SIMILAR PATTERNS OF AMINO ACIDS FOR 5HWA_A_GCSA303

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.
1eth TRIACYLGLYCEROL
ACYL-HYDROLASE

(Sus scrofa) 		PF00151
(Lipase)
PF01477
(PLAT) 		4 HIS A 157
VAL A 149
GLY A 126
ALA A 162
 None
 1.03A 5hwaA-1ethA:
0.0		 5hwaA-1ethA:
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.
1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II

(Saccharomyces
cerevisiae) 		PF00150
(Cellulase) 		4 ASP A 173
HIS A 268
GLY A 176
ALA A 177
 None
 1.05A 5hwaA-1h4pA:
0.0		 5hwaA-1h4pA:
19.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hds HEMOGLOBIN S (DEOXY)
(BETA CHAIN)

(Odocoileus
virginianus) 		PF00042
(Globin) 		4 ASP B  68
VAL B 113
GLY B  23
ALA B  26
 None
 0.91A 5hwaA-1hdsB:
undetectable		 5hwaA-1hdsB:
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.
1lpb LIPASE

(Homo sapiens) 		PF00151
(Lipase)
PF01477
(PLAT) 		4 HIS B 156
VAL B 148
GLY B 125
ALA B 161
 None
 1.02A 5hwaA-1lpbB:
0.0		 5hwaA-1lpbB:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n31 L-CYSTEINE/CYSTINE
LYASE C-DES

(Synechocystis
sp. PCC 6714) 		PF00266
(Aminotran_5) 		4 ASP A 366
VAL A 349
GLY A 344
ALA A 347
 None
 1.03A 5hwaA-1n31A:
0.0		 5hwaA-1n31A:
19.23
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.
1n4d VITAMIN B12
TRANSPORT PROTEIN
BTUF

(Escherichia
coli) 		PF01497
(Peripla_BP_2) 		4 ASP A  86
VAL A  72
GLY A  66
ALA A  68
 None
 0.87A 5hwaA-1n4dA:
0.0		 5hwaA-1n4dA:
24.09
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.
1o9j ALDEHYDE
DEHYDROGENASE,
CYTOSOLIC 1

(Elephantulus
edwardii) 		PF00171
(Aldedh) 		4 HIS A 235
VAL A 221
GLY A 229
ALA A 228
 None
None
NAD  A1501 (-3.5A)
None
 0.93A 5hwaA-1o9jA:
0.0		 5hwaA-1o9jA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pzx HYPOTHETICAL PROTEIN
APC36103

(Geobacillus
stearothermophilus) 		PF02645
(DegV) 		4 ASP A  12
VAL A  30
GLY A 268
ALA A 269
 None
 0.98A 5hwaA-1pzxA:
0.0		 5hwaA-1pzxA:
19.41
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.
1t6k PHENAZINE
BIOSYNTHESIS PROTEIN
PHZF

(Pseudomonas
fluorescens) 		PF02567
(PhzC-PhzF) 		4 HIS A 221
VAL A 234
GLY A 216
ALA A 215
 None
 1.02A 5hwaA-1t6kA:
0.0		 5hwaA-1t6kA:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vkf GLYCEROL UPTAKE
OPERON
ANTITERMINATOR-RELAT
ED PROTEIN

(Thermotoga
maritima) 		PF04309
(G3P_antiterm) 		4 HIS A  36
VAL A  47
GLY A  71
ALA A  72
 None
 0.87A 5hwaA-1vkfA:
0.0		 5hwaA-1vkfA:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wye 2-KETO-3-DEOXYGLUCON
ATE KINASE

(Sulfurisphaera
tokodaii) 		PF00294
(PfkB) 		4 ASP A 194
VAL A 251
GLY A 255
ALA A 254
 None
 1.02A 5hwaA-1wyeA:
undetectable		 5hwaA-1wyeA:
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.
2b8n GLYCERATE KINASE,
PUTATIVE

(Thermotoga
maritima) 		PF05161
(MOFRL)
PF13660
(DUF4147) 		4 HIS A 239
VAL A 243
GLY A 171
ALA A 174
 None
 1.04A 5hwaA-2b8nA:
undetectable		 5hwaA-2b8nA:
21.91
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.
2c1h DELTA-AMINOLEVULINIC
ACID DEHYDRATASE

(Prosthecochloris
vibrioformis) 		PF00490
(ALAD) 		4 ASP A 242
VAL A 149
GLY A 178
ALA A 179
 MG  A1329 ( 3.8A)
None
None
None
 1.06A 5hwaA-2c1hA:
undetectable		 5hwaA-2c1hA:
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.
2ca4 SULFITE:CYTOCHROME C
OXIDOREDUCTASE
SUBUNIT A

(Starkeya
novella) 		PF00174
(Oxidored_molyb)
PF03404
(Mo-co_dimer) 		4 HIS A 335
VAL A 270
GLY A 273
ALA A 274
 None
 0.89A 5hwaA-2ca4A:
undetectable		 5hwaA-2ca4A:
20.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d4e 5-CARBOXYMETHYL-2-HY
DROXYMUCONATE
SEMIALDEHYDE
DEHYDROGENASE

(Thermus
thermophilus) 		PF00171
(Aldedh) 		4 HIS A 239
VAL A 225
GLY A 233
ALA A 232
 None
None
GOL  A1801 (-3.4A)
None
 1.04A 5hwaA-2d4eA:
undetectable		 5hwaA-2d4eA:
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.
2ejw HOMOSERINE
DEHYDROGENASE

(Thermus
thermophilus) 		PF00742
(Homoserine_dh)
PF03447
(NAD_binding_3) 		4 ASP A 301
HIS A 120
GLY A 127
ALA A 126
 None
None
MG  A2003 ( 4.5A)
None
 1.03A 5hwaA-2ejwA:
undetectable		 5hwaA-2ejwA:
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.
2eyq TRANSCRIPTION-REPAIR
COUPLING FACTOR

(Escherichia
coli) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02559
(CarD_CdnL_TRCF)
PF03461
(TRCF) 		4 ASP A 949
HIS A 948
GLY A 942
ALA A 941
 None
None
EPE  A1151 (-2.7A)
EPE  A1151 (-4.1A)
 0.93A 5hwaA-2eyqA:
undetectable		 5hwaA-2eyqA:
11.73
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.
2gre DEBLOCKING
AMINOPEPTIDASE

(Bacillus cereus) 		PF05343
(Peptidase_M42) 		4 HIS A 327
VAL A 189
GLY A 316
ALA A 315
 None
 0.94A 5hwaA-2greA:
undetectable		 5hwaA-2greA:
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.
2hqr PUTATIVE
TRANSCRIPTIONAL
REGULATOR

(Helicobacter
pylori) 		PF00072
(Response_reg)
PF00486
(Trans_reg_C) 		4 HIS A  85
VAL A  73
GLY A  90
ALA A  91
 None
 0.91A 5hwaA-2hqrA:
undetectable		 5hwaA-2hqrA:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i0k OXIDOREDUCTASE

(Brevibacterium
sterolicum) 		PF01565
(FAD_binding_4)
PF09129
(Chol_subst-bind) 		4 ASP A 141
HIS A 145
GLY A 165
ALA A 166
 None
 0.95A 5hwaA-2i0kA:
undetectable		 5hwaA-2i0kA:
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.
2ipi ACLACINOMYCIN
OXIDOREDUCTASE
(AKNOX)

(Streptomyces
galilaeus) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		4 HIS A 138
VAL A 104
GLY A 107
ALA A 108
 FAD  A 801 (-3.6A)
None
None
None
 0.99A 5hwaA-2ipiA:
undetectable		 5hwaA-2ipiA:
19.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2irw CORTICOSTEROID
11-BETA-DEHYDROGENAS
E ISOZYME 1

(Homo sapiens) 		PF00106
(adh_short) 		4 HIS A  53
VAL A  61
GLY A  58
ALA A  83
 None
 0.83A 5hwaA-2irwA:
undetectable		 5hwaA-2irwA:
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.
2oz8 MLL7089 PROTEIN

(Mesorhizobium
japonicum) 		PF13378
(MR_MLE_C) 		4 ASP A 217
HIS A 216
GLY A 188
ALA A 187
 None
 0.97A 5hwaA-2oz8A:
undetectable		 5hwaA-2oz8A:
21.50
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.
2pb9 PHOSPHOMETHYLPYRIMID
INE KINASE

(Pyrococcus
furiosus) 		PF10120
(ThiP_synth) 		4 HIS A 341
VAL A 300
GLY A 337
ALA A 338
 PO4  A 500 (-4.2A)
None
None
None
 1.00A 5hwaA-2pb9A:
undetectable		 5hwaA-2pb9A:
21.60
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.
2pbi GUANINE
NUCLEOTIDE-BINDING
PROTEIN SUBUNIT BETA
5

(Mus musculus) 		PF00400
(WD40) 		4 HIS B 192
VAL B 198
GLY B 195
ALA B 196
 None
 1.00A 5hwaA-2pbiB:
undetectable		 5hwaA-2pbiB:
22.63
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.
2psf RENILLA-LUCIFERIN
2-MONOOXYGENASE

(Renilla
reniformis) 		PF00561
(Abhydrolase_1) 		4 HIS A 128
VAL A 146
GLY A 122
ALA A 123
 None
 0.76A 5hwaA-2psfA:
undetectable		 5hwaA-2psfA:
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.
2q74 INOSITOL-1-MONOPHOSP
HATASE

(Mycobacterium
tuberculosis) 		PF00459
(Inositol_P) 		4 ASP A 107
VAL A 264
GLY A 239
ALA A 240
 None
 0.97A 5hwaA-2q74A:
undetectable		 5hwaA-2q74A:
20.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vou 2,6-DIHYDROXYPYRIDIN
E HYDROXYLASE

(Paenarthrobacter
nicotinovorans) 		PF00070
(Pyr_redox) 		4 ASP A 325
VAL A 388
GLY A 354
ALA A 356
 None
 1.02A 5hwaA-2vouA:
undetectable		 5hwaA-2vouA:
21.80
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.
2vsq SURFACTIN SYNTHETASE
SUBUNIT 3

(Bacillus
subtilis) 		PF00501
(AMP-binding)
PF00550
(PP-binding)
PF00668
(Condensation)
PF00975
(Thioesterase)
PF13193
(AMP-binding_C) 		4 HIS A 509
VAL A 534
GLY A 512
ALA A 537
 None
 1.03A 5hwaA-2vsqA:
undetectable		 5hwaA-2vsqA:
11.18
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.
2x05 EXO-BETA-D-GLUCOSAMI
NIDASE

(Amycolatopsis
orientalis) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		4 HIS A 677
VAL A 724
GLY A 728
ALA A 729
 None
 0.94A 5hwaA-2x05A:
undetectable		 5hwaA-2x05A:
13.87
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.
3brq HTH-TYPE
TRANSCRIPTIONAL
REGULATOR ASCG

(Escherichia
coli) 		PF13377
(Peripla_BP_3) 		4 HIS A 218
VAL A 189
GLY A 212
ALA A 186
 None
 0.97A 5hwaA-3brqA:
undetectable		 5hwaA-3brqA:
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.
3dbi SUGAR-BINDING
TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Escherichia
coli) 		PF13377
(Peripla_BP_3) 		4 HIS A 262
VAL A 233
GLY A 256
ALA A 230
 None
 0.93A 5hwaA-3dbiA:
undetectable		 5hwaA-3dbiA:
20.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dwf 11-BETA-HYDROXYSTERO
ID DEHYDROGENASE 1

(Cavia porcellus) 		PF00106
(adh_short) 		4 HIS A  53
VAL A  61
GLY A  58
ALA A  83
 None
 0.92A 5hwaA-3dwfA:
undetectable		 5hwaA-3dwfA:
21.21
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.
3e74 ALLANTOINASE

(Escherichia
coli) 		PF01979
(Amidohydro_1) 		4 ASP A  57
HIS A  59
GLY A 337
ALA A 336
 None
FE  A 454 (-3.5A)
None
None
 0.95A 5hwaA-3e74A:
undetectable		 5hwaA-3e74A:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eaf ABC TRANSPORTER,
SUBSTRATE BINDING
PROTEIN

(Aeropyrum
pernix) 		PF13458
(Peripla_BP_6) 		4 ASP A  53
VAL A 193
GLY A 125
ALA A 127
 None
None
GOL  A 500 (-3.3A)
None
 1.04A 5hwaA-3eafA:
undetectable		 5hwaA-3eafA:
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.
3ebr UNCHARACTERIZED
RMLC-LIKE CUPIN

(Cupriavidus
pinatubonensis) 		PF12973
(Cupin_7) 		4 HIS A  58
VAL A  63
GLY A 115
ALA A 114
 None
 1.02A 5hwaA-3ebrA:
undetectable		 5hwaA-3ebrA:
21.15
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.
3f8t PREDICTED ATPASE
INVOLVED IN
REPLICATION CONTROL,
CDC46/MCM FAMILY

(Methanopyrus
kandleri) 		PF00493
(MCM) 		4 HIS A 316
VAL A 329
GLY A 294
ALA A 281
 None
 1.04A 5hwaA-3f8tA:
undetectable		 5hwaA-3f8tA:
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.
3h75 PERIPLASMIC
SUGAR-BINDING DOMAIN
PROTEIN

(Pseudomonas
protegens) 		PF13407
(Peripla_BP_4) 		4 ASP A 157
VAL A 276
GLY A 297
ALA A 296
 None
 1.00A 5hwaA-3h75A:
undetectable		 5hwaA-3h75A:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hm7 ALLANTOINASE

(Bacillus
halodurans) 		PF01979
(Amidohydro_1) 		4 ASP A  61
HIS A  63
GLY A 338
ALA A 337
 None
ZN  A 447 (-3.5A)
None
None
 0.85A 5hwaA-3hm7A:
undetectable		 5hwaA-3hm7A:
18.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hol TBPB

(Actinobacillus
pleuropneumoniae) 		PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A) 		4 ASP A 182
VAL A  55
GLY A 173
ALA A 151
 None
 0.95A 5hwaA-3holA:
undetectable		 5hwaA-3holA:
18.88
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.
3i44 ALDEHYDE
DEHYDROGENASE

(Bartonella
henselae) 		PF00171
(Aldedh) 		4 ASP A  26
HIS A 315
GLY A  93
ALA A  94
 None
 0.96A 5hwaA-3i44A:
undetectable		 5hwaA-3i44A:
19.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3io1 AMINOBENZOYL-GLUTAMA
TE UTILIZATION
PROTEIN

(Klebsiella
pneumoniae) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 ASP A 200
VAL A  56
GLY A 196
ALA A 195
 None
 1.04A 5hwaA-3io1A:
undetectable		 5hwaA-3io1A:
18.88
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.
3iwk AMINOALDEHYDE
DEHYDROGENASE

(Pisum sativum) 		PF00171
(Aldedh) 		4 HIS A 228
VAL A 214
GLY A 222
ALA A 221
 None
None
NAD  A 505 (-3.8A)
None
 0.94A 5hwaA-3iwkA:
undetectable		 5hwaA-3iwkA:
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.
3kd6 CARBOHYDRATE KINASE,
PFKB FAMILY

(Chlorobaculum
tepidum) 		PF00294
(PfkB) 		4 HIS A 246
VAL A 145
GLY A 241
ALA A 240
 None
 1.06A 5hwaA-3kd6A:
undetectable		 5hwaA-3kd6A:
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.
3m5b ZINC FINGER AND BTB
DOMAIN-CONTAINING
PROTEIN 32

(Homo sapiens) 		PF00651
(BTB) 		4 ASP A  30
HIS A  43
GLY A  55
ALA A  48
 None
 0.98A 5hwaA-3m5bA:
undetectable		 5hwaA-3m5bA:
16.60
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.
3mm5 SULFITE REDUCTASE,
DISSIMILATORY-TYPE
SUBUNIT ALPHA

(Archaeoglobus
fulgidus) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		4 HIS A 290
VAL A 286
GLY A 269
ALA A 270
 None
SF4  A 576 (-4.2A)
None
SF4  A 576 ( 3.7A)
 0.82A 5hwaA-3mm5A:
undetectable		 5hwaA-3mm5A:
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.
3o1h PERIPLASMIC PROTEIN
TORT

(Vibrio
parahaemolyticus) 		PF00532
(Peripla_BP_1) 		4 HIS B 155
VAL B 224
GLY B 148
ALA B 147
 None
 1.05A 5hwaA-3o1hB:
undetectable		 5hwaA-3o1hB:
22.33
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.
3p4s FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT

(Escherichia
coli) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		4 HIS A 137
VAL A  38
GLY A  13
ALA A  12
 None
FAD  A 601 (-3.9A)
FAD  A 601 (-3.2A)
FAD  A 601 (-3.4A)
 1.04A 5hwaA-3p4sA:
undetectable		 5hwaA-3p4sA:
17.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pmo UDP-3-O-[3-HYDROXYMY
RISTOYL] GLUCOSAMINE
N-ACYLTRANSFERASE

(Pseudomonas
aeruginosa) 		PF00132
(Hexapep)
PF04613
(LpxD) 		4 HIS A 165
VAL A 150
GLY A 130
ALA A 131
 None
 1.04A 5hwaA-3pmoA:
undetectable		 5hwaA-3pmoA:
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.
3pqs TRANSFERRIN-BINDING
PROTEIN

(Actinobacillus
pleuropneumoniae) 		PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A) 		4 ASP A 186
VAL A  57
GLY A 177
ALA A 158
 None
 0.92A 5hwaA-3pqsA:
undetectable		 5hwaA-3pqsA:
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.
3pz2 GERANYLGERANYL
TRANSFERASE TYPE-2
SUBUNIT BETA

(Rattus
norvegicus) 		PF00432
(Prenyltrans) 		4 HIS B 290
VAL B  56
GLY B 297
ALA B 296
 ZN  B   1 ( 3.2A)
None
None
None
 1.02A 5hwaA-3pz2B:
undetectable		 5hwaA-3pz2B:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rx6 POLARITY SUPPRESSION
PROTEIN

(Enterobacteria
phage P4) 		PF07455
(Psu) 		4 HIS A  73
VAL A 162
GLY A  67
ALA A  66
 None
 0.97A 5hwaA-3rx6A:
undetectable		 5hwaA-3rx6A:
20.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3slk POLYKETIDE SYNTHASE
EXTENDER MODULE 2

(Saccharopolyspora
spinosa) 		PF08240
(ADH_N)
PF08659
(KR)
PF13602
(ADH_zinc_N_2) 		4 HIS A 331
VAL A 364
GLY A 335
ALA A 334
 None
None
NDP  A 801 (-3.3A)
None
 1.06A 5hwaA-3slkA:
undetectable		 5hwaA-3slkA:
14.71
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.
3ss6 ACETYL-COA
ACETYLTRANSFERASE

(Bacillus
anthracis) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		4 HIS A  55
VAL A 254
GLY A  91
ALA A 354
 None
 1.06A 5hwaA-3ss6A:
undetectable		 5hwaA-3ss6A:
21.61
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.
3uxy SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Rhodobacter
sphaeroides) 		PF13561
(adh_short_C2) 		4 HIS A 162
VAL A  76
GLY A 124
ALA A 125
 None
 0.99A 5hwaA-3uxyA:
undetectable		 5hwaA-3uxyA:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bxs VENOM PROTHROMBIN
ACTIVATOR
PSEUTARIN-C
NON-CATALYTIC
SUBUNIT

(Pseudonaja
textilis) 		PF00754
(F5_F8_type_C)
PF07732
(Cu-oxidase_3) 		4 HIS V1050
VAL V1071
GLY V 264
ALA V 265
 None
 1.05A 5hwaA-4bxsV:
undetectable		 5hwaA-4bxsV:
10.91
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.
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobacter
marburgensis) 		PF00374
(NiFeSe_Hases) 		4 HIS A 150
VAL A 141
GLY A 146
ALA A 145
 SF4  B1274 ( 4.4A)
None
None
None
 0.95A 5hwaA-4ci0A:
1.7		 5hwaA-4ci0A:
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.
4dns FAD-LINKED
OXIDOREDUCTASE BG60

(Cynodon
dactylon) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		4 HIS A 160
VAL A 125
GLY A 128
ALA A 129
 FAD  A 501 (-3.9A)
None
None
None
 1.04A 5hwaA-4dnsA:
undetectable		 5hwaA-4dnsA:
20.38
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.
4gfh DNA TOPOISOMERASE 2

(Saccharomyces
cerevisiae) 		PF00204
(DNA_gyraseB)
PF00521
(DNA_topoisoIV)
PF01751
(Toprim)
PF02518
(HATPase_c)
PF16898
(TOPRIM_C) 		4 HIS A 623
VAL A 446
GLY A 460
ALA A 457
 None
 1.05A 5hwaA-4gfhA:
undetectable		 5hwaA-4gfhA:
13.76
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.
4go4 PUTATIVE
GAMMA-HYDROXYMUCONIC
SEMIALDEHYDE
DEHYDROGENASE

(Pseudomonas sp.
WBC-3) 		PF00171
(Aldedh) 		4 HIS A 215
VAL A 201
GLY A 209
ALA A 208
 None
None
NAD  A 601 (-3.4A)
None
 1.00A 5hwaA-4go4A:
undetectable		 5hwaA-4go4A:
18.60
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.
4i8p AMINOALDEHYDE
DEHYDROGENASE 1

(Zea mays) 		PF00171
(Aldedh) 		4 HIS A 230
VAL A 216
GLY A 224
ALA A 223
 None
None
NAD  A 601 (-3.6A)
None
 1.01A 5hwaA-4i8pA:
undetectable		 5hwaA-4i8pA:
19.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k26 CORTICOSTEROID
11-BETA-DEHYDROGENAS
E ISOZYME 1

(Mus musculus) 		PF00106
(adh_short) 		4 HIS A  53
VAL A  61
GLY A  58
ALA A  83
 None
 0.96A 5hwaA-4k26A:
undetectable		 5hwaA-4k26A:
20.88
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.
4kwg ALDEHYDE
DEHYDROGENASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00171
(Aldedh) 		4 HIS A 235
VAL A 221
GLY A 229
ALA A 228
 None
 1.06A 5hwaA-4kwgA:
undetectable		 5hwaA-4kwgA:
20.53
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.
4lvo SUBTILISIN-LIKE
SERINE PROTEASE

(Plasmodium
falciparum) 		PF00082
(Peptidase_S8) 		4 HIS A 611
VAL A 446
GLY A 434
ALA A 438
 None
 1.06A 5hwaA-4lvoA:
undetectable		 5hwaA-4lvoA:
20.11
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.
4o4x TBPB

(Glaesserella
parasuis) 		PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A) 		4 ASP A 187
VAL A  55
GLY A 178
ALA A 156
 None
 0.83A 5hwaA-4o4xA:
undetectable		 5hwaA-4o4xA:
19.29
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.
4o6r ALDEHYDE
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00171
(Aldedh) 		4 HIS A 215
VAL A 201
GLY A 209
ALA A 208
 None
None
AMP  A 501 (-3.7A)
None
 0.86A 5hwaA-4o6rA:
undetectable		 5hwaA-4o6rA:
18.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p56 PUTATIVE
EXTRACELLULAR
SOLUTE-BINDING
PROTEIN

(Bordetella
bronchiseptica) 		PF03480
(DctP) 		4 ASP A 278
HIS A 277
GLY A 271
ALA A 270
 None
 0.97A 5hwaA-4p56A:
undetectable		 5hwaA-4p56A:
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.
4p56 PUTATIVE
EXTRACELLULAR
SOLUTE-BINDING
PROTEIN

(Bordetella
bronchiseptica) 		PF03480
(DctP) 		4 HIS A 146
VAL A  41
GLY A 271
ALA A 273
 RMN  A 401 (-4.2A)
None
None
None
 0.95A 5hwaA-4p56A:
undetectable		 5hwaA-4p56A:
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.
4pxl CYTOSOLIC ALDEHYDE
DEHYDROGENASE RF2C

(Zea mays) 		PF00171
(Aldedh) 		4 HIS A 236
VAL A 222
GLY A 230
ALA A 229
 None
None
NAD  A 601 (-3.6A)
None
 1.03A 5hwaA-4pxlA:
undetectable		 5hwaA-4pxlA:
18.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pz2 ZMALDH

(Zea mays) 		PF00171
(Aldedh) 		4 HIS A 250
VAL A 236
GLY A 244
ALA A 243
 None
None
NAD  A 603 (-3.6A)
None
 0.86A 5hwaA-4pz2A:
undetectable		 5hwaA-4pz2A:
19.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q73 PROLINE
DEHYDROGENASE

(Bradyrhizobium
diazoefficiens) 		PF00171
(Aldedh)
PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		4 HIS A 871
VAL A 834
GLY A 789
ALA A 788
 None
 0.99A 5hwaA-4q73A:
undetectable		 5hwaA-4q73A:
15.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida) 		PF00171
(Aldedh) 		4 HIS A 235
VAL A 221
GLY A 229
ALA A 228
 None
 1.01A 5hwaA-4qyjA:
undetectable		 5hwaA-4qyjA:
20.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u8t ZYRO0G01672P

(Zygosaccharomyces
rouxii) 		PF04146
(YTH) 		4 ASP A 327
VAL A 271
GLY A 165
ALA A 166
 None
 1.01A 5hwaA-4u8tA:
undetectable		 5hwaA-4u8tA:
19.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4x9x DEGV
DOMAIN-CONTAINING
PROTEIN MW1315

(Staphylococcus
aureus) 		PF02645
(DegV) 		4 HIS A 266
VAL A 157
GLY A 160
ALA A 271
 OLA  A 301 (-2.7A)
OLA  A 301 ( 3.6A)
None
OLA  A 301 (-3.0A)
 0.90A 5hwaA-4x9xA:
undetectable		 5hwaA-4x9xA:
21.90
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.
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei) 		PF09818
(ABC_ATPase) 		4 ASP A 626
HIS A 625
GLY A 619
ALA A 618
 None
 1.00A 5hwaA-4yj1A:
undetectable		 5hwaA-4yj1A:
17.99
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.
4ywe PUTATIVE ALDEHYDE
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00171
(Aldedh) 		4 HIS A 216
VAL A 202
GLY A 210
ALA A 209
 None
 1.03A 5hwaA-4yweA:
undetectable		 5hwaA-4yweA:
17.91
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.
4zad FDC1

(Candida
dubliniensis) 		PF01977
(UbiD) 		4 ASP A 152
HIS A 150
GLY A  36
ALA A  37
 None
 1.04A 5hwaA-4zadA:
undetectable		 5hwaA-4zadA:
20.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5abm RETINAL
DEHYDROGENASE 1

(Ovis aries) 		PF00171
(Aldedh) 		4 HIS A 235
VAL A 221
GLY A 229
ALA A 228
 None
None
TXE  A 501 (-3.5A)
None
 1.04A 5hwaA-5abmA:
undetectable		 5hwaA-5abmA:
20.60
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.
5d27 PHOSPHATIDYLINOSITOL
3,4,5-TRISPHOSPHATE-
DEPENDENT RAC
EXCHANGER 1 PROTEIN

(Homo sapiens) 		PF00169
(PH) 		4 HIS A 349
VAL A 355
GLY A 352
ALA A 346
 NI  A 501 (-3.5A)
None
None
None
 0.99A 5hwaA-5d27A:
undetectable		 5hwaA-5d27A:
20.46
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.
5d88 PREDICTED PROTEASE
OF THE COLLAGENASE
FAMILY

(Methanopyrus
kandleri) 		PF01136
(Peptidase_U32) 		4 HIS A 133
VAL A 119
GLY A 138
ALA A 139
 None
 0.98A 5hwaA-5d88A:
undetectable		 5hwaA-5d88A:
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.
5exv HEMIN-DEGRADING
HEMS.CHUX DOMAIN
PROTEIN

(Vibrio cholerae) 		PF06228
(ChuX_HutX) 		4 ASP A  33
HIS A  36
GLY A 134
ALA A 132
 None
 0.97A 5hwaA-5exvA:
undetectable		 5hwaA-5exvA:
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.
5fi0 PHOSPHATIDYLINOSITOL
3,4,5-TRISPHOSPHATE-
DEPENDENT RAC
EXCHANGER 1
PROTEIN,PHOSPHATIDYL
INOSITOL
3,4,5-TRISPHOSPHATE-
DEPENDENT RAC
EXCHANGER 1 PROTEIN

(Homo sapiens) 		PF00169
(PH)
PF00621
(RhoGEF) 		4 HIS A 349
VAL A 355
GLY A 352
ALA A 346
 None
 0.93A 5hwaA-5fi0A:
undetectable		 5hwaA-5fi0A:
19.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5flz TUBULIN GAMMA CHAIN

(Saccharomyces
cerevisiae) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		4 HIS C  16
VAL C 172
GLY C 144
ALA C 143
 None
 0.99A 5hwaA-5flzC:
undetectable		 5hwaA-5flzC:
19.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gtk BETAINE-ALDEHYDE
DEHYDROGENASE

(Bacillus cereus) 		PF00171
(Aldedh) 		4 HIS A 234
VAL A 220
GLY A 228
ALA A 227
 None
None
NAD  A 501 (-3.5A)
None
 0.79A 5hwaA-5gtkA:
undetectable		 5hwaA-5gtkA:
19.92
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.
5hkq CONTACT-DEPENDENT
INHIBITOR A

(Escherichia
coli) 		PF14436
(EndoU_bacteria) 		4 HIS A 321
VAL A 304
GLY A 278
ALA A 281
 None
 0.97A 5hwaA-5hkqA:
undetectable		 5hwaA-5hkqA:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5i92 GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE

(Pseudomonas
aeruginosa) 		PF00202
(Aminotran_3) 		4 HIS A  68
VAL A  75
GLY A 308
ALA A 306
 None
 1.06A 5hwaA-5i92A:
undetectable		 5hwaA-5i92A:
18.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mj7 UNCHARACTERIZED
PROTEIN

(Caenorhabditis
elegans) 		PF01156
(IU_nuc_hydro) 		4 ASP A 254
VAL A  39
GLY A  14
ALA A  48
 TRS  A 402 ( 2.5A)
None
None
None
 0.93A 5hwaA-5mj7A:
undetectable		 5hwaA-5mj7A:
20.77
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.
5nd1 CAPSID PROTEIN

(Rosellinia
necatrix
quadrivirus 1) 		no annotation 4 HIS B 686
VAL B 259
GLY B 354
ALA B 355
 None
 0.87A 5hwaA-5nd1B:
undetectable		 5hwaA-5nd1B:
13.13
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.
5nqd ARSENITE OXIDASE
LARGE SUBUNIT AIOA
[3FE-4S] CLUSTER,
MO-MOLYBDOPTERIN
COFACTOR-BINDING
ACTIVE SITE

(Rhizobium sp.
NT-26) 		no annotation 4 ASP A 488
HIS A 489
GLY A 551
ALA A 553
 None
 1.00A 5hwaA-5nqdA:
undetectable		 5hwaA-5nqdA:
16.32
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.
5ojs TRANSCRIPTION-ASSOCI
ATED PROTEIN 1

(Saccharomyces
cerevisiae) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT) 		4 ASP T1108
HIS T1109
GLY T2525
ALA T2528
 None
 0.90A 5hwaA-5ojsT:
undetectable		 5hwaA-5ojsT:
5.39
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.
5upy INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE

(Listeria
monocytogenes) 		PF00478
(IMPDH) 		4 HIS A  73
VAL A 249
GLY A  70
ALA A 224
 None
 0.86A 5hwaA-5upyA:
undetectable		 5hwaA-5upyA:
21.33
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.
5v9x ATP-DEPENDENT DNA
HELICASE

(Mycolicibacterium
smegmatis) 		no annotation 4 ASP A 715
VAL A 420
GLY A 609
ALA A 611
 None
 0.94A 5hwaA-5v9xA:
undetectable		 5hwaA-5v9xA:
13.89
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.
5vn6 TAURINE DIOXYGENASE

(Burkholderia
ambifaria) 		PF02668
(TauD) 		4 ASP A 100
VAL A  80
GLY A 275
ALA A 274
 MG  A 300 (-2.7A)
None
None
None
 0.99A 5hwaA-5vn6A:
undetectable		 5hwaA-5vn6A:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vnc GLYCOGEN [STARCH]
SYNTHASE ISOFORM 2

(Saccharomyces
cerevisiae) 		no annotation 4 HIS A 166
VAL A 147
GLY A 173
ALA A 175
 None
 0.99A 5hwaA-5vncA:
undetectable		 5hwaA-5vncA:
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.
5xh9 EXTRACELLULAR
INVERTASE

(Aspergillus
kawachii) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		4 ASP A 336
VAL A 523
GLY A 545
ALA A 544
 None
 0.94A 5hwaA-5xh9A:
undetectable		 5hwaA-5xh9A:
20.30
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.
5xya -

(-) 		no annotation 4 ASP A 341
VAL A 171
GLY A 144
ALA A 169
 None
 0.99A 5hwaA-5xyaA:
undetectable		 5hwaA-5xyaA:
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.
5y50 PROTEIN
DETOXIFICATION 14

(Arabidopsis
thaliana) 		no annotation 4 HIS A 386
VAL A 451
GLY A 391
ALA A 393
 None
 1.05A 5hwaA-5y50A:
undetectable		 5hwaA-5y50A:
15.70
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.
5y89 PUTATIVE HEMIN
TRANSPORT SYSTEM,
SUBSTRATE-BINDING
PROTEIN

(Burkholderia
cenocepacia) 		no annotation 4 HIS A 254
VAL A 241
GLY A 269
ALA A 268
 None
 0.87A 5hwaA-5y89A:
undetectable		 5hwaA-5y89A:
19.45
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.
5ykd D-HYDANTOINASE/DIHYD
ROPYRIMIDINASE

(Pseudomonas
aeruginosa) 		no annotation 4 ASP A  57
HIS A  59
GLY A 341
ALA A 340
 None
ZN  A 502 (-3.4A)
None
None
 0.94A 5hwaA-5ykdA:
undetectable		 5hwaA-5ykdA:
14.45
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.
6cza -

(-) 		no annotation 4 ASP A 128
VAL A 511
GLY A 818
ALA A 808
 None
 0.87A 5hwaA-6czaA:
undetectable		 5hwaA-6czaA:
undetectable