SIMILAR PATTERNS OF AMINO ACIDS FOR 3W68_B_VIVB301

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.
1fw8 PHOSPHOGLYCERATE
KINASE

(Saccharomyces
cerevisiae) 		PF00162
(PGK) 		5 ILE A  88
LEU A   5
VAL A  31
PHE A 363
VAL A  27
 None
 1.07A 3w68B-1fw8A:
0.0		 3w68B-1fw8A:
19.81
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.
1gwi CYTOCHROME P450
154C1

(Streptomyces
coelicolor) 		PF00067
(p450) 		5 LEU A 131
VAL A 141
ILE A 251
PHE A 376
VAL A 404
 None
 1.00A 3w68B-1gwiA:
undetectable		 3w68B-1gwiA:
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.
1jv1 GLCNAC1P
URIDYLTRANSFERASE
ISOFORM 1: AGX1

(Homo sapiens) 		PF01704
(UDPGP) 		5 ILE A 164
PHE A 194
ILE A 247
LEU A 338
VAL A 342
 None
 1.11A 3w68B-1jv1A:
1.9		 3w68B-1jv1A:
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.
1mpp PEPSIN

(Rhizomucor
pusillus) 		PF00026
(Asp) 		5 TYR A 133
VAL A  91
LEU A  29
PHE A  31
VAL A  18
 None
 0.99A 3w68B-1mppA:
undetectable		 3w68B-1mppA:
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.
1mzj BETA-KETOACYLSYNTHAS
E III

(Streptomyces
sp. R1128) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		6 VAL A 143
LEU A  15
VAL A 302
PHE A 124
ILE A 183
LEU A 329
 None
 1.42A 3w68B-1mzjA:
undetectable		 3w68B-1mzjA:
23.19
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.
1o4v PHOSPHORIBOSYLAMINOI
MIDAZOLE MUTASE PURE

(Thermotoga
maritima) 		PF00731
(AIRC) 		5 LEU A  24
VAL A  85
ILE A 128
LEU A 124
VAL A 113
 None
 1.12A 3w68B-1o4vA:
1.4		 3w68B-1o4vA:
21.27
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.
1q5m PROSTAGLANDIN-E2
9-REDUCTASE

(Oryctolagus
cuniculus) 		PF00248
(Aldo_ket_red) 		5 VAL A 191
LEU A 268
VAL A   8
ILE A 115
LEU A 113
 None
NDP  A1003 (-4.1A)
None
None
None
 1.11A 3w68B-1q5mA:
1.4		 3w68B-1q5mA:
21.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qlb FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT
FUMARATE REDUCTASE
IRON-SULFUR PROTEIN

(Wolinella
succinogenes;
Wolinella
succinogenes) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C)
PF13085
(Fer2_3)
PF13183
(Fer4_8) 		5 TYR A 521
ILE A 182
VAL A 230
PHE B  53
VAL B  56
 None
None
None
None
FES  B1240 (-4.8A)
 0.97A 3w68B-1qlbA:
undetectable		 3w68B-1qlbA:
17.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1r5l PROTEIN
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)

(Homo sapiens) 		PF00650
(CRAL_TRIO)
PF03765
(CRAL_TRIO_N) 		9 TYR A 100
ILE A 119
TRP A 122
VAL A 132
SER A 136
LEU A 137
PHE A 158
PHE A 187
VAL A 191
 None
None
None
VIV  A 301 ( 4.7A)
VIV  A 301 (-3.5A)
VIV  A 301 ( 4.8A)
VIV  A 301 (-3.9A)
VIV  A 301 (-3.9A)
VIV  A 301 (-4.7A)
 0.45A 3w68B-1r5lA:
37.9		 3w68B-1r5lA:
89.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1r5l PROTEIN
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)

(Homo sapiens) 		PF00650
(CRAL_TRIO)
PF03765
(CRAL_TRIO_N) 		9 TYR A 100
ILE A 119
TRP A 122
VAL A 132
SER A 136
LEU A 137
VAL A 191
PHE A 158
PHE A 187
 None
None
None
VIV  A 301 ( 4.7A)
VIV  A 301 (-3.5A)
VIV  A 301 ( 4.8A)
VIV  A 301 (-4.7A)
VIV  A 301 (-3.9A)
VIV  A 301 (-3.9A)
 1.40A 3w68B-1r5lA:
37.9		 3w68B-1r5lA:
89.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1r5l PROTEIN
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)

(Homo sapiens) 		PF00650
(CRAL_TRIO)
PF03765
(CRAL_TRIO_N) 		10 TYR A 100
ILE A 119
TRP A 122
VAL A 132
SER A 136
PHE A 158
ILE A 179
LEU A 183
PHE A 187
VAL A 191
 None
None
None
VIV  A 301 ( 4.7A)
VIV  A 301 (-3.5A)
VIV  A 301 (-3.9A)
VIV  A 301 ( 4.0A)
None
VIV  A 301 (-3.9A)
VIV  A 301 (-4.7A)
 0.38A 3w68B-1r5lA:
37.9		 3w68B-1r5lA:
89.10
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.
1rcy RUSTICYANIN

(Acidithiobacillus
ferrooxidans) 		PF00127
(Copper-bind) 		5 TYR A  96
ILE A 102
ILE A 152
LEU A  64
VAL A  56
 None
 1.13A 3w68B-1rcyA:
undetectable		 3w68B-1rcyA:
17.78
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.
1rni ORF904

(Sulfolobus
islandicus) 		PF09250
(Prim-Pol) 		6 ILE A 169
LEU A 247
VAL A 108
PHE A 112
LEU A 224
VAL A 148
 None
 1.29A 3w68B-1rniA:
undetectable		 3w68B-1rniA:
18.37
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.
1t5r LUKS-PV

(Staphylococcus
phage PVL) 		PF07968
(Leukocidin) 		5 VAL A 280
PHE A  33
ILE A 228
LEU A  82
VAL A 214
 None
 1.11A 3w68B-1t5rA:
undetectable		 3w68B-1t5rA:
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.
1v4v UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Thermus
thermophilus) 		PF02350
(Epimerase_2) 		5 VAL A 294
LEU A 314
VAL A 327
LEU A 299
VAL A 324
 None
 1.14A 3w68B-1v4vA:
undetectable		 3w68B-1v4vA:
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.
1vjo ALANINE--GLYOXYLATE
AMINOTRANSFERASE

(Nostoc sp. PCC
7120) 		PF00266
(Aminotran_5) 		5 LEU A 179
PHE A 220
ILE A 227
LEU A 230
VAL A 237
 None
 1.14A 3w68B-1vjoA:
undetectable		 3w68B-1vjoA:
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.
1wyp CALPONIN 1

(Homo sapiens) 		PF00307
(CH) 		5 ILE A  76
VAL A 108
LEU A 113
PHE A  79
ILE A  26
 None
 1.02A 3w68B-1wypA:
undetectable		 3w68B-1wypA:
18.94
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.
1xje RIBONUCLEOTIDE
REDUCTASE,
B12-DEPENDENT

(Thermotoga
maritima) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC) 		5 VAL A  52
PHE A  87
ILE A 494
LEU A  94
VAL A  48
 None
None
GDP  A1002 (-3.9A)
None
None
 1.02A 3w68B-1xjeA:
1.2		 3w68B-1xjeA:
18.97
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.
1xmp PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE

(Bacillus
anthracis) 		PF00731
(AIRC) 		5 LEU A  25
VAL A  86
ILE A 131
LEU A 127
VAL A 114
 None
 1.11A 3w68B-1xmpA:
undetectable		 3w68B-1xmpA:
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.
1y8t HYPOTHETICAL PROTEIN
RV0983

(Mycobacterium
tuberculosis) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		5 ILE A 216
VAL A  19
ILE A  51
LEU A  22
VAL A  20
 None
 0.98A 3w68B-1y8tA:
undetectable		 3w68B-1y8tA:
22.66
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.
1y8x UBIQUITIN-CONJUGATIN
G ENZYME E2 M

(Homo sapiens) 		PF00179
(UQ_con) 		5 TYR A  86
ILE A  34
ILE A 129
LEU A 132
VAL A 110
 None
 1.08A 3w68B-1y8xA:
undetectable		 3w68B-1y8xA:
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.
1zjj HYPOTHETICAL PROTEIN
PH1952

(Pyrococcus
horikoshii) 		PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6) 		5 VAL A 229
LEU A 248
PHE A   6
LEU A 260
VAL A   2
 None
 1.07A 3w68B-1zjjA:
undetectable		 3w68B-1zjjA:
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.
2ahw PUTATIVE ENZYME YDIF

(Escherichia
coli) 		PF01144
(CoA_trans) 		5 ILE A 315
VAL A 373
LEU A 462
ILE A 405
VAL A 387
 None
None
None
COA  A2600 (-4.6A)
None
 1.14A 3w68B-2ahwA:
undetectable		 3w68B-2ahwA:
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.
2dmc FILAMIN-B

(Homo sapiens) 		PF00630
(Filamin) 		5 VAL A  85
ILE A  71
LEU A  37
PHE A  35
VAL A  99
 None
 1.10A 3w68B-2dmcA:
undetectable		 3w68B-2dmcA:
18.56
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.
2f6k METAL-DEPENDENT
HYDROLASE

(Lactobacillus
plantarum) 		PF04909
(Amidohydro_2) 		5 VAL A 236
ILE A 185
LEU A 188
PHE A 192
VAL A 232
 None
 1.05A 3w68B-2f6kA:
undetectable		 3w68B-2f6kA:
21.12
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.
2fnu AMINOTRANSFERASE

(Helicobacter
pylori) 		PF01041
(DegT_DnrJ_EryC1) 		5 TYR A 130
ILE A  82
SER A 346
LEU A 347
LEU A 302
 None
 0.93A 3w68B-2fnuA:
undetectable		 3w68B-2fnuA:
23.32
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.
2hsn METHIONYL-TRNA
SYNTHETASE,
CYTOPLASMIC
GU4 NUCLEIC-BINDING
PROTEIN 1

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF09635
(MetRS-N)
no annotation 		5 TYR A  94
SER B  39
LEU A  86
VAL B  75
VAL B  72
 None
 1.00A 3w68B-2hsnA:
undetectable		 3w68B-2hsnA:
20.36
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.
2nvu NEDD8-CONJUGATING
ENZYME UBC12

(Homo sapiens) 		PF00179
(UQ_con) 		5 TYR C  86
ILE C  34
ILE C 129
LEU C 132
VAL C 110
 None
 1.11A 3w68B-2nvuC:
undetectable		 3w68B-2nvuC:
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.
2o0x 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE

(Mycobacterium
tuberculosis) 		PF00275
(EPSP_synthase) 		5 SER A 315
VAL A 252
ILE A 273
LEU A 277
VAL A 251
 None
 0.95A 3w68B-2o0xA:
undetectable		 3w68B-2o0xA:
23.08
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.
2pbi REGULATOR OF
G-PROTEIN SIGNALING
9
GUANINE
NUCLEOTIDE-BINDING
PROTEIN SUBUNIT BETA
5

(Mus musculus;
Mus musculus) 		PF00610
(DEP)
PF00615
(RGS)
PF00631
(G-gamma)
PF00400
(WD40) 		5 ILE A 247
SER B 292
VAL B 309
LEU B  48
VAL B 318
 None
None
None
GOL  A 905 ( 3.4A)
None
 1.10A 3w68B-2pbiA:
undetectable		 3w68B-2pbiA:
19.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pzi PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNG

(Mycobacterium
tuberculosis) 		PF00069
(Pkinase)
PF16918
(PknG_TPR)
PF16919
(PknG_rubred) 		5 ILE A 282
LEU A 340
VAL A 399
LEU A 369
VAL A 395
 None
 1.08A 3w68B-2pziA:
undetectable		 3w68B-2pziA:
16.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q0x UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei) 		PF08538
(DUF1749) 		5 TRP A  68
LEU A 140
VAL A  75
ILE A 135
LEU A 125
 None
 1.03A 3w68B-2q0xA:
2.5		 3w68B-2q0xA:
22.32
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.
2v9h OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTOR YAET

(Escherichia
coli) 		PF07244
(POTRA) 		5 SER A  45
LEU A  43
VAL A  75
LEU A  34
VAL A  88
 None
 1.09A 3w68B-2v9hA:
undetectable		 3w68B-2v9hA:
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.
2wia FERROUS IRON
TRANSPORT PROTEIN B

(Klebsiella
pneumoniae) 		PF02421
(FeoB_N) 		5 VAL A 175
LEU A 172
ILE A 255
LEU A 137
VAL A 117
 None
 1.06A 3w68B-2wiaA:
undetectable		 3w68B-2wiaA:
20.14
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.
2wjs LAMININ SUBUNIT
ALPHA-2

(Mus musculus) 		PF00054
(Laminin_G_1) 		5 ILE A2673
LEU A2656
VAL A2525
ILE A2584
LEU A2548
 None
 0.98A 3w68B-2wjsA:
undetectable		 3w68B-2wjsA:
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.
2wsm HYDROGENASE
EXPRESSION/FORMATION
PROTEIN (HYPB)

(Archaeoglobus
fulgidus) 		PF02492
(cobW) 		5 ILE A 191
VAL A 134
ILE A 211
LEU A 212
VAL A  58
 None
 1.00A 3w68B-2wsmA:
undetectable		 3w68B-2wsmA:
23.74
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.
2z2z TK-SUBTILISIN
PRECURSOR

(Thermococcus
kodakarensis) 		PF00082
(Peptidase_S8) 		5 TRP A 131
VAL A 133
LEU A 136
VAL A  30
VAL A  40
 None
 1.01A 3w68B-2z2zA:
undetectable		 3w68B-2z2zA:
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.
3ada SARCOSINE OXIDASE
BETA SUBUNIT

(Corynebacterium
sp. U-96) 		PF01266
(DAO) 		5 ILE B 338
SER B  84
LEU B  85
PHE B 101
VAL B 175
 None
 1.09A 3w68B-3adaB:
undetectable		 3w68B-3adaB:
21.25
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.
3aq2 6B PROTEIN

(Agrobacterium
vitis) 		PF02027
(RolB_RolC) 		5 SER A 137
LEU A  56
ILE A 190
LEU A  81
VAL A  65
 None
 0.96A 3w68B-3aq2A:
undetectable		 3w68B-3aq2A:
22.89
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.
3b9e CHITINASE A

(Vibrio harveyi) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		5 ILE A 519
VAL A 468
PHE A 522
ILE A 502
LEU A 488
 None
 1.14A 3w68B-3b9eA:
1.6		 3w68B-3b9eA:
17.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bol 5-METHYLTETRAHYDROFO
LATE S-HOMOCYSTEINE
METHYLTRANSFERASE

(Thermotoga
maritima) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		5 ILE A 492
VAL A 310
ILE A 435
LEU A 409
VAL A 303
 None
 1.08A 3w68B-3bolA:
undetectable		 3w68B-3bolA:
19.07
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.
3bol 5-METHYLTETRAHYDROFO
LATE S-HOMOCYSTEINE
METHYLTRANSFERASE

(Thermotoga
maritima) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		6 ILE A 495
SER A 534
VAL A 310
ILE A 435
LEU A 409
VAL A 303
 None
 1.23A 3w68B-3bolA:
undetectable		 3w68B-3bolA:
19.07
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.
3dkh LACCASE-1

(Melanocarpus
albomyces) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 VAL A 442
VAL A 408
ILE A 419
LEU A 359
VAL A 406
 None
None
None
None
NAG  A 740 (-4.1A)
 1.09A 3w68B-3dkhA:
undetectable		 3w68B-3dkhA:
20.04
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.
3e9k KYNURENINASE

(Homo sapiens) 		PF00266
(Aminotran_5) 		5 ILE A  69
PHE A 450
ILE A 457
LEU A 458
VAL A 388
 None
 1.13A 3w68B-3e9kA:
undetectable		 3w68B-3e9kA:
20.99
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.
3ggn UNCHARACTERIZED
PROTEIN DR_A0006

(Deinococcus
radiodurans) 		PF03364
(Polyketide_cyc) 		5 ILE A  84
VAL A  50
VAL A  90
LEU A 132
VAL A 105
 None
 1.10A 3w68B-3ggnA:
undetectable		 3w68B-3ggnA:
21.51
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.
3gnq GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE, TYPE
I

(Burkholderia
pseudomallei) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 VAL A  92
LEU A  29
ILE A   6
LEU A  17
VAL A  69
 None
 1.07A 3w68B-3gnqA:
undetectable		 3w68B-3gnqA:
22.85
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.
3gr5 ESCC

(Escherichia
coli) 		no annotation 5 SER A 163
LEU A 166
ILE A 118
LEU A 122
VAL A 131
 None
 1.09A 3w68B-3gr5A:
undetectable		 3w68B-3gr5A:
20.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iyl VP1

(Aquareovirus C) 		PF06016
(Reovirus_L2) 		5 VAL W1149
LEU W1196
VAL W1176
LEU W1192
VAL W1165
 None
 0.86A 3w68B-3iylW:
undetectable		 3w68B-3iylW:
11.44
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.
3k1j ATP-DEPENDENT
PROTEASE LON

(Thermococcus
onnurineus) 		PF01078
(Mg_chelatase)
PF05362
(Lon_C)
PF13654
(AAA_32) 		5 ILE A 503
LEU A 551
VAL A 443
ILE A 627
LEU A 610
 None
 0.99A 3w68B-3k1jA:
undetectable		 3w68B-3k1jA:
19.19
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.
3k5h PHOSPHORIBOSYL-AMINO
IMIDAZOLE
CARBOXYLASE

(Aspergillus
clavatus) 		PF01262
(AlaDh_PNT_C)
PF02222
(ATP-grasp) 		5 ILE A 101
VAL A  69
ILE A 272
LEU A  19
VAL A   7
 None
 1.14A 3w68B-3k5hA:
undetectable		 3w68B-3k5hA:
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.
3m1m ORF904

(Sulfolobus
islandicus) 		PF09250
(Prim-Pol)
PF13010
(pRN1_helical) 		5 LEU A 247
VAL A 108
PHE A 112
LEU A 224
VAL A 148
 None
 1.07A 3w68B-3m1mA:
undetectable		 3w68B-3m1mA:
21.87
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.
3msg INTRA-CELLULAR
XYLANASE IXT6

(Geobacillus
stearothermophilus) 		PF00331
(Glyco_hydro_10) 		5 SER A 147
ILE A 153
LEU A 107
PHE A 101
VAL A  93
 None
 0.95A 3w68B-3msgA:
undetectable		 3w68B-3msgA:
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.
3mzk PROTEIN TRANSPORT
PROTEIN SEC16

(Saccharomyces
cerevisiae) 		PF12931
(Sec16_C)
PF12932
(Sec16) 		5 TYR B1318
ILE B1321
ILE B1098
LEU B1239
VAL B1256
 None
 1.10A 3w68B-3mzkB:
undetectable		 3w68B-3mzkB:
23.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pps LACCASE

(Thielavia
arenaria) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 VAL A 443
VAL A 408
ILE A 419
LEU A 359
VAL A 406
 None
None
None
NAG  A 760 (-4.1A)
NAG  A 760 ( 4.5A)
 1.13A 3w68B-3ppsA:
undetectable		 3w68B-3ppsA:
18.15
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.
3t66 NICKEL ABC
TRANSPORTER
(NICKEL-BINDING
PROTEIN)

(Bacillus
halodurans) 		PF00496
(SBP_bac_5) 		5 LEU A  75
PHE A 133
ILE A 115
LEU A  96
VAL A 142
 None
 1.02A 3w68B-3t66A:
undetectable		 3w68B-3t66A:
20.81
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.
3ttk POLYAMINE TRANSPORT
PROTEIN

(Pseudomonas
aeruginosa) 		PF13416
(SBP_bac_8) 		5 VAL A 308
VAL A  81
ILE A 301
LEU A 296
VAL A 277
 None
 1.14A 3w68B-3ttkA:
undetectable		 3w68B-3ttkA:
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.
3twi VARIABLE LYMPHOCYTE
RECEPTOR B

(Petromyzon
marinus) 		PF01462
(LRRNT)
PF13855
(LRR_8) 		5 ILE D 106
LEU D  54
ILE D  61
LEU D  64
VAL D  92
 None
 1.02A 3w68B-3twiD:
undetectable		 3w68B-3twiD:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vv3 DESEASIN MCP-01

(Pseudoalteromonas
sp. SM9913) 		PF00082
(Peptidase_S8) 		5 ILE A 253
SER A 171
ILE A 224
PHE A 195
VAL A 167
 None
 1.08A 3w68B-3vv3A:
undetectable		 3w68B-3vv3A:
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.
3vwx GLUTATHIONE
S-TRANSFERASE 6B

(Musca domestica) 		PF00043
(GST_C)
PF13417
(GST_N_3) 		5 ILE A 115
VAL A 213
VAL A  15
LEU A  36
VAL A  55
 None
None
None
GSH  A 500 (-4.4A)
GSH  A 500 (-3.9A)
 1.13A 3w68B-3vwxA:
undetectable		 3w68B-3vwxA:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zpp CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN

(Streptococcus
pneumoniae) 		PF12708
(Pectate_lyase_3)
PF13229
(Beta_helix) 		5 VAL A 404
VAL A 486
ILE A 473
LEU A 510
VAL A 513
 None
 1.03A 3w68B-3zppA:
undetectable		 3w68B-3zppA:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c30 DNA HELICASE II

(Deinococcus
radiodurans) 		PF00580
(UvrD-helicase)
PF13361
(UvrD_C) 		5 ILE A 260
LEU A 645
ILE A 583
LEU A 622
VAL A 296
 None
 1.13A 3w68B-4c30A:
undetectable		 3w68B-4c30A:
17.23
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.
4d9i DIAMINOPROPIONATE
AMMONIA-LYASE

(Escherichia
coli) 		PF00291
(PALP) 		5 TYR A 385
VAL A 389
LEU A 319
VAL A 373
LEU A  53
 None
 1.01A 3w68B-4d9iA:
undetectable		 3w68B-4d9iA:
19.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4e5k PHOSPHITE
DEHYDROGENASE
(THERMOSTABLE
VARIANT)

(Pseudomonas
stutzeri) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 ILE A 109
VAL A 148
VAL A 241
LEU A 208
VAL A 240
 None
None
None
NAD  A 401 (-4.5A)
None
 1.13A 3w68B-4e5kA:
undetectable		 3w68B-4e5kA:
20.12
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.
4h1x PHOSPHATE-BINDING
PROTEIN PSTS 2

(Streptococcus
pneumoniae) 		PF12849
(PBP_like_2) 		6 ILE A  58
VAL A  87
PHE A 280
ILE A 111
LEU A 109
VAL A 262
 None
 1.29A 3w68B-4h1xA:
undetectable		 3w68B-4h1xA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h40 PUTATIVE CELL
ADHESION PROTEIN

(Bacteroides
fragilis) 		PF15415
(Mfa_like_2) 		5 ILE A  37
VAL A  82
LEU A 147
VAL A 115
ILE A 140
 None
 1.02A 3w68B-4h40A:
undetectable		 3w68B-4h40A:
24.43
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.
4iqf METHIONYL-TRNA
FORMYLTRANSFERASE

(Bacillus
anthracis) 		PF00551
(Formyl_trans_N)
PF02911
(Formyl_trans_C) 		5 ILE A  96
VAL A  31
LEU A  17
VAL A 181
ILE A  28
 None
 1.14A 3w68B-4iqfA:
undetectable		 3w68B-4iqfA:
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.
4jbu VIRULENCE-ASSOCIATED
V ANTIGEN

(Yersinia pestis) 		PF04792
(LcrV) 		5 VAL A  63
LEU A  71
ILE A  44
LEU A 105
VAL A 121
 None
 1.10A 3w68B-4jbuA:
undetectable		 3w68B-4jbuA:
23.55
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.
4ko2 PERIPLASMIC [NIFESE]
HYDROGENASE SMALL
SUBUNIT

(Desulfomicrobium
baculatum) 		PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		5 VAL S 121
ILE S  41
LEU S  43
PHE S  45
VAL S  49
 None
 1.10A 3w68B-4ko2S:
undetectable		 3w68B-4ko2S:
22.59
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.
4lhb MOLYBDOPTERIN
ADENYLYLTRANSFERASE

(Pyrococcus
furiosus) 		PF00994
(MoCF_biosynth) 		6 ILE A 130
VAL A  76
SER A 141
LEU A 142
PHE A  98
PHE A 108
 None
 1.41A 3w68B-4lhbA:
undetectable		 3w68B-4lhbA:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mr0 PLASMIN AND
FIBRONECTIN-BINDING
PROTEIN A

(Streptococcus
pneumoniae) 		PF12708
(Pectate_lyase_3)
PF13229
(Beta_helix) 		5 VAL A 415
VAL A 497
ILE A 484
LEU A 521
VAL A 524
 None
 1.05A 3w68B-4mr0A:
undetectable		 3w68B-4mr0A:
16.80
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.
4nvr PUTATIVE
ACYLTRANSFERASE

(Salmonella
enterica) 		PF00561
(Abhydrolase_1) 		5 ILE A  33
VAL A  21
LEU A  27
LEU A  71
VAL A 121
 None
 1.10A 3w68B-4nvrA:
undetectable		 3w68B-4nvrA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p1x GAMMA-HEMOLYSIN
COMPONENT C

(Staphylococcus
aureus) 		PF07968
(Leukocidin) 		5 VAL B 280
PHE B  33
ILE B 228
LEU B  82
VAL B 214
 None
 1.09A 3w68B-4p1xB:
undetectable		 3w68B-4p1xB:
21.73
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.
4pfz 5-CARBOXYMETHYL-2-HY
DROXYMUCONATE
DELTA-ISOMERASE

(Mycolicibacterium
smegmatis) 		PF01557
(FAA_hydrolase)
PF10370
(DUF2437) 		5 ILE A 267
VAL A 201
ILE A 224
LEU A 227
VAL A  84
 None
 1.02A 3w68B-4pfzA:
undetectable		 3w68B-4pfzA:
22.97
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.
4q05 ESTERASE E25

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 ILE A 136
LEU A 195
VAL A  94
ILE A 180
LEU A 171
 None
 0.88A 3w68B-4q05A:
undetectable		 3w68B-4q05A:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q7k ABC TRANSPORTER

(Thermotoga
maritima) 		PF00005
(ABC_tran) 		5 TYR A 459
ILE A 453
VAL A 440
LEU A 484
VAL A 500
 None
 0.90A 3w68B-4q7kA:
undetectable		 3w68B-4q7kA:
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.
4xgu PUTATIVE PACHYTENE
CHECKPOINT PROTEIN 2

(Caenorhabditis
elegans) 		PF00004
(AAA) 		5 VAL A 254
VAL A 149
ILE A 295
LEU A 294
VAL A 153
 None
 1.11A 3w68B-4xguA:
undetectable		 3w68B-4xguA:
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.
4y9w ASPARTIC ACID
ENDOPEPTIDASE SAPP2

(Candida
parapsilosis) 		PF00026
(Asp) 		6 ILE A 163
VAL A 208
PHE A 311
LEU A 320
PHE A 259
VAL A 190
 None
 1.35A 3w68B-4y9wA:
undetectable		 3w68B-4y9wA:
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.
4yji ARYL ACYLAMIDASE

(bacterium
CSBL00001) 		PF01425
(Amidase) 		5 TYR A 198
ILE A 460
VAL A 231
VAL A 207
LEU A 256
 None
 1.10A 3w68B-4yjiA:
undetectable		 3w68B-4yjiA:
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.
4zxo GLYCOSYL HYDROLASE
FAMILY 26

(Bacteroides
ovatus) 		PF02156
(Glyco_hydro_26) 		5 TRP A 195
VAL A 126
LEU A  87
ILE A 161
LEU A 217
 None
 1.14A 3w68B-4zxoA:
undetectable		 3w68B-4zxoA:
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.
4zxo GLYCOSYL HYDROLASE
FAMILY 26

(Bacteroides
ovatus) 		PF02156
(Glyco_hydro_26) 		6 TRP A 195
VAL A 126
VAL A 181
ILE A 161
LEU A 217
VAL A 225
 None
 1.01A 3w68B-4zxoA:
undetectable		 3w68B-4zxoA:
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.
4zxo GLYCOSYL HYDROLASE
FAMILY 26

(Bacteroides
ovatus) 		PF02156
(Glyco_hydro_26) 		5 TRP A 195
VAL A 126
VAL A 181
ILE A 161
PHE A 167
 None
 1.02A 3w68B-4zxoA:
undetectable		 3w68B-4zxoA:
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.
5ey5 LBCATS-A

(synthetic
construct) 		PF00290
(Trp_syntA) 		5 VAL A  81
LEU A  34
ILE A  48
LEU A  40
VAL A 253
 None
 1.07A 3w68B-5ey5A:
1.8		 3w68B-5ey5A:
23.48
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.
5fby SEPARASE

(Chaetomium
thermophilum) 		PF03568
(Peptidase_C50) 		5 ILE A1982
VAL A1710
ILE A1702
LEU A1699
VAL A1741
 None
 1.11A 3w68B-5fbyA:
undetectable		 3w68B-5fbyA:
19.19
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.
5hjn LD10117P

(Drosophila
melanogaster) 		PF00566
(RabGAP-TBC) 		5 TYR A 112
VAL A 116
ILE A 130
LEU A 132
VAL A 136
 None
 0.99A 3w68B-5hjnA:
undetectable		 3w68B-5hjnA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jy5 THIOREDOXIN

(Cryptococcus
neoformans) 		PF00085
(Thioredoxin) 		5 ILE A  69
VAL A  20
ILE A  95
LEU A  99
VAL A  50
 None
 1.10A 3w68B-5jy5A:
undetectable		 3w68B-5jy5A:
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.
5kj8 SYNAPTOSOMAL-ASSOCIA
TED PROTEIN 25
SYNAPTOTAGMIN-1

(Rattus
norvegicus;
Rattus
norvegicus) 		no annotation
PF00168
(C2) 		5 VAL C  48
VAL E 359
LEU E 289
PHE E 343
VAL E 357
 None
 1.10A 3w68B-5kj8C:
undetectable		 3w68B-5kj8C:
16.95
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.
5m5p PRE-MRNA-SPLICING
HELICASE BRR2

(Saccharomyces
cerevisiae) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		5 VAL A 646
VAL A 625
ILE A 633
LEU A 631
VAL A 628
 None
 1.02A 3w68B-5m5pA:
undetectable		 3w68B-5m5pA:
9.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5mue ALPHA-TOCOPHEROL
TRANSFER PROTEIN

(Homo sapiens) 		PF00650
(CRAL_TRIO)
PF03765
(CRAL_TRIO_N) 		10 TYR A 100
ILE A 119
TRP A 122
VAL A 132
SER A 136
LEU A 137
PHE A 158
ILE A 179
PHE A 187
VAL A 191
 None
None
None
VIV  A 302 (-4.4A)
VIV  A 302 (-3.5A)
VIV  A 302 ( 4.8A)
VIV  A 302 (-3.9A)
VIV  A 302 (-4.0A)
VIV  A 302 (-4.0A)
VIV  A 302 ( 4.9A)
 0.43A 3w68B-5mueA:
34.0		 3w68B-5mueA:
92.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5mue ALPHA-TOCOPHEROL
TRANSFER PROTEIN

(Homo sapiens) 		PF00650
(CRAL_TRIO)
PF03765
(CRAL_TRIO_N) 		9 TYR A 100
ILE A 119
TRP A 122
VAL A 132
SER A 136
LEU A 137
VAL A 191
PHE A 158
PHE A 187
 None
None
None
VIV  A 302 (-4.4A)
VIV  A 302 (-3.5A)
VIV  A 302 ( 4.8A)
VIV  A 302 ( 4.9A)
VIV  A 302 (-3.9A)
VIV  A 302 (-4.0A)
 1.40A 3w68B-5mueA:
34.0		 3w68B-5mueA:
92.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5mue ALPHA-TOCOPHEROL
TRANSFER PROTEIN

(Homo sapiens) 		PF00650
(CRAL_TRIO)
PF03765
(CRAL_TRIO_N) 		10 TYR A 100
ILE A 119
TRP A 122
VAL A 132
SER A 136
PHE A 158
ILE A 179
LEU A 183
PHE A 187
VAL A 191
 None
None
None
VIV  A 302 (-4.4A)
VIV  A 302 (-3.5A)
VIV  A 302 (-3.9A)
VIV  A 302 (-4.0A)
None
VIV  A 302 (-4.0A)
VIV  A 302 ( 4.9A)
 0.43A 3w68B-5mueA:
34.0		 3w68B-5mueA:
92.98
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.
5och -

(-) 		no annotation 5 TYR B 481
SER B 518
VAL B 531
ILE B 666
LEU B 664
 ADP  B1001 (-3.6A)
None
None
None
None
 1.10A 3w68B-5ochB:
undetectable		 3w68B-5ochB:
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.
5sy5 NEURONAL PAS
DOMAIN-CONTAINING
PROTEIN 1

(Mus musculus) 		PF00010
(HLH)
PF00989
(PAS)
PF08447
(PAS_3) 		5 LEU B 356
VAL B 387
ILE B 351
LEU B 314
VAL B 399
 None
 1.01A 3w68B-5sy5B:
undetectable		 3w68B-5sy5B:
19.90
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.
5u0s MEDIATOR COMPLEX
SUBUNIT 18

(Schizosaccharomyces
pombe) 		PF09637
(Med18) 		5 VAL R 169
PHE R 199
LEU R  26
PHE R 133
VAL R 138
 None
 1.04A 3w68B-5u0sR:
undetectable		 3w68B-5u0sR:
21.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u2a AMP-DEPENDENT
SYNTHETASE AND
LIGASE

(Brucella canis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 ILE A 449
LEU A 466
ILE A 539
LEU A 531
VAL A 528
 None
 1.12A 3w68B-5u2aA:
undetectable		 3w68B-5u2aA:
19.72
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.
5ud0 FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Helicobacter
pylori) 		no annotation 5 ILE A  33
SER A 303
VAL A 245
ILE A   8
LEU A   9
 None
 1.14A 3w68B-5ud0A:
undetectable		 3w68B-5ud0A:
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.
6anu SPECTRIN BETA CHAIN,
NON-ERYTHROCYTIC 2

(Homo sapiens) 		no annotation 5 VAL f1119
LEU f1103
VAL f1074
ILE f1156
LEU f1098
 None
 0.99A 3w68B-6anuf:
undetectable		 3w68B-6anuf:
22.37
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.
6en4 SPLICING FACTOR 3B
SUBUNIT 1

(Homo sapiens) 		no annotation 5 TYR C 864
VAL C 868
ILE C 849
LEU C 840
VAL C 792
 None
 1.08A 3w68B-6en4C:
undetectable		 3w68B-6en4C:
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.
6evg MULTI-COPPER OXIDASE
CUEO

(Ochrobactrum) 		no annotation 5 VAL A 174
LEU A 298
VAL A 274
ILE A 264
LEU A 262
 None
 0.94A 3w68B-6evgA:
undetectable		 3w68B-6evgA:
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.
6ez8 FACTOR VIII INTRON
22 PROTEIN

(Homo sapiens) 		no annotation 5 SER B 324
VAL B 274
LEU B 318
PHE B 319
VAL B 271
 None
 1.07A 3w68B-6ez8B:
undetectable		 3w68B-6ez8B:
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.
6f5o RNA-DIRECTED RNA
POLYMERASE CATALYTIC
SUBUNIT
POLYMERASE BASIC
PROTEIN 2

(Influenza B
virus;
Influenza B
virus) 		no annotation
no annotation 		5 ILE C 200
SER B 664
VAL C  98
ILE B 608
LEU B 589
 None
 1.09A 3w68B-6f5oC:
undetectable		 3w68B-6f5oC:
undetectable