SIMILAR PATTERNS OF AMINO ACIDS FOR 4E1V_E_URFE1301

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.
1cly IGG FAB (HUMAN IGG1,
KAPPA)

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 THR H 110
GLY H   9
MET H  89
PRO H 214
 None
 0.83A 4e1vE-1clyH:
undetectable		 4e1vE-1clyH:
23.91
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.
1dgj ALDEHYDE
OXIDOREDUCTASE

(Desulfovibrio
desulfuricans) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		4 THR A 104
GLY A 106
ILE A 108
VAL A 109
 None
 0.99A 4e1vE-1dgjA:
undetectable		 4e1vE-1dgjA:
14.41
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.
1e9y UREASE SUBUNIT BETA

(Helicobacter
pylori) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		4 THR B  71
GLY B  99
GLN B 105
ILE B  69
 None
 0.93A 4e1vE-1e9yB:
undetectable		 4e1vE-1e9yB:
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.
1ebd DIHYDROLIPOAMIDE
DEHYDROGENASE

(Geobacillus
stearothermophilus) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 THR A 147
GLY A 313
ILE A 315
VAL A 316
 FAD  A 462 (-4.0A)
FAD  A 462 (-3.4A)
None
None
 0.81A 4e1vE-1ebdA:
undetectable		 4e1vE-1ebdA:
21.98
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.
1eye DIHYDROPTEROATE
SYNTHASE I

(Mycobacterium
tuberculosis) 		PF00809
(Pterin_bind) 		4 THR A  87
GLY A  49
ILE A  85
VAL A  48
 None
 0.86A 4e1vE-1eyeA:
undetectable		 4e1vE-1eyeA:
26.67
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.
1g0y INTERLEUKIN-1
RECEPTOR, TYPE I

(Homo sapiens) 		PF07679
(I-set)
PF13895
(Ig_2) 		4 GLY R 121
GLN R 113
ILE R 165
VAL R 166
 None
 0.98A 4e1vE-1g0yR:
undetectable		 4e1vE-1g0yR:
23.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1iiw SLR1257 PROTEIN

(Synechocystis
sp. PCC 6803) 		PF00497
(SBP_bac_3) 		4 THR A 181
GLY A  97
ILE A 183
VAL A 185
 None
 0.73A 4e1vE-1iiwA:
undetectable		 4e1vE-1iiwA:
24.06
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.
1k2p TYROSINE-PROTEIN
KINASE BTK

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 THR A 474
GLY A 462
ILE A 472
VAL A 463
 None
 0.80A 4e1vE-1k2pA:
undetectable		 4e1vE-1k2pA:
19.85
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.
1o2d ALCOHOL
DEHYDROGENASE,
IRON-CONTAINING

(Thermotoga
maritima) 		PF00465
(Fe-ADH) 		4 THR A 252
GLY A 197
ILE A 247
VAL A 246
 None
 0.76A 4e1vE-1o2dA:
undetectable		 4e1vE-1o2dA:
22.28
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.
1o4s ASPARTATE
AMINOTRANSFERASE

(Thermotoga
maritima) 		PF00155
(Aminotran_1_2) 		4 GLY A 244
MET A 238
ILE A 267
VAL A  94
 None
 0.86A 4e1vE-1o4sA:
undetectable		 4e1vE-1o4sA:
22.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1oed ACETYLCHOLINE
RECEPTOR PROTEIN,
DELTA CHAIN

(Torpedo
marmorata) 		PF02932
(Neur_chan_memb) 		4 GLY C 301
MET C 293
ILE C 303
VAL C 304
 None
 0.90A 4e1vE-1oedC:
undetectable		 4e1vE-1oedC:
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.
1p49 STERYL-SULFATASE

(Homo sapiens) 		PF00884
(Sulfatase)
PF14707
(Sulfatase_C) 		4 GLY A 344
ILE A  39
VAL A 378
PRO A 379
 None
 0.92A 4e1vE-1p49A:
undetectable		 4e1vE-1p49A:
17.34
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.
1poj ISOASPARTYL
DIPEPTIDASE

(Escherichia
coli) 		PF01979
(Amidohydro_1) 		5 THR A  82
GLY A  75
ARG A 169
ILE A 302
PRO A 291
 None
AE1  A 401 (-3.5A)
AE1  A 401 (-3.3A)
None
AE1  A 401 (-4.4A)
 1.47A 4e1vE-1pojA:
undetectable		 4e1vE-1pojA:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1q50 GLUCOSE-6-PHOSPHATE
ISOMERASE

(Leishmania
mexicana) 		PF00342
(PGI) 		4 GLN A 406
ILE A 332
VAL A 328
PRO A 211
 None
 0.89A 4e1vE-1q50A:
2.6		 4e1vE-1q50A:
19.03
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.
1sy7 CATALASE 1

(Neurospora
crassa) 		PF00199
(Catalase)
PF01965
(DJ-1_PfpI)
PF06628
(Catalase-rel) 		4 ARG A 224
MET A 474
ILE A 323
PRO A 168
 None
 0.91A 4e1vE-1sy7A:
undetectable		 4e1vE-1sy7A:
15.72
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.
1t6k PHENAZINE
BIOSYNTHESIS PROTEIN
PHZF

(Pseudomonas
fluorescens) 		PF02567
(PhzC-PhzF) 		4 THR A 211
GLY A  73
GLN A 119
PRO A 153
 SO4  A 301 (-3.9A)
SO4  A 301 (-3.6A)
None
None
 0.82A 4e1vE-1t6kA:
undetectable		 4e1vE-1t6kA:
23.37
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.
1uwy CARBOXYPEPTIDASE M

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF13620
(CarboxypepD_reg) 		4 THR A 100
GLY A  46
ILE A 102
VAL A  45
 None
 0.99A 4e1vE-1uwyA:
5.1		 4e1vE-1uwyA:
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.
1xr6 GENOME POLYPROTEIN

(Rhinovirus A) 		PF00680
(RdRP_1) 		4 GLY A 207
GLN A  84
ARG A 305
ILE A 323
 None
 0.99A 4e1vE-1xr6A:
undetectable		 4e1vE-1xr6A:
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.
1ypz T CELL RECEPTOR
DELTA

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 THR E 135
GLY E 180
ILE E 159
VAL E 160
 None
 0.94A 4e1vE-1ypzE:
undetectable		 4e1vE-1ypzE:
23.11
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.
2ay9 AROMATIC AMINO ACID
AMINOTRANSFERASE

(Paracoccus
denitrificans) 		PF00155
(Aminotran_1_2) 		4 THR A 105
GLY A  75
GLN A 284
MET A 287
 None
 0.85A 4e1vE-2ay9A:
undetectable		 4e1vE-2ay9A:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b0r POSSIBLE ADENYL
CYCLASE-ASSOCIATED
PROTEIN

(Cryptosporidium
parvum) 		PF08603
(CAP_C) 		4 GLY A 108
ILE A 128
VAL A 129
PRO A 130
 None
 0.94A 4e1vE-2b0rA:
undetectable		 4e1vE-2b0rA:
20.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bmb FOLIC ACID SYNTHESIS
PROTEIN FOL1

(Saccharomyces
cerevisiae) 		PF00809
(Pterin_bind)
PF01288
(HPPK) 		4 THR A 637
GLY A 593
ILE A 635
VAL A 592
 None
 0.78A 4e1vE-2bmbA:
undetectable		 4e1vE-2bmbA:
17.95
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.
2dyy UPF0076 PROTEIN
PH0854

(Pyrococcus
horikoshii) 		PF01042
(Ribonuc_L-PSP) 		4 GLY A  45
ILE A  42
VAL A  43
PRO A  34
 None
 0.97A 4e1vE-2dyyA:
undetectable		 4e1vE-2dyyA:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2f6k METAL-DEPENDENT
HYDROLASE

(Lactobacillus
plantarum) 		PF04909
(Amidohydro_2) 		4 GLN A 111
ILE A  70
VAL A  73
PRO A  98
 None
 0.96A 4e1vE-2f6kA:
undetectable		 4e1vE-2f6kA:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gmh ELECTRON TRANSFER
FLAVOPROTEIN-UBIQUIN
ONE OXIDOREDUCTASE

(Sus scrofa) 		PF05187
(ETF_QO)
PF13450
(NAD_binding_8) 		4 GLY A 293
ILE A 240
VAL A 292
PRO A 303
 None
 0.94A 4e1vE-2gmhA:
undetectable		 4e1vE-2gmhA:
17.95
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.
2gmh ELECTRON TRANSFER
FLAVOPROTEIN-UBIQUIN
ONE OXIDOREDUCTASE

(Sus scrofa) 		PF05187
(ETF_QO)
PF13450
(NAD_binding_8) 		4 THR A 438
ILE A 421
VAL A 418
PRO A 362
 UQ5  A 612 (-3.0A)
None
None
None
 0.95A 4e1vE-2gmhA:
undetectable		 4e1vE-2gmhA:
17.95
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.
2gzm GLUTAMATE RACEMASE

(Bacillus
anthracis) 		PF01177
(Asp_Glu_race) 		4 THR A  59
GLY A   8
ILE A  10
VAL A   9
 None
 0.97A 4e1vE-2gzmA:
undetectable		 4e1vE-2gzmA:
23.69
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.
2jh3 RIBOSOMAL PROTEIN
S2-RELATED PROTEIN

(Deinococcus
radiodurans) 		PF01903
(CbiX) 		4 THR A 437
GLY A 441
ARG A 288
ILE A 438
 None
 0.96A 4e1vE-2jh3A:
undetectable		 4e1vE-2jh3A:
20.13
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.
2kpt PUTATIVE SECRETED
PROTEIN

(Corynebacterium
glutamicum) 		PF04536
(TPM_phosphatase) 		4 THR A 134
GLY A 132
GLN A 105
VAL A 116
 None
 0.86A 4e1vE-2kptA:
undetectable		 4e1vE-2kptA:
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.
2mx6 SEGMENT POLARITY
PROTEIN DISHEVELLED
HOMOLOG DVL-1

(Mus musculus) 		PF00595
(PDZ) 		4 GLY A 281
MET A 284
ILE A 266
VAL A 267
 None
 0.99A 4e1vE-2mx6A:
undetectable		 4e1vE-2mx6A:
16.47
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.
2oce HYPOTHETICAL PROTEIN
PA5201

(Pseudomonas
aeruginosa) 		PF00575
(S1)
PF09371
(Tex_N)
PF12836
(HHH_3)
PF16921
(Tex_YqgF) 		4 GLY A 660
GLN A 643
ILE A 704
VAL A 661
 None
 0.95A 4e1vE-2oceA:
undetectable		 4e1vE-2oceA:
16.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oxf URIDINE
PHOSPHORYLASE

(Salmonella
enterica) 		PF01048
(PNP_UDP_1) 		5 GLY A1096
GLN A1166
ARG A1168
MET A1197
VAL A1221
 None
 0.83A 4e1vE-2oxfA:
42.0		 4e1vE-2oxfA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oxf URIDINE
PHOSPHORYLASE

(Salmonella
enterica) 		PF01048
(PNP_UDP_1) 		4 THR A1094
GLY A1096
ILE A1220
VAL A1221
 None
 0.31A 4e1vE-2oxfA:
42.0		 4e1vE-2oxfA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ppy ENOYL-COA HYDRATASE

(Geobacillus
kaustophilus) 		PF00378
(ECH_1) 		4 THR A 112
GLY A 133
GLN A 190
ILE A 135
 None
 0.75A 4e1vE-2ppyA:
2.4		 4e1vE-2ppyA:
22.57
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.
2puz IMIDAZOLONEPROPIONAS
E

(Agrobacterium
fabrum) 		PF01979
(Amidohydro_1) 		4 THR A 125
GLY A  93
ARG A 140
PRO A 334
 None
 0.98A 4e1vE-2puzA:
undetectable		 4e1vE-2puzA:
21.34
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.
2q1w PUTATIVE NUCLEOTIDE
SUGAR EPIMERASE/
DEHYDRATASE

(Bordetella
bronchiseptica) 		PF01370
(Epimerase) 		4 THR A  92
GLY A  97
ILE A  55
VAL A 100
 NAD  A 501 (-2.9A)
None
NAD  A 501 (-3.9A)
None
 0.99A 4e1vE-2q1wA:
2.4		 4e1vE-2q1wA:
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.
2v9p REPLICATION PROTEIN
E1

(Deltapapillomavirus
4) 		PF00519
(PPV_E1_C) 		4 GLN A 374
ARG A 370
ILE A 503
VAL A 511
 None
 0.93A 4e1vE-2v9pA:
undetectable		 4e1vE-2v9pA:
22.96
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.
2wu8 GLUCOSE-6-PHOSPHATE
ISOMERASE

(Mycobacterium
tuberculosis) 		PF00342
(PGI) 		4 GLN A 353
ILE A 279
VAL A 275
PRO A 164
 None
 0.90A 4e1vE-2wu8A:
undetectable		 4e1vE-2wu8A:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b9g IAG-NUCLEOSIDE
HYDROLASE

(Trypanosoma
vivax) 		PF01156
(IU_nuc_hydro) 		4 THR A 284
ARG A 299
ILE A 271
VAL A 269
 None
 0.79A 4e1vE-3b9gA:
undetectable		 4e1vE-3b9gA:
22.80
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.
3bje NUCLEOSIDE
PHOSPHORYLASE,
PUTATIVE

(Trypanosoma
brucei) 		PF01048
(PNP_UDP_1) 		4 THR A  85
GLY A  88
ILE A  92
VAL A  89
 None
 0.97A 4e1vE-3bjeA:
30.0		 4e1vE-3bjeA:
25.21
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.
3bje NUCLEOSIDE
PHOSPHORYLASE,
PUTATIVE

(Trypanosoma
brucei) 		PF01048
(PNP_UDP_1) 		5 THR A 140
GLY A 142
GLN A 246
ARG A 248
MET A 285
 R1P  A 401 (-3.0A)
URA  A 501 (-3.4A)
URA  A 501 (-3.0A)
URA  A 501 (-2.9A)
R1P  A 401 ( 3.9A)
 0.23A 4e1vE-3bjeA:
30.0		 4e1vE-3bjeA:
25.21
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.
3efm FERRIC ALCALIGIN
SIDEROPHORE RECEPTOR

(Bordetella
pertussis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 THR A  41
GLY A 395
ILE A 393
VAL A 394
 None
 0.97A 4e1vE-3efmA:
undetectable		 4e1vE-3efmA:
17.13
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.
3euf URIDINE
PHOSPHORYLASE 1

(Homo sapiens) 		PF01048
(PNP_UDP_1) 		5 THR A 141
GLY A 143
GLN A 217
ARG A 219
MET A 249
 PO4  A 401 ( 3.0A)
BAU  A 400 (-3.3A)
BAU  A 400 (-3.1A)
BAU  A 400 (-3.0A)
BAU  A 400 (-3.8A)
 0.32A 4e1vE-3eufA:
26.0		 4e1vE-3eufA:
26.27
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.
3gdo UNCHARACTERIZED
OXIDOREDUCTASE YVAA

(Bacillus
subtilis) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 GLY A 237
MET A 209
ILE A 239
VAL A 240
 None
 0.94A 4e1vE-3gdoA:
undetectable		 4e1vE-3gdoA:
23.43
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.
3h95 NUCLEOSIDE
DIPHOSPHATE-LINKED
MOIETY X MOTIF 6

(Homo sapiens) 		PF00293
(NUDIX) 		4 GLY A 145
GLN A 143
ILE A 225
VAL A 146
 None
 0.96A 4e1vE-3h95A:
undetectable		 4e1vE-3h95A:
22.01
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.
3jb4 VP0
VP3

(Parechovirus B) 		PF00073
(Rhv) 		4 THR B 175
GLY B 172
ARG B 102
VAL C  75
 None
 0.97A 4e1vE-3jb4B:
undetectable		 4e1vE-3jb4B:
23.91
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.
3kiz PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
CYCLO-LIGASE

(Cytophaga
hutchinsonii) 		PF02769
(AIRS_C) 		4 THR A 346
GLY A 284
ILE A 344
VAL A 285
 None
 0.92A 4e1vE-3kizA:
undetectable		 4e1vE-3kizA:
23.82
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.
3kvy URIDINE
PHOSPHORYLASE

(Bos taurus) 		PF01048
(PNP_UDP_1) 		5 THR A 140
GLY A 142
GLN A 216
ARG A 218
MET A 248
 SO4  A 311 ( 3.1A)
URA  A 312 (-3.3A)
URA  A 312 (-3.3A)
URA  A 312 (-2.9A)
URA  A 312 ( 3.7A)
 0.30A 4e1vE-3kvyA:
26.2		 4e1vE-3kvyA:
25.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3odh OKRAI ENDONUCLEASE

(Oceanobacter
kriegii) 		PF02923
(BamHI) 		4 GLY A 118
ILE A  76
VAL A  74
PRO A  82
 None
 0.88A 4e1vE-3odhA:
undetectable		 4e1vE-3odhA:
21.57
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.
3oga NUCLEOSIDE
TRIPHOSPHATASE NUDI

(Salmonella
enterica) 		PF00293
(NUDIX) 		4 GLY A  37
ARG A  52
ILE A   6
VAL A   7
 None
None
BME  A 142 ( 4.7A)
None
 0.90A 4e1vE-3ogaA:
undetectable		 4e1vE-3ogaA:
19.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3olm E3 UBIQUITIN-PROTEIN
LIGASE RSP5

(Saccharomyces
cerevisiae) 		PF00397
(WW)
PF00632
(HECT) 		4 GLY A 553
MET A 664
ILE A 688
VAL A 556
 None
 0.97A 4e1vE-3olmA:
undetectable		 4e1vE-3olmA:
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.
3p0f URIDINE
PHOSPHORYLASE 2

(Homo sapiens) 		PF01048
(PNP_UDP_1) 		5 THR A 147
GLY A 149
GLN A 223
ARG A 225
MET A 255
 BAU  A 400 (-4.5A)
BAU  A 400 (-3.5A)
BAU  A 400 (-3.1A)
BAU  A 400 (-2.8A)
BAU  A 400 (-3.9A)
 0.28A 4e1vE-3p0fA:
26.0		 4e1vE-3p0fA:
29.07
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.
3q8n 4-AMINOBUTYRATE
TRANSAMINASE

(Mycolicibacterium
smegmatis) 		PF00202
(Aminotran_3) 		5 THR A 120
GLY A 122
ARG A 307
VAL A 285
PRO A 286
 None
 1.25A 4e1vE-3q8nA:
undetectable		 4e1vE-3q8nA:
20.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qgk UREASE SUBUNIT BETA
2

(Helicobacter
mustelae) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		4 THR C 169
GLY C 159
ILE C 171
PRO C 173
 None
None
KCX  C 218 ( 4.7A)
None
 0.82A 4e1vE-3qgkC:
undetectable		 4e1vE-3qgkC:
20.21
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.
3qll CITRATE LYASE

(Yersinia pestis) 		PF03328
(HpcH_HpaI) 		4 THR A 102
GLY A 133
ILE A 140
VAL A 137
 None
 0.90A 4e1vE-3qllA:
undetectable		 4e1vE-3qllA:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qo0 FAB FRAGMENT OF
IMMUNOGLOBULIN G1
HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 THR B 116
GLY B  10
MET B  95
PRO B 208
 None
 0.96A 4e1vE-3qo0B:
undetectable		 4e1vE-3qo0B:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rmj 2-ISOPROPYLMALATE
SYNTHASE

(Neisseria
meningitidis) 		PF00682
(HMGL-like) 		4 THR A 265
GLY A 322
ILE A 268
VAL A 269
 None
 0.86A 4e1vE-3rmjA:
undetectable		 4e1vE-3rmjA:
22.07
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.
3tny YFIY (ABC TRANSPORT
SYSTEM
SUBSTRATE-BINDING
PROTEIN)

(Bacillus cereus) 		PF01497
(Peripla_BP_2) 		4 THR A 105
GLY A  87
MET A  10
ILE A  85
 None
 0.99A 4e1vE-3tnyA:
2.5		 4e1vE-3tnyA:
23.96
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.
3u37 ACETYL-XYLAN
ESTERASE EST2A

(Butyrivibrio
proteoclasticus) 		PF13472
(Lipase_GDSL_2) 		4 GLY A 146
MET A 172
ILE A 143
PRO A 352
 None
 0.94A 4e1vE-3u37A:
undetectable		 4e1vE-3u37A:
21.29
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.
3wbn PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pyrococcus
furiosus) 		PF01554
(MatE) 		4 GLY A 108
MET A 115
ILE A 150
VAL A 151
 None
None
OLC  A 505 ( 4.4A)
None
 0.91A 4e1vE-3wbnA:
undetectable		 4e1vE-3wbnA:
20.63
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.
4bzg ALDOSE 1-EPIMERASE

(Bacillus
subtilis) 		PF01263
(Aldose_epim) 		5 THR A 178
GLY A  65
GLN A  46
ILE A  66
VAL A  35
 None
 1.39A 4e1vE-4bzgA:
undetectable		 4e1vE-4bzgA:
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.
4c30 DNA HELICASE II

(Deinococcus
radiodurans) 		PF00580
(UvrD-helicase)
PF13361
(UvrD_C) 		4 THR A  39
GLY A  35
GLN A 258
ARG A 617
 MG  A1663 ( 2.8A)
ANP  A1662 (-3.1A)
ANP  A1662 (-3.2A)
ANP  A1662 (-3.0A)
 0.92A 4e1vE-4c30A:
undetectable		 4e1vE-4c30A:
18.66
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.
4em6 GLUCOSE-6-PHOSPHATE
ISOMERASE

(Brucella
melitensis) 		no annotation 4 GLN D 349
ILE D 275
VAL D 271
PRO D 161
 None
 0.90A 4e1vE-4em6D:
2.7		 4e1vE-4em6D:
19.31
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.
4emb 2,3-BISPHOSPHOGLYCER
ATE-DEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Borreliella
burgdorferi) 		PF00300
(His_Phos_1) 		4 GLY A 234
GLN A  50
ILE A 215
PRO A 216
 None
 0.98A 4e1vE-4embA:
undetectable		 4e1vE-4embA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4faj PRGZ

(Enterococcus
faecalis) 		PF00496
(SBP_bac_5) 		4 GLY A 427
GLN A 431
VAL A 417
PRO A 447
 None
 0.96A 4e1vE-4fajA:
undetectable		 4e1vE-4fajA:
17.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g7e UREASE

(Cajanus cajan) 		PF00449
(Urease_alpha)
PF00547
(Urease_gamma)
PF00699
(Urease_beta)
PF01979
(Amidohydro_1) 		4 THR B 385
GLY B 326
ILE B 321
VAL B 320
 None
 0.94A 4e1vE-4g7eB:
undetectable		 4e1vE-4g7eB:
16.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j9u TRK SYSTEM POTASSIUM
UPTAKE PROTEIN TRKH

(Vibrio
parahaemolyticus) 		PF02386
(TrkH) 		4 THR A 352
GLY A 141
ILE A 143
VAL A 144
 None
 0.81A 4e1vE-4j9uA:
undetectable		 4e1vE-4j9uA:
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.
4kg7 PEPTIDASE S8 AND
S53, SUBTILISIN,
KEXIN, SEDOLISIN

(Mycolicibacterium
smegmatis) 		PF00082
(Peptidase_S8) 		4 GLY A 291
GLN A 375
VAL A 287
PRO A 308
 None
 0.91A 4e1vE-4kg7A:
undetectable		 4e1vE-4kg7A:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l9r INOSITOL
2-DEHYDROGENASE/D-CH
IRO-INOSITOL
3-DEHYDROGENASE

(Bacillus
subtilis) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 THR A  34
GLY A   6
ILE A   8
VAL A  70
 None
 0.94A 4e1vE-4l9rA:
undetectable		 4e1vE-4l9rA:
23.77
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.
4lgn CELLULOSE-BINDING,
FAMILY II

(Acidothermus
cellulolyticus) 		no annotation 4 THR A 456
ARG A 716
ILE A 446
PRO A 439
 None
ACT  A 825 (-3.4A)
None
None
 0.96A 4e1vE-4lgnA:
undetectable		 4e1vE-4lgnA:
16.15
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.
4lgn CELLULOSE-BINDING,
FAMILY II

(Acidothermus
cellulolyticus) 		no annotation 4 THR A 677
GLY A 683
GLN A 703
VAL A 675
 None
None
EDO  A 805 (-3.6A)
None
 0.94A 4e1vE-4lgnA:
undetectable		 4e1vE-4lgnA:
16.15
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.
4me8 SIGNAL PEPTIDASE I

(Enterococcus
faecalis) 		PF00717
(Peptidase_S24) 		4 GLY A 163
ILE A  60
VAL A 164
PRO A  54
 None
 0.94A 4e1vE-4me8A:
undetectable		 4e1vE-4me8A:
23.53
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.
4p1c TOLUENE-4-MONOOXYGEN
ASE SYSTEM PROTEIN A
TOLUENE-4-MONOOXYGEN
ASE SYSTEM PROTEIN E

(Pseudomonas
mendocina) 		PF02332
(Phenol_Hydrox) 		4 THR A 181
GLY A 110
GLN B 140
ILE A 180
 None
 0.99A 4e1vE-4p1cA:
undetectable		 4e1vE-4p1cA:
18.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p52 HOMOSERINE KINASE

(Cytophaga
hutchinsonii) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		4 THR A 219
GLY A 213
MET A 226
PRO A 168
 None
 0.98A 4e1vE-4p52A:
undetectable		 4e1vE-4p52A:
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.
4q2h PROLINE RACEMASE
PROTEIN

(Agrobacterium
tumefaciens) 		PF05544
(Pro_racemase) 		4 THR A 309
GLY A 291
GLN A 293
VAL A 277
 None
 0.95A 4e1vE-4q2hA:
undetectable		 4e1vE-4q2hA:
21.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qgs ALCOHOL
DEHYDROGENASE YQHD

(Escherichia
coli) 		PF00465
(Fe-ADH) 		4 GLY A 270
MET A 276
ILE A 287
VAL A 288
 None
 0.81A 4e1vE-4qgsA:
undetectable		 4e1vE-4qgsA:
22.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r2w URIDINE
PHOSPHORYLASE

(Shewanella
oneidensis) 		PF01048
(PNP_UDP_1) 		8 THR A  91
GLY A  93
GLN A 163
ARG A 165
MET A 194
ILE A 217
VAL A 218
PRO A 226
 SO4  A 302 ( 3.0A)
None
None
None
GOL  A 303 (-3.5A)
None
None
None
 0.24A 4e1vE-4r2wA:
43.5		 4e1vE-4r2wA:
75.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r31 URIDINE
PHOSPHORYLASE

(Actinobacillus
succinogenes) 		PF01048
(PNP_UDP_1) 		6 GLY A  94
GLN A 164
ARG A 166
MET A 195
ILE A 218
VAL A 219
 None
None
None
GOL  A 301 (-4.0A)
None
None
 0.78A 4e1vE-4r31A:
40.8		 4e1vE-4r31A:
65.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r31 URIDINE
PHOSPHORYLASE

(Actinobacillus
succinogenes) 		PF01048
(PNP_UDP_1) 		5 THR A  92
GLY A  94
ARG A 166
ILE A 218
VAL A 219
 None
 0.76A 4e1vE-4r31A:
40.8		 4e1vE-4r31A:
65.93
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.
4r7u UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Vibrio cholerae) 		PF00275
(EPSP_synthase) 		4 THR A 312
GLY A 322
ILE A 324
VAL A 323
 None
 0.98A 4e1vE-4r7uA:
undetectable		 4e1vE-4r7uA:
24.35
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.
4yry DIHYDROPYRIMIDINE
DEHYDROGENASE
SUBUNIT A

(Thermotoga
maritima) 		PF07992
(Pyr_redox_2)
PF14691
(Fer4_20) 		4 THR B 233
GLY B 431
ILE B 434
VAL B 435
 FAD  B 503 (-3.8A)
None
None
None
 0.82A 4e1vE-4yryB:
undetectable		 4e1vE-4yryB:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yry DIHYDROPYRIMIDINE
DEHYDROGENASE
SUBUNIT A

(Thermotoga
maritima) 		PF07992
(Pyr_redox_2)
PF14691
(Fer4_20) 		4 THR B 233
GLY B 432
ILE B 434
VAL B 435
 FAD  B 503 (-3.8A)
FAD  B 503 (-3.2A)
None
None
 0.97A 4e1vE-4yryB:
undetectable		 4e1vE-4yryB:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zow MULTIDRUG
TRANSPORTER MDFA

(Escherichia
coli) 		PF07690
(MFS_1) 		4 THR A 109
GLN A  37
ILE A 105
VAL A  44
 None
 0.95A 4e1vE-4zowA:
undetectable		 4e1vE-4zowA:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zpd RNA-DIRECTED RNA
POLYMERASE

(Enterovirus B) 		PF00680
(RdRP_1) 		4 GLY A 207
GLN A  84
ARG A 307
ILE A 325
 None
 0.99A 4e1vE-4zpdA:
undetectable		 4e1vE-4zpdA:
19.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cyf PUTATIVE URIDINE
PHOSPHORYLASE

(Schistosoma
mansoni) 		PF01048
(PNP_UDP_1) 		4 THR A 124
ARG A 203
MET A 233
VAL A 257
 FLC  A 301 (-3.7A)
None
None
None
 0.46A 4e1vE-5cyfA:
25.3		 4e1vE-5cyfA:
26.26
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.
5ep8 PYRIMIDINE-NUCLEOSID
E PHOSPHORYLASE

(Bacillus
subtilis) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C) 		4 GLY A 355
ILE A 247
VAL A  87
PRO A 242
 GLY  A 355 ( 0.0A)
ILE  A 247 ( 0.6A)
VAL  A  87 ( 0.6A)
PRO  A 242 ( 1.1A)
 0.96A 4e1vE-5ep8A:
3.2		 4e1vE-5ep8A:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ix1 MORC FAMILY CW-TYPE
ZINC FINGER PROTEIN
3

(Mus musculus) 		PF07496
(zf-CW)
PF13589
(HATPase_c_3) 		4 THR A 302
GLY A 304
MET A 316
ILE A 285
 None
 0.97A 4e1vE-5ix1A:
undetectable		 4e1vE-5ix1A:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l2q SERINE/THREONINE-PRO
TEIN KINASE 40

(Homo sapiens) 		no annotation 4 GLY C  86
ILE C  49
VAL C  46
PRO C  45
 None
 0.93A 4e1vE-5l2qC:
undetectable		 4e1vE-5l2qC:
22.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5lhv URIDINE
PHOSPHORYLASE

(Vibrio cholerae) 		PF01048
(PNP_UDP_1) 		6 THR A  93
GLY A  95
GLN A 165
ARG A 167
MET A 196
ILE A 219
 SO4  A 301 ( 2.9A)
URI  A 303 ( 3.4A)
URA  A 304 ( 2.9A)
URA  A 304 ( 2.9A)
URI  A 303 ( 3.7A)
None
 0.18A 4e1vE-5lhvA:
42.2		 4e1vE-5lhvA:
75.70
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.
5oce PHOSPHATIDYLINOSITOL
MANNOSIDE
ACYLTRANSFERASE

(Mycolicibacterium
smegmatis) 		no annotation 4 THR A 256
GLY A 259
ILE A 264
VAL A 261
 None
 0.96A 4e1vE-5oceA:
undetectable		 4e1vE-5oceA:
15.23
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.
5ofu FBP PROTEIN

(Leishmania
major) 		PF00316
(FBPase) 		4 GLY A 304
ARG A 335
ILE A 306
VAL A 300
 None
 0.95A 4e1vE-5ofuA:
undetectable		 4e1vE-5ofuA:
23.03
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.
5opq 3,6-ANHYDRO-D-GALACT
OSIDASE

(Zobellia
galactanivorans) 		no annotation 4 THR A 592
GLY A 335
MET A 586
ILE A 337
 None
 0.84A 4e1vE-5opqA:
undetectable		 4e1vE-5opqA:
15.35
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.
5uoh CARBOXYLESTERASE A

(Mycobacterium
tuberculosis) 		PF00561
(Abhydrolase_1) 		4 GLY A 174
ILE A 178
VAL A 175
PRO A 429
 None
 0.93A 4e1vE-5uohA:
undetectable		 4e1vE-5uohA:
22.00
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.
5vat PENICILLIN-BINDING
PROTEIN ACTIVATOR
LPOA

(Haemophilus
influenzae) 		PF04348
(LppC) 		4 GLY A 391
ARG A 465
VAL A 394
PRO A 362
 None
 0.87A 4e1vE-5vatA:
undetectable		 4e1vE-5vatA:
19.01
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.
5vgr ATLASTIN-3

(Homo sapiens) 		PF02263
(GBP)
PF02841
(GBP_C) 		4 THR A 143
GLY A 118
ILE A 119
VAL A  30
 None
 0.97A 4e1vE-5vgrA:
2.7		 4e1vE-5vgrA:
19.95
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.
5wzr ALPHA-N-ACETYLGALACT
OSAMINIDASE

(Bifidobacterium
bifidum) 		PF11308
(Glyco_hydro_129) 		4 GLY A 509
ARG A 501
ILE A 140
VAL A 138
 None
 0.98A 4e1vE-5wzrA:
undetectable		 4e1vE-5wzrA:
18.05
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.
5xnz CRED

(Streptomyces
cremeus) 		no annotation 4 GLY A 374
ILE A 376
VAL A 377
PRO A 437
 None
 0.93A 4e1vE-5xnzA:
undetectable		 4e1vE-5xnzA:
16.87
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.
5yjh PERIOSTIN

(Homo sapiens) 		no annotation 4 THR A 104
GLY A 109
ILE A 107
PRO A  81
 MG  A 720 (-3.1A)
None
MG  A 720 ( 4.7A)
None
 0.94A 4e1vE-5yjhA:
undetectable		 4e1vE-5yjhA:
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.
6bfu SPIKE PROTEIN

(Coronavirus
HKU15) 		no annotation 4 GLY A 915
GLN A 582
ILE A 563
PRO A 938
 NAG  A1914 ( 4.9A)
None
None
NAG  A1914 ( 4.6A)
 0.97A 4e1vE-6bfuA:
undetectable		 4e1vE-6bfuA:
13.34
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.
6dt3 NUCLEOSIDE
TRIPHOSPHATASE NUDI

(Klebsiella
pneumoniae) 		no annotation 4 GLY A  37
ARG A  52
ILE A   6
VAL A   7
 None
 0.92A 4e1vE-6dt3A:
undetectable		 4e1vE-6dt3A:
18.39