA:
18.71
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.
1g0u PROTEASOME COMPONENT
PUP2

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome)
PF10584
(Proteasome_A_N) 		3 VAL D  68
ALA D  77
PHE D 221
 None
 0.69A 4z4iA-1g0uD:
undetectable		 4z4iA-1g0uD:
14.53
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.
1h39 SQUALENE--HOPENE
CYCLASE

(Alicyclobacillus
acidocaldarius) 		PF13243
(SQHop_cyclase_C)
PF13249
(SQHop_cyclase_N) 		3 VAL A 382
ALA A 399
PHE A 363
 None
 0.77A 4z4iA-1h39A:
undetectable		 4z4iA-1h39A:
20.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hwn EBULIN

(Sambucus ebulus) 		PF00161
(RIP) 		3 VAL A 150
ALA A 123
PHE A 112
 None
 0.87A 4z4iA-1hwnA:
undetectable		 4z4iA-1hwnA:
15.67
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.
1oll NK RECEPTOR

(Homo sapiens) 		no annotation 3 VAL A 147
ALA A 125
PHE A 129
 None
 0.88A 4z4iA-1ollA:
undetectable		 4z4iA-1ollA:
12.80
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.
1pvm CONSERVED
HYPOTHETICAL PROTEIN
TA0289

(Thermoplasma
acidophilum) 		PF00571
(CBS)
PF09151
(DUF1936) 		3 VAL A 113
ALA A 104
PHE A  13
 None
 0.88A 4z4iA-1pvmA:
undetectable		 4z4iA-1pvmA:
11.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ru4 PECTATE LYASE

(Dickeya
chrysanthemi) 		PF13229
(Beta_helix) 		3 VAL A 289
ALA A 252
PHE A 298
 None
 0.90A 4z4iA-1ru4A:
0.0		 4z4iA-1ru4A:
18.45
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.
1ry4 CG5884-PA

(Drosophila
melanogaster) 		PF00595
(PDZ) 		3 VAL A 145
ALA A 147
PHE A 142
 None
 0.81A 4z4iA-1ry4A:
undetectable		 4z4iA-1ry4A:
10.27
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.
1sml PROTEIN
(PENICILLINASE)

(Stenotrophomonas
maltophilia) 		PF00753
(Lactamase_B) 		3 VAL A 139
ALA A 108
PHE A 156
 None
 0.79A 4z4iA-1smlA:
undetectable		 4z4iA-1smlA:
15.39
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.
1sp8 4-HYDROXYPHENYLPYRUV
ATE DIOXYGENASE

(Zea mays) 		PF00903
(Glyoxalase) 		3 VAL A 299
ALA A 134
PHE A 290
 None
 0.55A 4z4iA-1sp8A:
undetectable		 4z4iA-1sp8A:
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.
1ux7 ENDO-1,4-BETA-XYLANA
SE D

(Paenibacillus
polymyxa) 		PF03422
(CBM_6) 		3 VAL A 124
ALA A  38
PHE A  34
 None
 0.91A 4z4iA-1ux7A:
undetectable		 4z4iA-1ux7A:
9.95
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.
1wkm METHIONINE
AMINOPEPTIDASE

(Pyrococcus
furiosus) 		PF00557
(Peptidase_M24) 		3 VAL A  83
ALA A  92
PHE A  50
 None
None
MET  A1298 (-3.8A)
 0.90A 4z4iA-1wkmA:
undetectable		 4z4iA-1wkmA:
15.87
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.
1xmb IAA-AMINO ACID
HYDROLASE HOMOLOG 2

(Arabidopsis
thaliana) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		3 VAL A 364
ALA A 362
PHE A 295
 None
 0.82A 4z4iA-1xmbA:
undetectable		 4z4iA-1xmbA:
20.97
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.
1yzp PEROXIDASE
MANGANESE-DEPENDENT
I

(Phanerochaete
chrysosporium) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		3 VAL A 137
ALA A 135
PHE A  77
 None
 0.65A 4z4iA-1yzpA:
undetectable		 4z4iA-1yzpA:
17.43
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.
1zoi ESTERASE

(Pseudomonas
putida) 		PF00561
(Abhydrolase_1) 		3 VAL A 219
ALA A 247
PHE A 273
 None
 0.85A 4z4iA-1zoiA:
2.4		 4z4iA-1zoiA:
15.86
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.
2e7u GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE

(Thermus
thermophilus) 		PF00202
(Aminotran_3) 		3 VAL A 214
ALA A 212
PHE A 360
 None
 0.80A 4z4iA-2e7uA:
2.6		 4z4iA-2e7uA:
20.26
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.
2epj GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE

(Aeropyrum
pernix) 		PF00202
(Aminotran_3) 		3 VAL A 218
ALA A 216
PHE A 364
 None
 0.74A 4z4iA-2epjA:
2.3		 4z4iA-2epjA:
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.
2fvm DIHYDROPYRIMIDINASE

(Lachancea
kluyveri) 		PF01979
(Amidohydro_1) 		3 VAL A  63
ALA A  61
PHE A  97
 None
None
KCX  A 167 ( 4.5A)
 0.85A 4z4iA-2fvmA:
undetectable		 4z4iA-2fvmA:
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.
2g39 ACETYL-COA HYDROLASE

(Pseudomonas
aeruginosa) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		3 VAL A 427
ALA A 433
PHE A 360
 None
 0.90A 4z4iA-2g39A:
undetectable		 4z4iA-2g39A:
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.
2gh9 MALTOSE/MALTODEXTRIN
-BINDING PROTEIN

(Thermus
thermophilus) 		PF13416
(SBP_bac_8) 		3 VAL A 273
ALA A 275
PHE A  46
 None
 0.83A 4z4iA-2gh9A:
undetectable		 4z4iA-2gh9A:
17.96
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.
2iic ALPHA-11 GIARDIN

(Giardia
intestinalis) 		no annotation 3 VAL A  96
ALA A 100
PHE A 259
 None
 0.91A 4z4iA-2iicA:
undetectable		 4z4iA-2iicA:
15.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2liv LEUCINE

(Escherichia
coli) 		PF13458
(Peripla_BP_6) 		3 VAL A   8
ALA A  10
PHE A  23
 None
 0.79A 4z4iA-2livA:
4.9		 4z4iA-2livA:
16.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2lm5 CALCIUM AND
INTEGRIN-BINDING
PROTEIN 1

(Homo sapiens) 		PF13499
(EF-hand_7) 		3 VAL A 190
ALA A 111
PHE A  98
 None
 0.84A 4z4iA-2lm5A:
undetectable		 4z4iA-2lm5A:
12.41
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.
2msx KUNITZ-TYPE PROTEASE
INHIBITOR 1

(Homo sapiens) 		PF07502
(MANEC) 		3 VAL A 102
ALA A 114
PHE A 117
 None
 0.83A 4z4iA-2msxA:
undetectable		 4z4iA-2msxA:
9.69
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.
2pyh POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE 4

(Azotobacter
vinelandii) 		PF12708
(Pectate_lyase_3) 		3 VAL A 189
ALA A 167
PHE A 198
 None
 0.90A 4z4iA-2pyhA:
undetectable		 4z4iA-2pyhA:
17.87
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.
2rgt FUSION OF
LIM/HOMEOBOX PROTEIN
LHX3, LINKER,
INSULIN GENE
ENHANCER PROTEIN
ISL-1

(Mus musculus;
synthetic
construct) 		PF00412
(LIM) 		3 VAL A 266
ALA A 268
PHE A 134
 None
 0.88A 4z4iA-2rgtA:
undetectable		 4z4iA-2rgtA:
11.71
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.
2v4j SULFITE REDUCTASE,
DISSIMILATORY-TYPE
SUBUNIT BETA

(Desulfovibrio
vulgaris) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		3 VAL B  67
ALA B  69
PHE B 173
 None
 0.71A 4z4iA-2v4jB:
2.6		 4z4iA-2v4jB:
18.61
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.
2wc1 FLAVODOXIN

(Rhodobacter
capsulatus) 		PF00258
(Flavodoxin_1) 		3 VAL A 179
ALA A 173
PHE A  26
 None
 0.92A 4z4iA-2wc1A:
3.5		 4z4iA-2wc1A:
13.48
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.
2wxu PHOSPHOLIPASE C

(Clostridium
perfringens) 		PF00882
(Zn_dep_PLPC)
PF01477
(PLAT) 		3 VAL A 140
ALA A 142
PHE A  69
 None
 0.92A 4z4iA-2wxuA:
undetectable		 4z4iA-2wxuA:
17.97
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.
2xuz IRON-UPTAKE
SYSTEM-BINDING
PROTEIN

(Bacillus
subtilis) 		PF01497
(Peripla_BP_2) 		3 VAL A  44
ALA A 276
PHE A  71
 None
 0.93A 4z4iA-2xuzA:
3.4		 4z4iA-2xuzA:
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.
2yp1 AROMATIC
PEROXYGENASE

(Agrocybe
aegerita) 		PF01328
(Peroxidase_2) 		3 VAL A 205
ALA A 235
PHE A 232
 None
 0.41A 4z4iA-2yp1A:
undetectable		 4z4iA-2yp1A:
16.61
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.
2yzw ADP-RIBOSYLGLYCOHYDR
OLASE

(Thermus
thermophilus) 		PF03747
(ADP_ribosyl_GH) 		3 VAL A 206
ALA A 189
PHE A 210
 None
 0.88A 4z4iA-2yzwA:
undetectable		 4z4iA-2yzwA:
16.88
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.
3aq0 GERANYL DIPHOSPHATE
SYNTHASE

(Arabidopsis
thaliana) 		PF00348
(polyprenyl_synt) 		3 VAL A  29
ALA A  37
PHE A 137
 None
 0.86A 4z4iA-3aq0A:
undetectable		 4z4iA-3aq0A:
17.14
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.
3bdv UNCHARACTERIZED
PROTEIN DUF1234

(Pectobacterium
atrosepticum) 		PF06821
(Ser_hydrolase) 		3 VAL A 101
ALA A  99
PHE A 182
 None
 0.90A 4z4iA-3bdvA:
5.3		 4z4iA-3bdvA:
12.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bg9 PYRUVATE
CARBOXYLASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00682
(HMGL-like)
PF02436
(PYC_OADA) 		3 VAL A 831
ALA A 798
PHE A 598
 None
 0.71A 4z4iA-3bg9A:
undetectable		 4z4iA-3bg9A:
21.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gfh ETHANOLAMINE
UTILIZATION PROTEIN
EUTL

(Escherichia
coli) 		PF00936
(BMC) 		3 VAL A 152
ALA A 188
PHE A 204
 None
 0.71A 4z4iA-3gfhA:
undetectable		 4z4iA-3gfhA:
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.
3h2u RAVER-1

(Homo sapiens) 		PF00076
(RRM_1) 		3 VAL B 235
ALA B 265
PHE B 232
 None
 0.87A 4z4iA-3h2uB:
3.8		 4z4iA-3h2uB:
17.06
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.
3isr TRANSGLUTAMINASE-LIK
E ENZYMES, PUTATIVE
CYSTEINE PROTEASE

(Cytophaga
hutchinsonii) 		PF01841
(Transglut_core) 		3 VAL A 169
ALA A 167
PHE A 173
 None
 0.93A 4z4iA-3isrA:
undetectable		 4z4iA-3isrA:
16.11
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.
3jzd IRON-CONTAINING
ALCOHOL
DEHYDROGENASE

(Cupriavidus
pinatubonensis) 		PF00465
(Fe-ADH) 		3 VAL A 354
ALA A 309
PHE A 298
 None
 0.71A 4z4iA-3jzdA:
3.4		 4z4iA-3jzdA:
17.89
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.
3ppx VON WILLEBRAND
FACTOR

(Homo sapiens) 		PF00092
(VWA) 		3 VAL A1499
ALA A1602
PHE A1552
 None
NA  A   1 ( 3.9A)
None
 0.64A 4z4iA-3ppxA:
5.5		 4z4iA-3ppxA:
12.10
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.
3q75 FARNESYLTRANSFERASE
BETA SUBUNIT

(Cryptococcus
neoformans) 		PF00432
(Prenyltrans) 		3 VAL B 302
ALA B 334
PHE B 314
 None
 0.75A 4z4iA-3q75B:
undetectable		 4z4iA-3q75B:
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.
3sf6 GLUTARYL-COA
DEHYDROGENASE

(Mycolicibacterium
smegmatis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		3 VAL A  88
ALA A 314
PHE A 259
 None
 0.75A 4z4iA-3sf6A:
undetectable		 4z4iA-3sf6A:
19.88
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.
3sse 5-METHYLCYTOSINE-SPE
CIFIC RESTRICTION
ENZYME B

(Escherichia
coli) 		PF12102
(DUF3578) 		3 VAL A  77
ALA A 123
PHE A 137
 None
 0.86A 4z4iA-3sseA:
undetectable		 4z4iA-3sseA:
11.43
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.
3swo GLUTARYL-COA
DEHYDROGENASE

(Mycolicibacterium
smegmatis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		3 VAL A  85
ALA A 311
PHE A 256
 None
 0.71A 4z4iA-3swoA:
undetectable		 4z4iA-3swoA:
18.45
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.
3uem PROTEIN
DISULFIDE-ISOMERASE

(Homo sapiens) 		PF00085
(Thioredoxin)
PF13848
(Thioredoxin_6) 		3 VAL A 388
ALA A 448
PHE A 445
 None
 0.70A 4z4iA-3uemA:
undetectable		 4z4iA-3uemA:
17.59
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.
3ulk KETOL-ACID
REDUCTOISOMERASE

(Escherichia
coli) 		PF01450
(IlvC)
PF07991
(IlvN) 		3 VAL A 205
ALA A 203
PHE A  22
 VAL  A 205 ( 0.6A)
ALA  A 203 ( 0.0A)
PHE  A  22 ( 1.3A)
 0.87A 4z4iA-3ulkA:
undetectable		 4z4iA-3ulkA:
19.61
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.
3w1s AUTOPHAGY PROTEIN 5

(Saccharomyces
cerevisiae) 		PF04106
(APG5) 		3 VAL A  46
ALA A 134
PHE A  74
 None
 0.77A 4z4iA-3w1sA:
undetectable		 4z4iA-3w1sA:
16.38
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.
3w3s TYPE-2 SERINE--TRNA
LIGASE

(Methanopyrus
kandleri) 		PF00587
(tRNA-synt_2b) 		3 VAL A 370
ALA A 479
PHE A 242
 None
 0.88A 4z4iA-3w3sA:
2.7		 4z4iA-3w3sA:
20.05
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.
3wrv TM-1 PROTEIN

(Solanum
lycopersicum) 		PF06792
(UPF0261) 		3 VAL A 119
ALA A 117
PHE A 191
 None
 0.72A 4z4iA-3wrvA:
4.8		 4z4iA-3wrvA:
13.10
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.
3wry TM-1 PROTEIN

(Solanum
lycopersicum) 		PF06792
(UPF0261) 		3 VAL A 119
ALA A 117
PHE A 191
 None
 0.66A 4z4iA-3wryA:
2.1		 4z4iA-3wryA:
19.84
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.
3zdp NUCLEOCAPSID PROTEIN

(Influenza A
virus) 		PF00506
(Flu_NP) 		3 VAL A 414
ALA A 416
PHE A 458
 None
 0.82A 4z4iA-3zdpA:
undetectable		 4z4iA-3zdpA:
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.
4am3 POLYRIBONUCLEOTIDE
NUCLEOTIDYLTRANSFERA
SE

(Caulobacter
vibrioides) 		PF00013
(KH_1)
PF01138
(RNase_PH)
PF03725
(RNase_PH_C)
PF03726
(PNPase) 		3 VAL A 162
ALA A 160
PHE A 207
 None
 0.87A 4z4iA-4am3A:
undetectable		 4z4iA-4am3A:
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.
4el1 PROTEIN
DISULFIDE-ISOMERASE

(Homo sapiens) 		PF00085
(Thioredoxin)
PF13848
(Thioredoxin_6) 		3 VAL A 388
ALA A 448
PHE A 445
 None
 0.73A 4z4iA-4el1A:
undetectable		 4z4iA-4el1A:
18.01
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.
4em8 RIBOSE 5-PHOSPHATE
ISOMERASE B

(Anaplasma
phagocytophilum) 		PF02502
(LacAB_rpiB) 		3 VAL A 104
ALA A  85
PHE A 124
 None
 0.75A 4z4iA-4em8A:
3.1		 4z4iA-4em8A:
11.29
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.
4f3n UNCHARACTERIZED ACR,
COG1565 SUPERFAMILY

(Burkholderia
thailandensis) 		PF02636
(Methyltransf_28) 		3 VAL A 119
ALA A 148
PHE A 185
 None
 0.93A 4z4iA-4f3nA:
undetectable		 4z4iA-4f3nA:
18.21
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.
4gpg PROTEASE 1

(Achromobacter
lyticus) 		PF00089
(Trypsin) 		3 VAL A  25
ALA A  27
PHE A  52
 None
 0.85A 4z4iA-4gpgA:
undetectable		 4z4iA-4gpgA:
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.
4grh AMINODEOXYCHORISMATE
SYNTHASE

(Stenotrophomonas
maltophilia) 		PF00425
(Chorismate_bind)
PF04715
(Anth_synt_I_N) 		3 VAL A 253
ALA A 242
PHE A 393
 None
 0.92A 4z4iA-4grhA:
undetectable		 4z4iA-4grhA:
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.
4hst GLUTARYL-7-AMINOCEPH
ALOSPORANIC ACID
ACYLASE BETA CHAIN

(Pseudomonas) 		PF01804
(Penicil_amidase) 		3 VAL B 279
ALA B  19
PHE B 277
 None
 0.77A 4z4iA-4hstB:
undetectable		 4z4iA-4hstB:
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.
4i1f E3 UBIQUITIN-PROTEIN
LIGASE PARKIN

(Homo sapiens) 		PF01485
(IBR) 		3 VAL A 164
ALA A 172
PHE A 209
 None
 0.91A 4z4iA-4i1fA:
undetectable		 4z4iA-4i1fA:
16.82
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.
4k7d E3 UBIQUITIN-PROTEIN
LIGASE PARKIN

(Rattus
norvegicus) 		PF01485
(IBR) 		3 VAL A 164
ALA A 172
PHE A 209
 None
 0.91A 4z4iA-4k7dA:
undetectable		 4z4iA-4k7dA:
16.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4krf PROTEIN ARGONAUTE-1

(Homo sapiens) 		PF02170
(PAZ)
PF02171
(Piwi)
PF08699
(ArgoL1)
PF16486
(ArgoN)
PF16487
(ArgoMid)
PF16488
(ArgoL2) 		3 VAL A 589
ALA A 618
PHE A 651
 None
 0.16A 4z4iA-4krfA:
55.1		 4z4iA-4krfA:
82.35
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.
4mnm CHITINASE A

(Cycas revoluta) 		PF00704
(Glyco_hydro_18) 		3 VAL A 188
ALA A 158
PHE A 325
 None
 0.75A 4z4iA-4mnmA:
undetectable		 4z4iA-4mnmA:
17.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nsy LYSYL ENDOPEPTIDASE

(Lysobacter
enzymogenes) 		PF13365
(Trypsin_2) 		3 VAL A  25
ALA A  27
PHE A  52
 None
 0.81A 4z4iA-4nsyA:
undetectable		 4z4iA-4nsyA:
14.86
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.
4ofl EXTRACYTOPLASMIC
NICKEL-BINDING
PROTEIN YPYNTA

(Yersinia pestis) 		PF00496
(SBP_bac_5) 		3 VAL A 133
ALA A 135
PHE A  71
 None
 0.48A 4z4iA-4oflA:
undetectable		 4z4iA-4oflA:
20.45
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.
4ose PUTATIVE HYDROLASE

(Rickettsia
typhi) 		PF00561
(Abhydrolase_1) 		3 VAL A 221
ALA A 143
PHE A 140
 None
 0.91A 4z4iA-4oseA:
3.2		 4z4iA-4oseA:
15.96
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.
4p5b THYMIDYLATE SYNTHASE
THYX

(Streptomyces
cacaoi) 		PF02511
(Thy1) 		3 VAL A 237
ALA A 199
PHE A 231
 None
 0.70A 4z4iA-4p5bA:
undetectable		 4z4iA-4p5bA:
14.74
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.
4tlh ETHANOLAMINE
UTILIZATION PROTEIN
EUTL

(Clostridium
perfringens) 		PF00936
(BMC) 		3 VAL A 151
ALA A 187
PHE A 203
 None
 0.75A 4z4iA-4tlhA:
undetectable		 4z4iA-4tlhA:
13.03
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.
4uri CHITINASE-RELATED
AGGLUTININ

(Robinia
pseudoacacia) 		PF00704
(Glyco_hydro_18) 		3 VAL A 182
ALA A 155
PHE A 315
 None
MPD  A 401 (-3.4A)
None
 0.85A 4z4iA-4uriA:
2.3		 4z4iA-4uriA:
17.03
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.
4wts BETA-1,3-GLUCANOSYLT
RANSFERASE

(Rhizomucor
miehei) 		PF00332
(Glyco_hydro_17) 		3 VAL A 134
ALA A 132
PHE A 138
 None
 0.91A 4z4iA-4wtsA:
undetectable		 4z4iA-4wtsA:
17.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zhs ASPARTATE
SEMIALDEHYDE
DEHYDROGENASE

(Trichophyton
rubrum) 		no annotation 3 VAL D  37
ALA D  39
PHE D  77
 None
 0.87A 4z4iA-4zhsD:
3.9		 4z4iA-4zhsD:
17.17
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.
5b5r GASDERMIN-A3

(Mus musculus) 		PF04598
(Gasdermin) 		3 VAL A  54
ALA A  51
PHE A  33
 None
 0.75A 4z4iA-5b5rA:
undetectable		 4z4iA-5b5rA:
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.
5cuv ACIDOCALCISOMAL
PYROPHOSPHATASE

(Trypanosoma
cruzi) 		PF00719
(Pyrophosphatase) 		3 VAL A 310
ALA A 312
PHE A 305
 None
 0.91A 4z4iA-5cuvA:
undetectable		 4z4iA-5cuvA:
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.
5f7s GLYCOSIDE HYDROLASE
FAMILY 31

(Trueperella
pyogenes) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		3 VAL A 682
ALA A 580
PHE A 540
 None
 0.87A 4z4iA-5f7sA:
undetectable		 4z4iA-5f7sA:
22.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fir 5'-3'
EXORIBONUCLEASE 2
HOMOLOG

(Caenorhabditis
elegans) 		PF03159
(XRN_N) 		3 VAL A 564
ALA A 595
PHE A 590
 None
 0.87A 4z4iA-5firA:
2.5		 4z4iA-5firA:
22.25
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.
5fsw RNA DEPENDENT RNA
POLYMERASE QDE-1

(Thielavia
terrestris) 		PF05183
(RdRP) 		3 VAL A 774
ALA A 776
PHE A 790
 None
 0.91A 4z4iA-5fswA:
undetectable		 4z4iA-5fswA:
21.38
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.
5inr DIPEPTIDASE

(Lactobacillus
farciminis) 		PF03577
(Peptidase_C69) 		3 VAL A  43
ALA A 356
PHE A  41
 None
EDO  A 510 (-3.8A)
None
 0.86A 4z4iA-5inrA:
undetectable		 4z4iA-5inrA:
18.09
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.
5kjm N-LYSINE
METHYLTRANSFERASE
SMYD2

(Homo sapiens) 		PF00856
(SET)
PF01753
(zf-MYND) 		3 VAL A  42
ALA A 197
PHE A  56
 None
 0.90A 4z4iA-5kjmA:
undetectable		 4z4iA-5kjmA:
19.70
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.
5lw3 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE 6

(Azotobacter
vinelandii) 		no annotation 3 VAL A 189
ALA A 167
PHE A 198
 None
 0.89A 4z4iA-5lw3A:
undetectable		 4z4iA-5lw3A:
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.
5mz6 SEPARASE

(Caenorhabditis
elegans) 		PF03568
(Peptidase_C50) 		3 VAL 1 132
ALA 1 151
PHE 1 123
 None
 0.83A 4z4iA-5mz61:
3.8		 4z4iA-5mz61:
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.
5n7z LIPOPOLYSACCHARIDE
1,6-GALACTOSYLTRANSF
ERASE

(Salmonella
enterica) 		no annotation 3 VAL A  75
ALA A 101
PHE A  41
 None
 0.78A 4z4iA-5n7zA:
5.6		 4z4iA-5n7zA:
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.
5o2u CAPSID PROTEIN P24
VHH 59H10

(Human
immunodeficiency
virus 1;
Lama glama) 		PF00607
(Gag_p24)
PF07686
(V-set) 		3 VAL B  58
ALA A 209
PHE B  47
 None
 0.89A 4z4iA-5o2uB:
undetectable		 4z4iA-5o2uB:
9.50
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.
5suj UNCHARACTERIZED
PROTEIN

(Legionella
pneumophila) 		no annotation 3 VAL A  38
ALA A  40
PHE A 361
 None
 0.70A 4z4iA-5sujA:
undetectable		 4z4iA-5sujA:
19.16
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.
5ve2 ENOYL-COA HYDRATASE

(Pseudoalteromonas
atlantica) 		PF00378
(ECH_1) 		3 VAL A 106
ALA A 138
PHE A 129
 VAL  A 106 ( 0.6A)
ALA  A 138 ( 0.0A)
PHE  A 129 ( 1.3A)
 0.82A 4z4iA-5ve2A:
undetectable		 4z4iA-5ve2A:
15.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5vm9 PROTEIN ARGONAUTE-3

(Homo sapiens) 		no annotation 3 VAL A 592
ALA A 621
PHE A 654
 None
 0.32A 4z4iA-5vm9A:
51.5		 4z4iA-5vm9A:
79.63
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.
5w4b ADENOSYLHOMOCYSTEINA
SE

(Homo sapiens) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		3 VAL A  74
ALA A  48
PHE A 120
 None
 0.90A 4z4iA-5w4bA:
2.0		 4z4iA-5w4bA:
19.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wea PROTEIN ARGONAUTE-2

(Homo sapiens) 		no annotation 3 VAL A 591
ALA A 620
PHE A 653
 None
 0.29A 4z4iA-5weaA:
54.5		 4z4iA-5weaA:
99.19
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.
5wwt PUTATIVE
METHYLTRANSFERASE
NSUN6

(Homo sapiens) 		PF01189
(Methyltr_RsmB-F) 		3 VAL A 136
ALA A 162
PHE A 185
 None
G  C  24 ( 3.9A)
None
 0.89A 4z4iA-5wwtA:
undetectable		 4z4iA-5wwtA:
19.65
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.
5x3j GLYCOSIDE HYDROLASE
FAMILY 31

(Kribbella
flavida) 		no annotation 3 VAL A 666
ALA A 564
PHE A 524
 None
 0.88A 4z4iA-5x3jA:
1.2		 4z4iA-5x3jA:
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.
5xnr ALYQ

(Persicobacter
sp. CCB-QB2) 		no annotation 3 VAL A 450
ALA A 434
PHE A 487
 None
 0.63A 4z4iA-5xnrA:
undetectable		 4z4iA-5xnrA:
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.
5xtg 2,3-DIHYDROXY-2,3-DI
HYDROPHENYLPROPIONAT
E DEHYDROGENASE

(Pseudomonas sp.
MC1) 		PF13561
(adh_short_C2) 		3 VAL B  31
ALA B  51
PHE B  76
 None
 0.89A 4z4iA-5xtgB:
3.4		 4z4iA-5xtgB:
15.45
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.
5z9s GLYCOSYL HYDROLASE
FAMILY 3 PROTEIN

(Bifidobacterium
longum) 		no annotation 3 VAL A 705
ALA A 703
PHE A 666
 None
 0.87A 4z4iA-5z9sA:
2.2		 4z4iA-5z9sA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6aph ADENOSYLHOMOCYSTEINA
SE

(Elizabethkingia
anophelis) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		3 VAL A  77
ALA A  51
PHE A 123
 None
 0.87A 4z4iA-6aphA:
2.0		 4z4iA-6aphA:
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.
6cj7 SERPIN-12

(Manduca sexta) 		no annotation 3 VAL A 311
ALA A 267
PHE A 361
 None
 0.83A 4z4iA-6cj7A:
undetectable		 4z4iA-6cj7A:
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.
6cmz DIHYDROLIPOYL
DEHYDROGENASE

(Burkholderia
cenocepacia) 		no annotation 3 VAL A 151
ALA A 268
PHE A 158
 FAD  A 503 (-4.8A)
None
None
 0.61A 4z4iA-6cmzA:
undetectable		 4z4iA-6cmzA:
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.
6cza


(;
) 		no annotation
no annotation 		3 VAL B  13
ALA A 260
PHE B 228
 SF4  B 301 (-4.0A)
None
None
 0.57A 4z4iA-6czaB:
undetectable		 4z4iA-6czaB:
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.
6ej2 BETA-SECRETASE 1

(Homo sapiens) 		no annotation 3 VAL A 449
ALA A 451
PHE A 518
 None
 0.92A 4z4iA-6ej2A:
undetectable		 4z4iA-6ej2A:
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.
6en4 SPLICING FACTOR 3B
SUBUNIT 3

(Homo sapiens) 		no annotation 3 VAL A 288
ALA A 303
PHE A 234
 None
 0.80A 4z4iA-6en4A:
undetectable		 4z4iA-6en4A:
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.
6esl BACTERIAL LEUCYL
AMINOPEPTIDASE

(Legionella
pneumophila) 		no annotation 3 VAL A 265
ALA A 332
PHE A 371
 None
 0.71A 4z4iA-6eslA:
2.3		 4z4iA-6eslA:
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.
6gk6 -

(-) 		no annotation 3 VAL A  36
ALA A   6
PHE A  11
 None
 0.87A 4z4iA-6gk6A:
undetectable		 4z4iA-6gk6A:
undetectable