SIMILAR PATTERNS OF AMINO ACIDS FOR 3GWX_A_EPAA1_1

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.
1e51 DELTA-AMINOLEVULINIC
ACID DEHYDRATASE

(Homo sapiens) 		PF00490
(ALAD) 		5 VAL A  37
PHE A  36
ILE A  32
LEU A 108
LEU A  61
 None
 1.05A 3gwxA-1e51A:
0.0		 3gwxA-1e51A:
23.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ef1 MOESIN

(Homo sapiens) 		PF00373
(FERM_M)
PF09379
(FERM_N)
PF09380
(FERM_C) 		5 VAL A   7
LEU A  59
VAL A  70
VAL A  65
LEU A  29
 None
 1.00A 3gwxA-1ef1A:
undetectable		 3gwxA-1ef1A:
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.
1eh5 PALMITOYL PROTEIN
THIOESTERASE 1

(Bos taurus) 		PF02089
(Palm_thioest) 		5 PHE A 114
LEU A  99
VAL A 124
VAL A  95
LEU A  70
 None
 1.03A 3gwxA-1eh5A:
undetectable		 3gwxA-1eh5A:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fuj PR3

(Homo sapiens) 		PF00089
(Trypsin) 		5 VAL A  88
LEU A  33
VAL A  66
VAL A  64
LEU A  59
 None
 0.96A 3gwxA-1fujA:
undetectable		 3gwxA-1fujA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1g3n V-CYCLIN

(Human
gammaherpesvirus
8) 		PF00134
(Cyclin_N)
PF09080
(K-cyclin_vir_C) 		5 VAL C 206
ILE C 197
LEU C 224
VAL C 220
LEU C 162
 None
 1.05A 3gwxA-1g3nC:
0.0		 3gwxA-1g3nC:
22.52
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.
1n61 CARBON MONOXIDE
DEHYDROGENASE MEDIUM
CHAIN

(Oligotropha
carboxidovorans) 		PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C) 		5 ILE C 253
LEU C 275
VAL C 200
VAL C 279
LEU C 243
 None
 0.99A 3gwxA-1n61C:
0.0		 3gwxA-1n61C:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1p1a UV EXCISION REPAIR
PROTEIN RAD23
HOMOLOG B

(Homo sapiens) 		PF00240
(ubiquitin) 		5 VAL A  26
LEU A   8
VAL A   6
VAL A  73
LEU A  49
 None
 0.97A 3gwxA-1p1aA:
undetectable		 3gwxA-1p1aA:
16.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pix GLUTACONYL-COA
DECARBOXYLASE A
SUBUNIT

(Acidaminococcus
fermentans) 		PF01039
(Carboxyl_trans) 		5 VAL A 108
ILE A 205
VAL A 282
VAL A 101
LEU A  69
 None
 0.92A 3gwxA-1pixA:
0.0		 3gwxA-1pixA:
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.
1r3d CONSERVED
HYPOTHETICAL PROTEIN
VC1974

(Vibrio cholerae) 		PF12697
(Abhydrolase_6) 		5 VAL A  75
GLN A  73
LEU A 111
VAL A  85
LEU A  87
 None
 1.03A 3gwxA-1r3dA:
0.0		 3gwxA-1r3dA:
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.
1rhf TYROSINE-PROTEIN
KINASE RECEPTOR
TYRO3

(Homo sapiens) 		PF07679
(I-set) 		5 VAL A 152
LEU A 108
VAL A 110
VAL A 179
LEU A 118
 None
 0.98A 3gwxA-1rhfA:
undetectable		 3gwxA-1rhfA:
23.36
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.
1riw THROMBIN HEAVY
CHAIN, B

(Homo sapiens) 		PF00089
(Trypsin) 		5 ILE B 136
LEU B  54
VAL B  52
VAL B  97
LEU B 117
 None
 0.95A 3gwxA-1riwB:
undetectable		 3gwxA-1riwB:
20.61
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.
1uel UV EXCISION REPAIR
PROTEIN RAD23
HOMOLOG B

(Homo sapiens) 		PF00240
(ubiquitin) 		5 VAL A  23
LEU A   5
VAL A   3
VAL A  70
LEU A  46
 None
 0.95A 3gwxA-1uelA:
undetectable		 3gwxA-1uelA:
16.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v71 HYPOTHETICAL PROTEIN
C320.14 IN
CHROMOSOME III

(Schizosaccharomyces
pombe) 		PF00291
(PALP) 		5 PHE A  39
LEU A 168
VAL A  29
VAL A 172
LEU A 175
 None
 0.97A 3gwxA-1v71A:
undetectable		 3gwxA-1v71A:
20.40
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.
1x6m GLUTATHIONE-DEPENDEN
T
FORMALDEHYDE-ACTIVAT
ING ENZYME

(Paracoccus
denitrificans) 		PF04828
(GFA) 		5 ILE A  96
LEU A  78
VAL A  73
VAL A  44
LEU A  31
 SO4  A 501 (-4.2A)
None
None
None
None
 1.06A 3gwxA-1x6mA:
undetectable		 3gwxA-1x6mA:
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.
1xwc THIOREDOXIN

(Drosophila
melanogaster) 		PF00085
(Thioredoxin) 		6 VAL A  23
PHE A  80
ILE A  72
LEU A  11
VAL A   5
LEU A  15
 None
 1.48A 3gwxA-1xwcA:
undetectable		 3gwxA-1xwcA:
25.27
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.
1ycp EPSILON THROMBIN

(Bos taurus) 		PF00089
(Trypsin) 		5 ILE K 103
LEU K  33
VAL K  31
VAL K  66
LEU K  85
 None
 1.03A 3gwxA-1ycpK:
undetectable		 3gwxA-1ycpK:
25.33
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.
1yew PARTICULATE METHANE
MONOOXYGENASE, A
SUBUNIT
PARTICULATE METHANE
MONOOXYGENASE, B
SUBUNIT

(Methylococcus
capsulatus) 		PF02461
(AMO)
PF04744
(Monooxygenase_B) 		5 VAL B 169
GLN A 265
LEU A 180
VAL A 170
VAL A 178
 None
 1.07A 3gwxA-1yewB:
undetectable		 3gwxA-1yewB:
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.
1z5a TYPE II DNA
TOPOISOMERASE VI
SUBUNIT B

(Sulfolobus
shibatae) 		PF02518
(HATPase_c)
PF05833
(FbpA)
PF09239
(Topo-VIb_trans) 		5 VAL A 172
ILE A  69
VAL A 116
VAL A 112
LEU A  39
 None
None
None
ADP  A2001 (-4.0A)
None
 1.05A 3gwxA-1z5aA:
undetectable		 3gwxA-1z5aA:
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.
2ag1 BENZALDEHYDE LYASE

(Pseudomonas
fluorescens) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 VAL A 142
LEU A  22
VAL A  19
VAL A  69
LEU A  98
 None
 1.02A 3gwxA-2ag1A:
undetectable		 3gwxA-2ag1A:
18.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2aoq DNA MISMATCH REPAIR
PROTEIN MUTH

(Haemophilus
influenzae) 		PF02976
(MutH) 		5 GLN A 156
LEU A 117
VAL A 113
VAL A  95
LEU A 213
 None
 1.00A 3gwxA-2aoqA:
undetectable		 3gwxA-2aoqA:
21.94
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.
2atp T-CELL SURFACE
GLYCOPROTEIN CD8
ALPHA CHAIN

(Mus musculus) 		PF07686
(V-set) 		5 VAL A 116
PHE A 101
GLN A  41
LEU A  89
LEU A  24
 None
 1.05A 3gwxA-2atpA:
undetectable		 3gwxA-2atpA:
17.84
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.
2c40 INOSINE-URIDINE
PREFERRING
NUCLEOSIDE HYDROLASE
FAMILY PROTEIN

(Bacillus
anthracis) 		PF01156
(IU_nuc_hydro) 		5 LEU A  20
VAL A 248
VAL A  16
LEU A 224
LYS A 308
 None
 1.07A 3gwxA-2c40A:
undetectable		 3gwxA-2c40A:
19.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cu1 MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE 2

(Homo sapiens) 		PF00564
(PB1) 		5 VAL A  11
LEU A  64
VAL A  68
VAL A  28
LEU A  33
 None
 1.07A 3gwxA-2cu1A:
undetectable		 3gwxA-2cu1A:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gnp TRANSCRIPTIONAL
REGULATOR

(Streptococcus
pneumoniae) 		PF04198
(Sugar-bind) 		5 VAL A 311
ILE A  95
LEU A  77
VAL A  68
LEU A 293
 None
 0.99A 3gwxA-2gnpA:
undetectable		 3gwxA-2gnpA:
21.18
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.
2grj DEPHOSPHO-COA KINASE

(Thermotoga
maritima) 		PF01121
(CoaE) 		5 VAL A   5
ILE A 131
LEU A 164
VAL A 155
VAL A 168
 None
 1.06A 3gwxA-2grjA:
undetectable		 3gwxA-2grjA:
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.
2hjs USG-1 PROTEIN
HOMOLOG

(Pseudomonas
aeruginosa) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		5 ILE A 228
LEU A 309
VAL A 307
VAL A 297
LEU A 265
 None
 1.02A 3gwxA-2hjsA:
undetectable		 3gwxA-2hjsA:
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.
2htm PUTATIVE THIAMINE
BIOSYNTHESIS PROTEIN
THIS

(Thermus
thermophilus) 		PF02597
(ThiS) 		5 VAL E  19
LEU E  34
VAL E  32
VAL E  55
LEU E  49
 None
 0.97A 3gwxA-2htmE:
undetectable		 3gwxA-2htmE:
14.76
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.
2mqe OMPA DOMAIN PROTEIN
TRANSMEMBRANE
REGION-CONTAINING
PROTEIN

(Escherichia
coli) 		PF00691
(OmpA) 		5 ILE A 316
LEU A 264
VAL A 236
VAL A 260
LEU A 217
 None
 0.90A 3gwxA-2mqeA:
undetectable		 3gwxA-2mqeA:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2n2h PAIRED AMPHIPATHIC
HELIX PROTEIN SIN3A

(Mus musculus) 		PF08295
(Sin3_corepress) 		5 VAL B 633
ILE B 673
LEU B 685
VAL B 693
LEU B 658
 None
 0.93A 3gwxA-2n2hB:
undetectable		 3gwxA-2n2hB:
18.77
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.
2npt MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE 2

(Homo sapiens) 		PF00564
(PB1) 		5 VAL B  46
LEU B  99
VAL B 103
VAL B  63
LEU B  68
 None
 0.88A 3gwxA-2nptB:
undetectable		 3gwxA-2nptB:
18.85
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.
2nzj GTP-BINDING PROTEIN
REM 1

(Homo sapiens) 		PF00071
(Ras) 		5 VAL A 188
GLN A 242
LEU A  86
VAL A  84
LEU A 179
 None
 1.01A 3gwxA-2nzjA:
undetectable		 3gwxA-2nzjA:
20.66
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.
2ouc DUAL SPECIFICITY
PROTEIN PHOSPHATASE
10

(Homo sapiens) 		PF00581
(Rhodanese) 		5 VAL A 192
ILE A 150
LEU A 259
VAL A 255
VAL A 212
 None
 1.06A 3gwxA-2oucA:
undetectable		 3gwxA-2oucA:
20.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2p54 PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		7 PHE A 273
GLN A 277
ILE A 317
MET A 320
VAL A 332
LEU A 344
LYS A 358
 735  A 469 (-3.7A)
735  A 469 (-4.4A)
735  A 469 ( 4.8A)
None
735  A 469 (-3.8A)
735  A 469 ( 4.2A)
None
 0.49A 3gwxA-2p54A:
37.9		 3gwxA-2p54A:
70.52
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.
2pg6 CYTOCHROME P450 2A6

(Homo sapiens) 		PF00067
(p450) 		5 GLN A 150
ILE A 157
LEU A 310
VAL A 178
VAL A 306
 None
None
None
None
HEM  A 500 ( 4.3A)
 0.99A 3gwxA-2pg6A:
undetectable		 3gwxA-2pg6A:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pg6 CYTOCHROME P450 2A6

(Homo sapiens) 		PF00067
(p450) 		5 GLN A 150
LEU A 310
VAL A 178
VAL A 306
LEU A 449
 None
None
None
HEM  A 500 ( 4.3A)
None
 0.97A 3gwxA-2pg6A:
undetectable		 3gwxA-2pg6A:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2r1v DJ-1

(Homo sapiens) 		PF01965
(DJ-1_PfpI) 		5 ILE A 105
LEU A 166
VAL A 169
VAL A 181
LEU A 185
 None
 1.03A 3gwxA-2r1vA:
undetectable		 3gwxA-2r1vA:
20.50
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.
2v0j BIFUNCTIONAL PROTEIN
GLMU

(Haemophilus
influenzae) 		PF00132
(Hexapep)
PF12804
(NTP_transf_3) 		5 ILE A 109
LEU A  11
VAL A   9
VAL A  86
LEU A 198
 None
H2U  A1453 (-4.0A)
None
None
None
 0.89A 3gwxA-2v0jA:
undetectable		 3gwxA-2v0jA:
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.
2w4i GLUTAMATE RACEMASE

(Helicobacter
pylori) 		PF01177
(Asp_Glu_race) 		5 VAL A  90
ILE A  29
LEU A  19
VAL A  15
LEU A 218
 None
 1.02A 3gwxA-2w4iA:
undetectable		 3gwxA-2w4iA:
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.
2wfx HEDGEHOG-INTERACTING
PROTEIN

(Homo sapiens) 		PF07995
(GSDH) 		5 VAL B 562
GLN B 220
LEU B 535
VAL B 510
LEU B 505
 None
 0.98A 3gwxA-2wfxB:
undetectable		 3gwxA-2wfxB:
17.98
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.
2ww2 ALPHA-1,2-MANNOSIDAS
E

(Bacteroides
thetaiotaomicron) 		PF07971
(Glyco_hydro_92) 		5 VAL A 657
ILE A 675
LEU A 685
VAL A 683
VAL A 295
 None
 1.06A 3gwxA-2ww2A:
undetectable		 3gwxA-2ww2A:
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.
2yrl KIAA1837 PROTEIN

(Homo sapiens) 		PF00801
(PKD) 		5 VAL A  91
LEU A  53
VAL A  51
VAL A  63
LEU A  26
 None
 1.04A 3gwxA-2yrlA:
undetectable		 3gwxA-2yrlA:
16.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 PHE A 282
GLN A 286
ILE A 326
MET A 329
LEU A 353
LYS A 367
 MC5  A   1 (-4.4A)
None
MC5  A   1 ( 4.9A)
None
MC5  A   1 (-4.7A)
None
 0.65A 3gwxA-3b0qA:
36.2		 3gwxA-3b0qA:
61.68
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.
3bif PROTEIN
(6-PHOSPHOFRUCTO-2-K
INASE/
FRUCTOSE-2,6-BISPHOS
PHATASE)

(Rattus
norvegicus) 		PF00300
(His_Phos_1)
PF01591
(6PF2K) 		5 VAL A 387
LEU A 372
VAL A 322
VAL A 375
LEU A 397
 BOG  A 525 ( 4.8A)
None
None
BOG  A 525 (-3.8A)
None
 0.99A 3gwxA-3bifA:
undetectable		 3gwxA-3bifA:
19.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3d5f PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR DELTA

(Homo sapiens) 		PF00104
(Hormone_recep) 		10 VAL A 281
PHE A 282
GLN A 286
ILE A 326
MET A 329
LEU A 339
VAL A 341
VAL A 348
LEU A 353
LYS A 367
 L41  A 501 ( 4.7A)
L41  A 501 ( 4.9A)
None
None
None
L41  A 501 (-4.8A)
L41  A 501 ( 4.4A)
None
None
None
 0.40A 3gwxA-3d5fA:
39.9		 3gwxA-3d5fA:
99.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3d5f PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR DELTA

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 VAL A 281
PHE A 360
LEU A 339
VAL A 341
VAL A 348
LEU A 353
 L41  A 501 ( 4.7A)
None
L41  A 501 (-4.8A)
L41  A 501 ( 4.4A)
None
None
 1.31A 3gwxA-3d5fA:
39.9		 3gwxA-3d5fA:
99.63
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.
3ddh PUTATIVE HALOACID
DEHALOGENASE-LIKE
FAMILY HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF13419
(HAD_2) 		5 VAL A 220
LEU A 175
VAL A 177
LEU A 226
LYS A   2
 None
 0.97A 3gwxA-3ddhA:
undetectable		 3gwxA-3ddhA:
25.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		5 PHE D 282
GLN D 286
ILE D 326
MET D 329
LEU D 353
 None
None
PLB  D 701 ( 4.5A)
None
None
 0.70A 3gwxA-3dzuD:
34.3		 3gwxA-3dzuD:
42.43
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.
3ein GLUTATHIONE
S-TRANSFERASE 1-1

(Drosophila
melanogaster) 		PF00043
(GST_C)
PF02798
(GST_N) 		5 ILE A 158
LEU A  27
VAL A  25
VAL A   2
LEU A  56
 None
 0.96A 3gwxA-3einA:
undetectable		 3gwxA-3einA:
23.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gg4 GLYCEROL KINASE

(Yersinia
pseudotuberculosis) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 GLN A 150
LEU A 162
VAL A 159
VAL A  86
LEU A  84
 None
 0.97A 3gwxA-3gg4A:
undetectable		 3gwxA-3gg4A:
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.
3hiw VACUOLAR SAPORIN

(Saponaria
officinalis) 		PF00161
(RIP) 		5 ILE A 126
LEU A  65
VAL A  67
VAL A  54
LEU A  56
 None
 1.04A 3gwxA-3hiwA:
undetectable		 3gwxA-3hiwA:
21.26
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.
3hwj E3 UBIQUITIN-PROTEIN
LIGASE MYCBP2

(Mus musculus) 		PF08005
(PHR) 		5 VAL A1755
ILE A1809
LEU A1771
VAL A1773
LEU A1814
 None
 1.06A 3gwxA-3hwjA:
undetectable		 3gwxA-3hwjA:
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.
3ks2 CHAPERONE PROTEIN
IPGC

(Shigella
flexneri) 		PF07720
(TPR_3) 		5 VAL A 107
PHE A 108
GLN A 112
ILE A 150
LEU A 129
 None
 1.03A 3gwxA-3ks2A:
undetectable		 3gwxA-3ks2A:
16.73
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.
3mal STROMAL CELL-DERIVED
FACTOR 2-LIKE
PROTEIN

(Arabidopsis
thaliana) 		PF02815
(MIR) 		6 GLN A 166
ILE A 202
LEU A  54
VAL A 191
VAL A  70
LEU A 116
 None
 1.47A 3gwxA-3malA:
undetectable		 3gwxA-3malA:
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.
3nmb PUTATIVE SUGAR
HYDROLASE

(Bacteroides
ovatus) 		PF06439
(DUF1080) 		5 VAL A 286
PHE A 119
VAL A  56
VAL A  36
LEU A  38
 EDO  A   9 (-4.4A)
None
None
None
None
 0.90A 3gwxA-3nmbA:
undetectable		 3gwxA-3nmbA:
20.75
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.
3o82 PEPTIDE ARYLATION
ENZYME

(Acinetobacter
baumannii) 		PF00501
(AMP-binding) 		5 PHE A 167
LEU A  98
VAL A  83
VAL A  94
LEU A  66
 None
 0.81A 3gwxA-3o82A:
undetectable		 3gwxA-3o82A:
20.87
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.
3tgl TRIACYL-GLYCEROL
ACYLHYDROLASE

(Rhizomucor
miehei) 		PF01764
(Lipase_3) 		5 VAL A 138
LEU A 122
VAL A  66
VAL A 126
LEU A 157
 None
 0.96A 3gwxA-3tglA:
undetectable		 3gwxA-3tglA:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v98 ARACHIDONATE
5-LIPOXYGENASE

(Homo sapiens) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		5 VAL A  10
ILE A 626
LEU A 111
VAL A  67
LEU A  82
 None
 1.00A 3gwxA-3v98A:
undetectable		 3gwxA-3v98A:
16.25
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.
3va7 KLLA0E08119P

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 VAL A1375
PHE A1374
LEU A1385
VAL A1381
LEU A1404
 None
 0.92A 3gwxA-3va7A:
undetectable		 3gwxA-3va7A:
12.91
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.
3won DIPEPTIDYL
AMINOPEPTIDASE BII

(Pseudoxanthomonas
mexicana) 		PF10459
(Peptidase_S46) 		5 VAL A 206
LEU A 603
VAL A 644
VAL A 606
LEU A 622
 None
 1.04A 3gwxA-3wonA:
undetectable		 3gwxA-3wonA:
18.14
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.
3ze6 PERIPLASMIC [NIFESE]
HYDROGENASE, SMALL
SUBUNIT

(Desulfovibrio
vulgaris) 		PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		5 PHE A  11
LEU A 144
VAL A 153
VAL A 140
LEU A 105
 None
 0.79A 3gwxA-3ze6A:
undetectable		 3gwxA-3ze6A:
22.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aq1 SBSB PROTEIN

(Geobacillus
stearothermophilus) 		no annotation 5 VAL C 324
LEU C 375
VAL C 299
VAL C 367
LEU C 369
 None
 1.01A 3gwxA-4aq1C:
undetectable		 3gwxA-4aq1C:
15.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b28 METALLOPEPTIDASE,
FAMILY M24, PUTATIVE

(Roseobacter
denitrificans) 		PF00557
(Peptidase_M24) 		5 GLN A 423
ILE A 334
LEU A 350
VAL A 382
LEU A 397
 None
 1.02A 3gwxA-4b28A:
undetectable		 3gwxA-4b28A:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bj6 RAP1-INTERACTING
FACTOR 2

(Saccharomyces
cerevisiae) 		no annotation 5 VAL A 235
ILE A 251
VAL A 208
VAL A 194
LEU A 190
 None
 1.07A 3gwxA-4bj6A:
undetectable		 3gwxA-4bj6A:
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.
4ci8 ECHINODERM
MICROTUBULE-ASSOCIAT
ED PROTEIN-LIKE 1

(Homo sapiens) 		PF00400
(WD40)
PF03451
(HELP) 		5 VAL A 279
LEU A 256
VAL A 254
VAL A 247
LEU A 241
 None
 0.91A 3gwxA-4ci8A:
undetectable		 3gwxA-4ci8A:
19.69
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.
4d9r COMPLEMENT FACTOR D

(Homo sapiens) 		PF00089
(Trypsin) 		5 ILE A 176
LEU A 199
VAL A 213
VAL A 138
LEU A 160
 None
 1.06A 3gwxA-4d9rA:
undetectable		 3gwxA-4d9rA:
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.
4e4y SHORT CHAIN
DEHYDROGENASE FAMILY
PROTEIN

(Francisella
tularensis) 		PF13561
(adh_short_C2) 		5 VAL A  17
GLN A 210
VAL A 165
VAL A 120
LEU A 220
 None
 1.00A 3gwxA-4e4yA:
undetectable		 3gwxA-4e4yA:
23.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g5a UNCHARACTERIZED
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF11589
(DUF3244) 		5 VAL A 115
ILE A  83
LEU A  58
VAL A  47
LEU A  45
 None
 1.00A 3gwxA-4g5aA:
undetectable		 3gwxA-4g5aA:
17.62
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.
4gn1 RAS-ASSOCIATED AND
PLECKSTRIN HOMOLOGY
DOMAINS-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00169
(PH)
PF00788
(RA) 		5 VAL A 275
LEU A 333
VAL A 287
VAL A 296
LEU A 314
 None
 1.00A 3gwxA-4gn1A:
undetectable		 3gwxA-4gn1A:
23.73
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.
4hy3 PHOSPHOGLYCERATE
OXIDOREDUCTASE

(Rhizobium etli) 		PF02826
(2-Hacid_dh_C) 		5 VAL A 214
PHE A 213
ILE A 288
LEU A 254
VAL A 249
 None
 1.03A 3gwxA-4hy3A:
undetectable		 3gwxA-4hy3A:
21.39
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.
4hyy MEIOTIC
RECOMBINATION
PROTEIN DMC1/LIM15
HOMOLOG

(Homo sapiens) 		PF08423
(Rad51) 		5 VAL A 264
PHE A 265
LEU A 203
VAL A 206
LEU A 253
 None
 0.95A 3gwxA-4hyyA:
undetectable		 3gwxA-4hyyA:
24.16
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.
4lbw ELONGATION FACTOR
TU-A

(Thermus
thermophilus) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2) 		5 GLN A 125
LEU A 374
VAL A 349
VAL A 378
LEU A 380
 None
 0.99A 3gwxA-4lbwA:
undetectable		 3gwxA-4lbwA:
20.98
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.
4m75 U6 SNRNA-ASSOCIATED
SM-LIKE PROTEIN LSM6

(Saccharomyces
cerevisiae) 		PF01423
(LSM) 		5 VAL D  24
LEU D  73
VAL D  78
VAL D  47
LEU D  49
 None
 1.05A 3gwxA-4m75D:
undetectable		 3gwxA-4m75D:
19.18
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.
4n78 CYTOPLASMIC
FMR1-INTERACTING
PROTEIN 1

(Homo sapiens) 		PF05994
(FragX_IP)
PF07159
(DUF1394) 		5 GLN A1012
ILE A1004
LEU A 847
VAL A 929
VAL A 843
 None
 1.05A 3gwxA-4n78A:
undetectable		 3gwxA-4n78A:
12.82
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.
4n78 CYTOPLASMIC
FMR1-INTERACTING
PROTEIN 1

(Homo sapiens) 		PF05994
(FragX_IP)
PF07159
(DUF1394) 		5 ILE A1004
LEU A 847
VAL A 929
VAL A 843
LEU A 792
 None
 1.04A 3gwxA-4n78A:
undetectable		 3gwxA-4n78A:
12.82
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.
4rvc ABC TRANSPORTER
ATP-BINDING PROTEIN

(Geobacillus
kaustophilus) 		PF00005
(ABC_tran) 		5 VAL A  22
ILE A  50
LEU A  34
VAL A 205
LEU A 207
 None
 1.06A 3gwxA-4rvcA:
undetectable		 3gwxA-4rvcA:
24.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u67 50S RIBOSOMAL
PROTEIN L30

(Deinococcus
radiodurans) 		PF00327
(Ribosomal_L30) 		5 VAL W  34
LEU W  51
VAL W  53
VAL W  44
LEU W  23
 None
 0.97A 3gwxA-4u67W:
undetectable		 3gwxA-4u67W:
12.70
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.
4xgc ORIGIN RECOGNITION
COMPLEX SUBUNIT 4

(Drosophila
melanogaster) 		PF13191
(AAA_16)
PF14629
(ORC4_C) 		5 PHE D 127
LEU D  84
VAL D  86
VAL D 142
LEU D 132
 None
 1.04A 3gwxA-4xgcD:
undetectable		 3gwxA-4xgcD:
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.
5bqm SOMATOLIBERIN,BOTULI
NUM NEUROTOXIN TYPE
D

(Clostridium
botulinum;
Homo sapiens) 		PF07952
(Toxin_trans) 		5 ILE B 834
LEU B 647
VAL B 667
VAL B 651
LEU B 626
 None
 1.06A 3gwxA-5bqmB:
undetectable		 3gwxA-5bqmB:
20.37
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.
5dhm IMMUNOREACTIVE 32
KDA ANTIGEN

(Porphyromonas
gingivalis) 		no annotation 5 VAL C 100
LEU C 177
VAL C 175
VAL C 116
LEU C  66
 None
 0.82A 3gwxA-5dhmC:
undetectable		 3gwxA-5dhmC:
19.93
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.
5ep1 PUTATIVE REPRESSOR
PROTEIN LUXO

(Photobacterium
angustum) 		PF00158
(Sigma54_activat) 		5 GLN A 259
LEU A 238
VAL A 276
VAL A 230
LEU A 211
 None
 1.07A 3gwxA-5ep1A:
undetectable		 3gwxA-5ep1A:
20.72
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.
5ets 2-AMINO-4-HYDROXY-6-
HYDROXYMETHYLDIHYDRO
PTERIDINE
PYROPHOSPHOKINASE

(Staphylococcus
aureus) 		no annotation 5 GLN B  69
ILE B   2
LEU B   6
VAL B  96
LEU B  26
 None
 1.05A 3gwxA-5etsB:
undetectable		 3gwxA-5etsB:
23.05
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.
5fhz ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3

(Homo sapiens) 		PF00171
(Aldedh) 		5 VAL A 107
GLN A 102
LEU A 191
VAL A 188
LEU A 216
 None
 1.06A 3gwxA-5fhzA:
undetectable		 3gwxA-5fhzA:
18.55
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.
5i8i UREA AMIDOLYASE

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF01425
(Amidase)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 VAL A1375
PHE A1374
LEU A1385
VAL A1381
LEU A1404
 None
 0.92A 3gwxA-5i8iA:
undetectable		 3gwxA-5i8iA:
9.18
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.
5jsy PERIPLASMIC [NIFESE]
HYDROGENASE, SMALL
SUBUNIT

(Desulfovibrio
vulgaris) 		PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		5 PHE A  11
LEU A 144
VAL A 153
VAL A 140
LEU A 105
 None
 0.75A 3gwxA-5jsyA:
undetectable		 3gwxA-5jsyA:
20.18
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.
5kdx METALLOPEPTIDASE

(Pseudomonas
aeruginosa) 		PF13402
(Peptidase_M60) 		5 VAL A 222
PHE A 248
LEU A 158
VAL A 162
LEU A 144
 None
 0.91A 3gwxA-5kdxA:
undetectable		 3gwxA-5kdxA:
14.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lfr MYELIN-ASSOCIATED
GLYCOPROTEIN

(Mus musculus) 		PF08205
(C2-set_2)
PF13927
(Ig_3) 		5 VAL A 249
LEU A 292
VAL A 295
VAL A 257
LEU A 259
 NAG  A 408 (-4.4A)
None
None
NAG  A 408 ( 4.4A)
None
 0.99A 3gwxA-5lfrA:
undetectable		 3gwxA-5lfrA:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mz9 -

(-) 		no annotation 5 VAL A 325
ILE A 385
LEU A  79
VAL A 111
LEU A 132
 None
 0.99A 3gwxA-5mz9A:
undetectable		 3gwxA-5mz9A:
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.
5nd1 CAPSID PROTEIN

(Rosellinia
necatrix
quadrivirus 1) 		no annotation 5 GLN B 485
LEU B 397
VAL B 232
VAL B 228
LEU B 401
 None
 1.01A 3gwxA-5nd1B:
undetectable		 3gwxA-5nd1B:
17.72
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.
5nf4 MINOR FIMBRIUM TIP
SUBUNIT MFA3

(Porphyromonas
gingivalis) 		no annotation 5 VAL A  71
LEU A  38
VAL A  40
VAL A  99
LEU A 101
 None
 1.02A 3gwxA-5nf4A:
undetectable		 3gwxA-5nf4A:
13.65
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.
5tdg FUSION GLYCOPROTEIN
F0,FIBRITIN

(Bovine
orthopneumovirus;
Enterobacteria
phage T4 sensu
lato) 		PF00523
(Fusion_gly)
PF07921
(Fibritin_C) 		5 VAL A 187
LEU A 158
VAL A 300
VAL A 154
LEU A 181
 None
 1.03A 3gwxA-5tdgA:
undetectable		 3gwxA-5tdgA:
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.
5to3 PROTHROMBIN,THROMBOM
ODULIN

(Homo sapiens) 		PF00089
(Trypsin)
PF09064
(Tme5_EGF_like) 		5 ILE B 115
LEU B  33
VAL B  31
VAL B  76
LEU B  96
 None
 1.07A 3gwxA-5to3B:
undetectable		 3gwxA-5to3B:
20.55
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.
5vi6 HISTONE DEACETYLASE
8

(Homo sapiens) 		PF00850
(Hist_deacetyl) 		5 ILE A 284
LEU A 248
VAL A 247
VAL A 251
LEU A 173
 None
 0.91A 3gwxA-5vi6A:
undetectable		 3gwxA-5vi6A:
21.72
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.
5vto BLASTICIDIN M

(Streptomyces
griseochromogenes) 		no annotation 5 GLN A  53
ILE A  47
LEU A 119
VAL A 117
VAL A 144
 None
 1.07A 3gwxA-5vtoA:
undetectable		 3gwxA-5vtoA:
17.47
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.
5vvo PROTEIN O-GLCNACASE

(Homo sapiens) 		PF07555
(NAGidase) 		5 PHE A 133
ILE A 137
LEU A 248
VAL A 276
LEU A 311
 None
 1.03A 3gwxA-5vvoA:
undetectable		 3gwxA-5vvoA:
19.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xtb NADH DEHYDROGENASE
[UBIQUINONE]
FLAVOPROTEIN 2,
MITOCHONDRIAL

(Homo sapiens) 		PF01257
(2Fe-2S_thioredx) 		5 VAL O 107
ILE O  95
LEU O  83
VAL O 115
VAL O  79
 None
 1.05A 3gwxA-5xtbO:
undetectable		 3gwxA-5xtbO:
19.86
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.
5xw6 P2X PURINOCEPTOR

(Gallus gallus) 		no annotation 5 ILE C  82
LEU C  65
VAL C  63
VAL C 178
LEU C 219
 None
None
None
128  C 502 (-4.7A)
None
 0.89A 3gwxA-5xw6C:
undetectable		 3gwxA-5xw6C:
20.23
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.
5yb7 L-AMINO ACID
OXIDASE/MONOOXYGENAS
E

(Pseudomonas sp.
AIU 813) 		no annotation 5 VAL A 268
ILE A  50
VAL A 521
VAL A 517
LEU A  83
 None
None
None
FAD  A 601 (-3.9A)
FAD  A 601 (-4.1A)
 1.00A 3gwxA-5yb7A:
undetectable		 3gwxA-5yb7A:
17.94
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.
5ygf GH18329P

(Drosophila
melanogaster) 		no annotation 5 VAL A 276
ILE A 403
LEU A 384
VAL A 448
LEU A 450
 None
 1.07A 3gwxA-5ygfA:
undetectable		 3gwxA-5ygfA:
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.
6b5c KATANIN P60
ATPASE-CONTAINING
SUBUNIT A-LIKE 1

(Homo sapiens) 		no annotation 6 VAL A 272
PHE A 305
ILE A 364
LEU A 332
VAL A 328
VAL A 289
 None
 1.42A 3gwxA-6b5cA:
undetectable		 3gwxA-6b5cA:
14.01
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.
6fhs RUVB-LIKE HELICASE

(Chaetomium
thermophilum) 		no annotation 5 GLN A 409
ILE A 375
LEU A 387
VAL A 385
VAL A 426
 None
ADP  A 501 (-3.9A)
None
None
None
 1.07A 3gwxA-6fhsA:
undetectable		 3gwxA-6fhsA:
16.22