SIMILAR PATTERNS OF AMINO ACIDS FOR 5HWK_B_BEZB301_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.
1dmu BGLI RESTRICTION
ENDONUCLEASE

(Bacillus
subtilis) 		PF14562
(Endonuc_BglI) 		5 GLY A 245
GLY A 251
LEU A 246
LEU A 261
TYR A 258
 None
 1.21A 5hwkB-1dmuA:
undetectable		 5hwkB-1dmuA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1efp PROTEIN (ELECTRON
TRANSFER
FLAVOPROTEIN)

(Paracoccus
denitrificans) 		PF00766
(ETF_alpha)
PF01012
(ETF) 		5 GLY A 202
GLY A 204
SER A 205
LEU A 203
GLU A 207
 FAD  A 399 (-3.1A)
None
None
None
None
 1.36A 5hwkB-1efpA:
0.0		 5hwkB-1efpA:
22.40
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.
1lrw METHANOL
DEHYDROGENASE
SUBUNIT 1

(Paracoccus
denitrificans) 		PF01011
(PQQ)
PF13360
(PQQ_2) 		5 GLY A 451
GLY A 453
SER A 474
LEU A 452
TYR A 392
 None
 1.41A 5hwkB-1lrwA:
undetectable		 5hwkB-1lrwA:
19.77
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.
1nl4 PROTEIN
FARNESYLTRANSFERASE
ALPHA SUBUNIT

(Rattus
norvegicus) 		PF01239
(PPTA) 		5 TYR A 279
GLY A 282
LEU A 284
LEU A 256
TYR A 250
 None
 1.41A 5hwkB-1nl4A:
undetectable		 5hwkB-1nl4A:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1o1y CONSERVED
HYPOTHETICAL PROTEIN
TM1158

(Thermotoga
maritima) 		PF00117
(GATase) 		5 GLY A  54
TYR A  55
LEU A  89
LEU A  67
GLU A  60
 OCS  A  88 (-4.2A)
None
OCS  A  88 ( 4.7A)
None
None
 1.31A 5hwkB-1o1yA:
0.0		 5hwkB-1o1yA:
21.97
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.
1o1y CONSERVED
HYPOTHETICAL PROTEIN
TM1158

(Thermotoga
maritima) 		PF00117
(GATase) 		5 TYR A  55
LEU A  89
LEU A  67
GLU A  60
TYR A  64
 None
OCS  A  88 ( 4.7A)
None
None
None
 1.33A 5hwkB-1o1yA:
0.0		 5hwkB-1o1yA:
21.97
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.
1rie RIESKE IRON-SULFUR
PROTEIN

(Bos taurus) 		PF00355
(Rieske) 		5 GLY A 155
TYR A 156
GLY A 169
SER A 168
ARG A 101
 None
 1.41A 5hwkB-1rieA:
0.0		 5hwkB-1rieA:
21.65
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.
1tnu GERANYLGERANYL
TRANSFERASE TYPE I
BETA SUBUNIT

(Rattus
norvegicus) 		PF00432
(Prenyltrans) 		5 GLY B  94
GLY B 120
SER B 119
ARG B  92
GLU B 166
 None
 1.16A 5hwkB-1tnuB:
undetectable		 5hwkB-1tnuB:
20.10
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.
1uok OLIGO-1,6-GLUCOSIDAS
E

(Bacillus cereus) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		5 GLY A 141
TYR A 220
GLY A 146
SER A 145
GLU A 394
 None
 1.36A 5hwkB-1uokA:
0.0		 5hwkB-1uokA:
18.16
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.
1v7v CHITOBIOSE
PHOSPHORYLASE

(Vibrio
proteolyticus) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		5 GLY A 732
GLY A 729
SER A 728
LEU A 733
GLU A 441
 None
 1.30A 5hwkB-1v7vA:
0.0		 5hwkB-1v7vA:
16.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ve1 O-ACETYLSERINE
SULFHYDRYLASE

(Thermus
thermophilus) 		PF00291
(PALP) 		5 GLY A  60
TYR A  86
SER A  83
ARG A   2
GLU A   4
 None
 1.36A 5hwkB-1ve1A:
undetectable		 5hwkB-1ve1A:
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.
1w74 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
A

(Mycobacterium
tuberculosis) 		PF00160
(Pro_isomerase) 		5 GLY A  94
TYR A  95
GLY A 124
SER A 125
TYR A  52
 None
 1.29A 5hwkB-1w74A:
undetectable		 5hwkB-1w74A:
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.
1wnb PUTATIVE BETAINE
ALDEHYDE
DEHYDROGENASE

(Escherichia
coli) 		PF00171
(Aldedh) 		5 GLY A 428
TYR A 427
GLY A 405
SER A 450
LEU A 406
 None
 1.30A 5hwkB-1wnbA:
undetectable		 5hwkB-1wnbA:
18.89
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.
1wy0 GERANYLGERANYL
PYROPHOSPHATE
SYNTHETASE

(Pyrococcus
horikoshii) 		PF00348
(polyprenyl_synt) 		5 GLY A 193
GLY A 189
SER A  57
LEU A 321
TYR A 199
 None
 1.12A 5hwkB-1wy0A:
undetectable		 5hwkB-1wy0A:
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.
1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN

(Thermus
thermophilus) 		PF00291
(PALP) 		5 GLY A 231
GLY A 261
LEU A 262
LEU A 276
TYR A 340
 None
 1.26A 5hwkB-1x1qA:
undetectable		 5hwkB-1x1qA:
22.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2avd CATECHOL-O-METHYLTRA
NSFERASE

(Homo sapiens) 		PF01596
(Methyltransf_3) 		5 GLY A 255
GLY A 253
LEU A 256
LEU A  93
GLU A  89
 None
 1.41A 5hwkB-2avdA:
undetectable		 5hwkB-2avdA:
20.49
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.
2b4x ANTITHROMBIN-III

(Homo sapiens) 		PF00079
(Serpin) 		5 GLY I  93
TYR I 158
GLY I 353
LEU I 351
LEU I 213
 None
 1.00A 5hwkB-2b4xI:
undetectable		 5hwkB-2b4xI:
18.41
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.
2bas YKUI PROTEIN

(Bacillus
subtilis) 		PF00563
(EAL)
PF10388
(YkuI_C) 		5 GLY A 146
LEU A 116
LEU A 103
TYR A 141
TYR A 142
 None
 1.29A 5hwkB-2basA:
undetectable		 5hwkB-2basA:
20.27
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.
2cc0 ACETYL-XYLAN
ESTERASE

(Streptomyces
lividans) 		PF01522
(Polysacc_deac_1) 		5 GLY A   8
GLY A 180
SER A 179
LEU A   9
LEU A  26
 None
 1.24A 5hwkB-2cc0A:
undetectable		 5hwkB-2cc0A:
21.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d0v METHANOL
DEHYDROGENASE LARGE
SUBUNIT

(Hyphomicrobium
denitrificans) 		PF01011
(PQQ)
PF13360
(PQQ_2) 		5 GLY A 451
GLY A 453
SER A 474
LEU A 452
TYR A 392
 None
 1.41A 5hwkB-2d0vA:
undetectable		 5hwkB-2d0vA:
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.
2g02 NISIN BIOSYNTHESIS
PROTEIN NISC

(Lactococcus
lactis) 		PF05147
(LANC_like) 		5 GLY A  93
GLY A  90
SER A  86
LEU A  87
GLU A 144
 None
 1.34A 5hwkB-2g02A:
undetectable		 5hwkB-2g02A:
19.27
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.
2hfs MEVALONATE KINASE,
PUTATIVE

(Leishmania
major) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		5 GLY A  54
GLY A  94
LEU A  55
LEU A 123
TYR A 127
 None
 1.30A 5hwkB-2hfsA:
undetectable		 5hwkB-2hfsA:
21.99
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.
2him L-ASPARAGINASE 1

(Escherichia
coli) 		PF00710
(Asparaginase) 		5 GLY A  90
GLY A 116
SER A 117
LEU A  31
TYR A  10
 ASN  A6001 ( 3.1A)
None
None
None
None
 1.22A 5hwkB-2himA:
undetectable		 5hwkB-2himA:
20.89
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.
2i5t PROTEIN C7ORF24

(Homo sapiens) 		PF13772
(AIG2_2) 		5 TYR A  22
GLY A  23
SER A  24
TYR A 105
TYR A 125
 None
 0.68A 5hwkB-2i5tA:
11.0		 5hwkB-2i5tA:
23.14
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.
2iwz 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE

(Homo sapiens) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A  58
GLY A  50
LEU A  51
LEU A 400
TYR A 299
 None
 1.36A 5hwkB-2iwzA:
undetectable		 5hwkB-2iwzA:
19.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2j5g ALR4455 PROTEIN

(Nostoc sp. PCC
7120) 		PF00378
(ECH_1) 		5 GLY D 239
GLY D 152
LEU D 240
LEU D 100
GLU D 123
 None
 1.33A 5hwkB-2j5gD:
undetectable		 5hwkB-2j5gD:
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.
2mjf RIBOSOME ASSEMBLY 1
PROTEIN
PROTEIN HIT1

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		no annotation
no annotation 		5 GLY A  20
GLY A  23
LEU A  25
LEU B  64
TYR B  54
 None
 1.11A 5hwkB-2mjfA:
undetectable		 5hwkB-2mjfA:
13.98
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.
2ml3 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE 6

(Azotobacter
vinelandii) 		PF00353
(HemolysinCabind) 		5 GLY A  24
GLY A  42
LEU A  23
GLU A  59
TYR A  40
 CA  A 202 (-4.4A)
CA  A 204 (-4.4A)
None
None
None
 1.33A 5hwkB-2ml3A:
undetectable		 5hwkB-2ml3A:
19.76
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.
2ohh TYPE A FLAVOPROTEIN
FPRA

(Methanothermobacter
thermautotrophicus) 		PF00258
(Flavodoxin_1)
PF00753
(Lactamase_B) 		5 GLY A  45
GLY A 138
LEU A 137
LEU A 160
GLU A 162
 None
 0.98A 5hwkB-2ohhA:
undetectable		 5hwkB-2ohhA:
19.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qik UPF0131 PROTEIN YKQA

(Bacillus
subtilis) 		PF06094
(GGACT)
PF13772
(AIG2_2) 		5 TYR A   8
GLY A   9
LEU A  11
TYR A  79
TYR A  98
 None
 0.72A 5hwkB-2qikA:
10.7		 5hwkB-2qikA:
22.40
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.
2wc7 ALPHA AMYLASE,
CATALYTIC REGION

(Nostoc
punctiforme) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		5 GLY A 256
GLY A 239
LEU A 318
GLU A 240
TYR A 260
 None
 1.36A 5hwkB-2wc7A:
undetectable		 5hwkB-2wc7A:
17.44
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.
2wrd HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		5 GLY A 224
GLY A 226
SER A 227
LEU A 225
GLU A 189
 None
 0.98A 5hwkB-2wrdA:
undetectable		 5hwkB-2wrdA:
18.34
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.
2x8p CHOLINE-BINDING
PROTEIN F

(Streptococcus
pneumoniae) 		PF01473
(CW_binding_1) 		5 GLY A 249
GLY A 234
LEU A 245
LEU A 238
TYR A 223
 None
 1.32A 5hwkB-2x8pA:
undetectable		 5hwkB-2x8pA:
20.06
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.
2xtz GUANINE
NUCLEOTIDE-BINDING
PROTEIN ALPHA-1
SUBUNIT

(Arabidopsis
thaliana) 		PF00503
(G-alpha) 		5 TYR A  83
GLY A 123
LEU A 126
ARG A 125
GLU A 121
 None
 1.39A 5hwkB-2xtzA:
undetectable		 5hwkB-2xtzA:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3aiv BETA-GLUCOSIDASE

(Secale cereale) 		PF00232
(Glyco_hydro_1) 		5 GLY A 203
GLY A 208
LEU A 160
ARG A 209
GLU A 153
 None
 1.37A 5hwkB-3aivA:
undetectable		 5hwkB-3aivA:
17.28
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.
3bwl SENSOR PROTEIN

(Haloarcula
marismortui) 		PF08448
(PAS_4) 		5 GLY A 481
SER A 482
LEU A 433
ARG A 478
TYR A 435
 None
 1.30A 5hwkB-3bwlA:
undetectable		 5hwkB-3bwlA:
18.64
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.
3cuq VACUOLAR-SORTING
PROTEIN SNF8
VACUOLAR
PROTEIN-SORTING-ASSO
CIATED PROTEIN 36

(Homo sapiens;
Homo sapiens) 		PF04157
(EAP30)
PF04157
(EAP30) 		5 GLY A 155
GLY B 309
SER B 308
LEU B 351
GLU B 355
 None
 1.18A 5hwkB-3cuqA:
undetectable		 5hwkB-3cuqA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dzm HYPOTHETICAL
CONSERVED PROTEIN

(Thermus
thermophilus) 		no annotation 5 GLY A 131
GLY A  99
LEU A 130
LEU A 128
TYR A 102
 None
 1.32A 5hwkB-3dzmA:
undetectable		 5hwkB-3dzmA:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eo6 PROTEIN OF UNKNOWN
FUNCTION (DUF1255)

(Acidithiobacillus
ferrooxidans) 		PF06865
(DUF1255) 		5 GLY A  22
SER A  19
LEU A  20
LEU A  42
ARG A  24
 None
 1.37A 5hwkB-3eo6A:
undetectable		 5hwkB-3eo6A:
19.11
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.
3fi1 NA(+)/H(+)
ANTIPORTER NHAA

(Escherichia
coli) 		PF06965
(Na_H_antiport_1) 		5 GLY A 230
GLY A  76
LEU A  73
LEU A 251
GLU A 252
 None
 1.35A 5hwkB-3fi1A:
undetectable		 5hwkB-3fi1A:
24.18
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.
3g8y SUSD/RAGB-ASSOCIATED
ESTERASE-LIKE
PROTEIN

(Bacteroides
vulgatus) 		PF12715
(Abhydrolase_7) 		5 GLY A 258
GLY A 145
SER A 146
LEU A 257
ARG A 307
 None
EDO  A   4 (-3.5A)
None
None
None
 1.12A 5hwkB-3g8yA:
undetectable		 5hwkB-3g8yA:
20.20
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.
3h1i CYTOCHROME B-C1
COMPLEX SUBUNIT
RIESKE,
MITOCHONDRIAL

(Gallus gallus) 		PF00355
(Rieske)
PF02921
(UCR_TM) 		5 GLY E 155
TYR E 156
GLY E 169
SER E 168
ARG E 101
 None
 1.42A 5hwkB-3h1iE:
undetectable		 5hwkB-3h1iE:
23.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hbx GLUTAMATE
DECARBOXYLASE 1

(Arabidopsis
thaliana) 		PF00282
(Pyridoxal_deC) 		5 GLY A 211
GLY A 248
LEU A 210
LEU A 259
TYR A 256
 None
 1.22A 5hwkB-3hbxA:
undetectable		 5hwkB-3hbxA:
18.90
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.
3hf9 PROTEASOME (ALPHA
SUBUNIT) PRCA

(Mycobacterium
tuberculosis) 		no annotation 5 GLY A 145
GLY A 108
LEU A 107
LEU A  74
TYR A 103
 None
 1.37A 5hwkB-3hf9A:
undetectable		 5hwkB-3hf9A:
27.37
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.
3hzu THIOSULFATE
SULFURTRANSFERASE
SSEA

(Mycobacterium
tuberculosis) 		PF00581
(Rhodanese) 		5 GLY A 125
GLY A 220
SER A 219
LEU A 128
ARG A 221
 None
 1.29A 5hwkB-3hzuA:
undetectable		 5hwkB-3hzuA:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ju1 ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN

(Shewanella
oneidensis) 		PF16113
(ECH_2) 		5 GLY A 180
GLY A 184
LEU A 172
LEU A 136
GLU A 157
 None
 1.38A 5hwkB-3ju1A:
undetectable		 5hwkB-3ju1A:
19.66
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.
3juc AIG2-LIKE
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF06094
(GGACT) 		5 TYR A   7
GLY A   8
LEU A  10
TYR A  88
TYR A 119
 PCA  A1001 (-3.6A)
PCA  A1001 (-3.1A)
PCA  A1001 (-3.7A)
PCA  A1001 (-4.6A)
None
 0.78A 5hwkB-3jucA:
6.6		 5hwkB-3jucA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kux PUTATIVE
OXIDOREDUCTASE

(Yersinia pestis) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 GLY A 140
SER A 141
LEU A 142
LEU A 292
TYR A 247
 None
 1.30A 5hwkB-3kuxA:
undetectable		 5hwkB-3kuxA:
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.
3kux PUTATIVE
OXIDOREDUCTASE

(Yersinia pestis) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 GLY A 245
GLY A 242
LEU A 142
LEU A 133
TYR A 247
 None
 1.18A 5hwkB-3kuxA:
undetectable		 5hwkB-3kuxA:
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.
3mq0 TRANSCRIPTIONAL
REPRESSOR OF THE
BLCABC OPERON

(Agrobacterium
tumefaciens) 		PF01614
(IclR)
PF09339
(HTH_IclR) 		5 GLY A 222
GLY A 254
LEU A 257
LEU A 116
TYR A 119
 None
 1.34A 5hwkB-3mq0A:
undetectable		 5hwkB-3mq0A:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nuz PUTATIVE ACETYL
XYLAN ESTERASE

(Bacteroides
fragilis) 		PF12715
(Abhydrolase_7) 		5 GLY A 258
GLY A 145
SER A 146
LEU A 257
ARG A 307
 None
 1.23A 5hwkB-3nuzA:
undetectable		 5hwkB-3nuzA:
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.
3oky PLEXIN-A2

(Mus musculus) 		PF01403
(Sema)
PF01437
(PSI) 		5 GLY A 135
LEU A 159
LEU A 213
ARG A 201
GLU A 156
 None
 1.36A 5hwkB-3okyA:
undetectable		 5hwkB-3okyA:
16.23
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.
3qtd PMBA PROTEIN

(Pseudomonas
aeruginosa) 		PF01523
(PmbA_TldD) 		5 GLY A 337
GLY A 333
SER A 332
LEU A 336
TYR A 326
 None
 1.15A 5hwkB-3qtdA:
undetectable		 5hwkB-3qtdA:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rha PUTRESCINE OXIDASE

(Paenarthrobacter
aurescens) 		PF01593
(Amino_oxidase) 		5 GLY A 311
GLY A  88
SER A 313
LEU A 312
TYR A 102
 None
 1.40A 5hwkB-3rhaA:
undetectable		 5hwkB-3rhaA:
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.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT L
NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT N

(Escherichia
coli;
Escherichia
coli) 		no annotation
no annotation 		5 GLY L 580
SER L 576
LEU N 286
TYR N 423
TYR N 424
 None
 1.31A 5hwkB-3rkoL:
undetectable		 5hwkB-3rkoL:
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.
3thc BETA-GALACTOSIDASE

(Homo sapiens) 		PF01301
(Glyco_hydro_35)
PF13364
(BetaGal_dom4_5) 		5 GLY A 579
LEU A 619
LEU A 476
GLU A 478
TYR A 444
 None
 1.12A 5hwkB-3thcA:
undetectable		 5hwkB-3thcA:
16.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ts7 GERANYLTRANSTRANSFER
ASE

(Methylococcus
capsulatus) 		PF00348
(polyprenyl_synt) 		5 GLY A 262
GLY A 259
LEU A 258
LEU A 178
TYR A 254
 None
 1.14A 5hwkB-3ts7A:
undetectable		 5hwkB-3ts7A:
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.
3tva XYLOSE ISOMERASE
DOMAIN PROTEIN TIM
BARREL

(Planctopirus
limnophila) 		PF01261
(AP_endonuc_2) 		5 GLY A 117
GLY A  69
LEU A 118
LEU A  88
GLU A  74
 None
 1.38A 5hwkB-3tvaA:
undetectable		 5hwkB-3tvaA:
22.76
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.
3unv ADMH

(Pantoea
agglomerans) 		PF00221
(Lyase_aromatic) 		5 GLY A 498
GLY A 495
LEU A 290
LEU A 249
TYR A 507
 None
EDO  A1007 (-3.1A)
None
None
None
 1.36A 5hwkB-3unvA:
undetectable		 5hwkB-3unvA:
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.
3vsm OCCLUSION-DERIVED
VIRUS ENVELOPE
PROTEIN E66

(Autographa
californica
multiple
nucleopolyhedrovirus) 		PF04850
(Baculo_E66) 		5 GLY A 323
LEU A 324
LEU A 300
TYR A 297
TYR A 288
 None
 1.25A 5hwkB-3vsmA:
undetectable		 5hwkB-3vsmA:
15.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w2x EXODEOXYRIBONUCLEASE

(Methanothermobacter
thermautotrophicus) 		PF03372
(Exo_endo_phos) 		5 GLY A 172
SER A 171
LEU A 174
LEU A 126
TYR A 129
 None
None
FMT  A 303 ( 4.1A)
None
None
 1.02A 5hwkB-3w2xA:
undetectable		 5hwkB-3w2xA:
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.
3w3s TYPE-2 SERINE--TRNA
LIGASE

(Methanopyrus
kandleri) 		PF00587
(tRNA-synt_2b) 		5 GLY A 301
SER A 302
LEU A 303
LEU A 289
GLU A 288
 None
 1.00A 5hwkB-3w3sA:
undetectable		 5hwkB-3w3sA:
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.
3wp5 CDBFV

(Neocallimastix
patriciarum) 		PF00457
(Glyco_hydro_11) 		5 GLY A  98
LEU A 200
GLU A 196
TYR A 110
TYR A 111
 None
 1.17A 5hwkB-3wp5A:
undetectable		 5hwkB-3wp5A:
20.15
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.
4b56 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 1

(Mus musculus) 		PF01033
(Somatomedin_B)
PF01223
(Endonuclease_NS)
PF01663
(Phosphodiest) 		5 GLY A 365
GLY A 361
SER A 360
LEU A 375
GLU A 356
 None
 1.19A 5hwkB-4b56A:
undetectable		 5hwkB-4b56A:
14.09
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.
4cak INTEGRIN ALPHA-IIB

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 GLY A 418
GLY A 438
LEU A 421
LEU A 435
TYR A 448
 None
 1.27A 5hwkB-4cakA:
undetectable		 5hwkB-4cakA:
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.
4g6c BETA-HEXOSAMINIDASE
1

(Burkholderia
cenocepacia) 		PF00933
(Glyco_hydro_3) 		5 GLY A 208
SER A 210
LEU A 211
LEU A 127
TYR A 204
 None
 1.25A 5hwkB-4g6cA:
undetectable		 5hwkB-4g6cA:
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.
4gg2 GAMMA-GLUTAMYLTRANSP
EPTIDASE 1 HEAVY
CHAIN

(Homo sapiens) 		PF01019
(G_glu_transpept) 		5 GLY A 231
SER A 232
LEU A 233
LEU A 220
GLU A 223
 NAG  A 403 (-3.2A)
None
None
None
None
 1.11A 5hwkB-4gg2A:
undetectable		 5hwkB-4gg2A:
19.67
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.
4hfu HEMAGGLUTININ HA1
FAB 8M2 HEAVY CHAIN

(Influenza A
virus;
Homo sapiens) 		PF00509
(Hemagglutinin)
PF07654
(C1-set)
PF07686
(V-set) 		6 GLY A 225
GLY A 227
SER A 228
LEU A 226
GLU A 190
TYR H 100
 None
 1.15A 5hwkB-4hfuA:
undetectable		 5hwkB-4hfuA:
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.
4hwi BAG FAMILY MOLECULAR
CHAPERONE REGULATOR
1

(Arabidopsis
thaliana) 		PF02179
(BAG)
PF14560
(Ubiquitin_2) 		5 GLY B  97
GLY B 100
LEU B 134
GLU B 136
TYR B  73
 None
 1.36A 5hwkB-4hwiB:
undetectable		 5hwkB-4hwiB:
24.58
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.
4ita SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE

(Synechococcus
sp. PCC 7002) 		PF00171
(Aldedh) 		5 GLY A 438
GLY A 441
LEU A 439
LEU A 102
ARG A 443
 None
 1.24A 5hwkB-4itaA:
undetectable		 5hwkB-4itaA:
18.64
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.
4joi CST COMPLEX SUBUNIT
STN1
CST COMPLEX SUBUNIT
TEN1

(Homo sapiens;
Homo sapiens) 		PF01336
(tRNA_anti-codon)
PF09170
(STN1_2)
no annotation 		5 TYR D 115
LEU A 170
LEU A  29
TYR A  49
TYR A 178
 None
 1.40A 5hwkB-4joiD:
undetectable		 5hwkB-4joiD:
22.41
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.
4keq 4-PYRIDOXOLACTONASE

(Mesorhizobium
japonicum) 		PF00753
(Lactamase_B) 		5 GLY A  80
GLY A  83
LEU A  79
LEU A  39
TYR A   7
 None
 1.19A 5hwkB-4keqA:
undetectable		 5hwkB-4keqA:
25.50
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.
4mbg CAAX
FARNESYLTRANSFERASE
BETA SUBUNIT RAM1

(Aspergillus
fumigatus) 		PF00432
(Prenyltrans) 		5 GLY B 239
GLY B 287
LEU B 288
LEU B 322
TYR B 335
 None
 1.16A 5hwkB-4mbgB:
undetectable		 5hwkB-4mbgB:
18.18
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.
4s1t URIDYLATE-SPECIFIC
ENDORIBONUCLEASE

(Human
coronavirus
229E) 		PF06471
(NSP11) 		5 GLY A 247
GLY A 239
LEU A 249
LEU A 264
TYR A 284
 PO4  A 401 ( 4.2A)
None
None
None
None
 1.31A 5hwkB-4s1tA:
undetectable		 5hwkB-4s1tA:
20.73
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.
4w8v CRISPR SYSTEM CMR
SUBUNIT CMR6

(Pyrococcus
furiosus) 		PF03787
(RAMPs) 		5 GLY A 122
GLY A 124
LEU A 123
ARG A 134
TYR A 143
 None
 1.26A 5hwkB-4w8vA:
undetectable		 5hwkB-4w8vA:
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.
4wkz AUTONOMOUS COHESIN

(Ruminococcus
flavefaciens) 		no annotation 5 GLY B 188
GLY B 159
LEU B 158
LEU B  76
TYR B 156
 None
 1.33A 5hwkB-4wkzB:
undetectable		 5hwkB-4wkzB:
22.31
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.
5a9d SOLUTE CARRIER
FAMILY 15 MEMBER 1

(Mus musculus) 		no annotation 5 GLY A 525
SER A 547
LEU A 549
GLU A 571
TYR A 529
 None
 1.34A 5hwkB-5a9dA:
undetectable		 5hwkB-5a9dA:
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.
5ap9 LIPASE

(Thermomyces
lanuginosus) 		PF01764
(Lipase_3)
PF03893
(Lipase3_N) 		5 GLY A 148
GLY A  82
SER A  83
LEU A 147
LEU A  93
 None
 1.27A 5hwkB-5ap9A:
undetectable		 5hwkB-5ap9A:
20.15
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.
5b2d HN PROTEIN

(Mumps
rubulavirus) 		PF00423
(HN) 		5 GLY A 408
TYR A 480
GLY A 309
SER A 310
LEU A 411
 None
 1.32A 5hwkB-5b2dA:
undetectable		 5hwkB-5b2dA:
20.69
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.
5c94 NON-STRUCTURAL
PROTEIN 9

(Avian
coronavirus) 		PF08710
(nsp9) 		5 GLY A  98
GLY A 102
LEU A 101
LEU A  86
TYR A  30
 None
None
PEG  A 202 (-3.5A)
None
None
 1.10A 5hwkB-5c94A:
undetectable		 5hwkB-5c94A:
18.67
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.
5d95 AMINOTRANSFERASE
CLASS-III

(Sphaerobacter
thermophilus) 		PF00202
(Aminotran_3) 		5 GLY A 369
TYR A 370
GLY A 371
SER A 372
LEU A 373
 None
 1.06A 5hwkB-5d95A:
undetectable		 5hwkB-5d95A:
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.
5esv CH03 HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		5 GLY A  33
TYR A  32
GLY A  95
LEU A  34
LEU A   4
 None
 1.35A 5hwkB-5esvA:
undetectable		 5hwkB-5esvA:
18.29
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.
5f7c ALPHA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		5 GLY A 693
GLY A 679
LEU A 676
LEU A 661
TYR A 655
 None
 1.23A 5hwkB-5f7cA:
undetectable		 5hwkB-5f7cA:
15.74
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.
5f7r LMO0178 PROTEIN

(Listeria
monocytogenes) 		no annotation 5 GLY E 337
GLY E 339
LEU E 340
LEU E 347
ARG E 343
 GLC  E 502 ( 4.9A)
None
None
None
None
 1.27A 5hwkB-5f7rE:
undetectable		 5hwkB-5f7rE:
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.
5foe GDP-FUCOSE PROTEIN
O-FUCOSYLTRANSFERASE
2,THROMBOSPONDIN-1

(Caenorhabditis
elegans;
Homo sapiens) 		PF00090
(TSP_1)
PF10250
(O-FucT) 		5 GLY A 282
SER A 257
LEU A 255
LEU A 369
TYR A 325
 None
 1.32A 5hwkB-5foeA:
undetectable		 5hwkB-5foeA:
18.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hwi GLUTATHIONE-SPECIFIC
GAMMA-GLUTAMYLCYCLOT
RANSFERASE

(Saccharomyces
cerevisiae) 		PF04752
(ChaC) 		5 GLY A  12
LEU A  16
ARG A 114
TYR A 119
TYR A 161
 SIN  A 301 (-3.2A)
SIN  A 301 (-3.8A)
None
SIN  A 301 ( 4.7A)
None
 0.78A 5hwkB-5hwiA:
30.1		 5hwkB-5hwiA:
98.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hwi GLUTATHIONE-SPECIFIC
GAMMA-GLUTAMYLCYCLOT
RANSFERASE

(Saccharomyces
cerevisiae) 		PF04752
(ChaC) 		7 GLY A  12
TYR A  13
GLY A  14
SER A  15
LEU A  16
TYR A 119
TYR A 161
 SIN  A 301 (-3.2A)
SIN  A 301 (-3.5A)
SIN  A 301 (-3.1A)
SIN  A 301 (-2.8A)
SIN  A 301 (-3.8A)
SIN  A 301 ( 4.7A)
None
 0.36A 5hwkB-5hwiA:
30.1		 5hwkB-5hwiA:
98.33
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.
5j0a LYMPHOKINE-ACTIVATED
KILLER
T-CELL-ORIGINATED
PROTEIN KINASE

(Homo sapiens) 		PF00069
(Pkinase) 		5 GLY A  99
TYR A 100
SER A  91
LEU A  92
LEU A 163
 None
 1.27A 5hwkB-5j0aA:
undetectable		 5hwkB-5j0aA:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jjc CYSTEINE SYNTHASE

(Brucella
abortus) 		PF00291
(PALP) 		5 TYR A 309
GLY A 276
SER A 278
LEU A 274
TYR A 305
 None
 1.29A 5hwkB-5jjcA:
undetectable		 5hwkB-5jjcA:
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.
5jjq AMP-DEPENDENT
SYNTHETASE AND
LIGASE

(Streptomyces
sp. ML694-90F3) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 GLY A 227
TYR A 192
GLY A 223
LEU A 226
LEU A  86
 None
 1.37A 5hwkB-5jjqA:
undetectable		 5hwkB-5jjqA:
17.35
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.
5kvu ISOCITRATE
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF03971
(IDH) 		5 GLY A 413
GLY A 546
LEU A 414
GLU A 421
TYR A 422
 None
None
None
None
MLT  A 802 (-4.0A)
 1.32A 5hwkB-5kvuA:
undetectable		 5hwkB-5kvuA:
15.84
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.
5mpd 26S PROTEASOME
REGULATORY SUBUNIT
RPN2

(Saccharomyces
cerevisiae) 		PF01851
(PC_rep)
PF13646
(HEAT_2) 		5 GLY N 732
SER N 750
LEU N 751
LEU N 452
TYR N 406
 None
 1.07A 5hwkB-5mpdN:
undetectable		 5hwkB-5mpdN:
13.41
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.
5of4 GENERAL
TRANSCRIPTION FACTOR
IIH SUBUNIT 2

(Homo sapiens) 		PF04056
(Ssl1) 		5 GLY E 200
SER E 202
LEU E 201
LEU E  76
ARG E  80
 None
 1.20A 5hwkB-5of4E:
undetectable		 5hwkB-5of4E:
19.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5svc ACETONE CARBOXYLASE
ALPHA SUBUNIT

(Xanthobacter
autotrophicus) 		PF02538
(Hydantoinase_B) 		5 GLY A 274
GLY A 271
LEU A 273
LEU A  47
TYR A  57
 None
 1.30A 5hwkB-5svcA:
undetectable		 5hwkB-5svcA:
14.78
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.
5u7s FRUCTOSE-1,6-BISPHOS
PHATE ALDOLASE

(Acinetobacter
baumannii) 		PF01116
(F_bP_aldolase) 		5 GLY A 109
GLY A 106
SER A 107
LEU A 108
GLU A 142
 None
 1.24A 5hwkB-5u7sA:
undetectable		 5hwkB-5u7sA:
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.
5ubm GIGASTASIN

(Haementeria
ghilianii) 		no annotation 5 GLY I  71
GLY I 108
SER I 107
ARG I 109
GLU I 111
 None
 1.24A 5hwkB-5ubmI:
undetectable		 5hwkB-5ubmI:
19.35
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.
5uki RNA LARIAT
DEBRANCHING ENZYME,
PUTATIVE

(Entamoeba
histolytica) 		no annotation 5 GLY A 210
GLY A 185
LEU A 209
LEU A 195
TYR A 235
 None
 1.14A 5hwkB-5ukiA:
undetectable		 5hwkB-5ukiA:
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.
5xmd EPOXIDE HYDROLASE A

(Vigna radiata) 		no annotation 5 GLY A 228
TYR A  62
GLY A  61
LEU A  79
ARG A  60
 None
 1.39A 5hwkB-5xmdA:
undetectable		 5hwkB-5xmdA:
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.
6c01 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 3

(Homo sapiens) 		no annotation 5 GLY A 332
GLY A 328
SER A 327
LEU A 342
GLU A 323
 None
 1.09A 5hwkB-6c01A:
undetectable		 5hwkB-6c01A:
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.
6fpe TRNA
THREONYLCARBAMOYLADE
NOSINE BIOSYNTHESIS
PROTEIN TSAB
TRNA N6-ADENOSINE
THREONYLCARBAMOYLTRA
NSFERASE

(Thermotoga
maritima;
Thermotoga
maritima) 		no annotation
no annotation 		5 GLY A  66
GLY A  69
LEU A  67
LEU B  52
ARG A  71
 None
 1.14A 5hwkB-6fpeA:
undetectable		 5hwkB-6fpeA:
undetectable