SIMILAR PATTERNS OF AMINO ACIDS FOR 1S19_A_MC9A500

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.
1ad3 ALDEHYDE
DEHYDROGENASE (CLASS
3)

(Rattus
norvegicus) 		PF00171
(Aldedh) 		5 LEU A  29
LEU A  67
VAL A  66
LEU A 136
LEU A 149
 None
 1.14A 1s19A-1ad3A:
0.0		 1s19A-1ad3A:
20.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dof ADENYLOSUCCINATE
LYASE

(Pyrobaculum
aerophilum) 		PF00206
(Lyase_1) 		5 LEU A  29
LEU A  35
VAL A  36
SER A 190
VAL A  78
 None
 1.18A 1s19A-1dofA:
2.4		 1s19A-1dofA:
20.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gpe PROTEIN (GLUCOSE
OXIDASE)

(Penicillium
amagasakiense) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 LEU A  52
VAL A 254
ILE A 301
SER A 305
LEU A 548
 None
FAD  A 600 (-4.0A)
None
None
None
 1.12A 1s19A-1gpeA:
0.0		 1s19A-1gpeA:
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.
1i4s RIBONUCLEASE III

(Aquifex
aeolicus) 		PF14622
(Ribonucleas_3_3) 		5 LEU A  46
VAL A  47
SER A 120
LEU A  87
LEU A  11
 None
 1.16A 1s19A-1i4sA:
0.0		 1s19A-1i4sA:
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.
1jih DNA POLYMERASE ETA

(Saccharomyces
cerevisiae) 		PF00817
(IMS)
PF11799
(IMS_C) 		5 ILE A 230
SER A   2
TRP A 233
LEU A 183
LEU A 187
 None
 1.08A 1s19A-1jihA:
0.0		 1s19A-1jihA:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1l8w VLSE1

(Borreliella
burgdorferi) 		PF00921
(Lipoprotein_2) 		5 LEU A 321
ILE A 171
SER A 140
VAL A  77
LEU A 129
 None
 1.15A 1s19A-1l8wA:
0.0		 1s19A-1l8wA:
20.71
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.
1naa CELLOBIOSE
DEHYDROGENASE

(Phanerochaete
chrysosporium) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 LEU A 243
VAL A 428
ILE A 474
SER A 478
LEU A 717
 None
6FA  A 801 (-4.0A)
None
None
None
 1.18A 1s19A-1naaA:
0.0		 1s19A-1naaA:
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.
1pwe L-SERINE DEHYDRATASE

(Rattus
norvegicus) 		PF00291
(PALP) 		5 VAL A 176
ILE A 163
TRP A 185
LEU A  13
LEU A 156
 None
 1.16A 1s19A-1pweA:
undetectable		 1s19A-1pweA:
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.
1rc7 RIBONUCLEASE III

(Aquifex
aeolicus) 		PF00035
(dsrm)
PF14622
(Ribonucleas_3_3) 		5 LEU A  46
VAL A  47
SER A 120
LEU A  87
LEU A  11
 None
 1.12A 1s19A-1rc7A:
undetectable		 1s19A-1rc7A:
23.68
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.
1sp8 4-HYDROXYPHENYLPYRUV
ATE DIOXYGENASE

(Zea mays) 		PF00903
(Glyoxalase) 		5 LEU A 370
VAL A 369
ILE A 392
VAL A 360
LEU A 310
 None
 1.16A 1s19A-1sp8A:
undetectable		 1s19A-1sp8A:
21.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u2l PEROXIDASE/CATALASE
HPI

(Escherichia
coli) 		PF00141
(peroxidase) 		5 LEU A 525
ILE A 516
VAL A 470
LEU A 467
LEU A 462
 None
 1.17A 1s19A-1u2lA:
undetectable		 1s19A-1u2lA:
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.
1uiy ENOYL-COA HYDRATASE

(Thermus
thermophilus) 		PF00378
(ECH_1) 		5 LEU A  49
ILE A 144
VAL A 119
LEU A 127
LEU A 174
 None
 1.01A 1s19A-1uiyA:
undetectable		 1s19A-1uiyA:
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.
1v0m ENDO-1,4-BETA-XYLANA
SE A

(Streptomyces
lividans) 		PF00331
(Glyco_hydro_10) 		5 LEU A 222
LEU A 228
VAL A 230
ILE A 199
TYR A 186
 None
 1.10A 1s19A-1v0mA:
undetectable		 1s19A-1v0mA:
23.86
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.
1v4v UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Thermus
thermophilus) 		PF02350
(Epimerase_2) 		5 LEU A 331
LEU A 316
VAL A 324
LEU A 221
LEU A 217
 None
 1.17A 1s19A-1v4vA:
undetectable		 1s19A-1v4vA:
20.42
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.
1v6u ENDO-1,4-BETA-D-XYLA
NASE

(Streptomyces
olivaceoviridis) 		PF00331
(Glyco_hydro_10)
PF00652
(Ricin_B_lectin) 		5 LEU A 222
LEU A 228
VAL A 230
ILE A 199
TYR A 186
 None
 1.16A 1s19A-1v6uA:
undetectable		 1s19A-1v6uA:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xfg GLUCOSAMINE--FRUCTOS
E-6-PHOSPHATE
AMINOTRANSFERASE
[ISOMERIZING]

(Escherichia
coli) 		PF13522
(GATase_6) 		5 LEU A 152
LEU A 146
VAL A 145
LEU A 178
LEU A 206
 None
 1.04A 1s19A-1xfgA:
undetectable		 1s19A-1xfgA:
20.86
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.
2ayu NUCLEOSOME ASSEMBLY
PROTEIN

(Saccharomyces
cerevisiae) 		PF00956
(NAP) 		5 LEU A 190
LEU A 196
VAL A 199
ILE A 344
LEU A 231
 None
 1.06A 1s19A-2ayuA:
undetectable		 1s19A-2ayuA:
20.41
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.
2d5i AZO REDUCTASE

(Escherichia
coli) 		PF02525
(Flavodoxin_2) 		5 LEU A 104
LEU A 110
VAL A 111
ILE A  80
LEU A   4
 None
 1.14A 1s19A-2d5iA:
undetectable		 1s19A-2d5iA:
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.
2f8t ARGONAUTE PROTEIN

(Aquifex
aeolicus) 		PF02171
(Piwi) 		5 LEU A 457
VAL A 359
ILE A 395
SER A 393
LEU A 446
 None
 1.17A 1s19A-2f8tA:
undetectable		 1s19A-2f8tA:
15.89
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.
2g0f THIOL:DISULFIDE
INTERCHANGE PROTEIN
DSBE

(Escherichia
coli) 		PF08534
(Redoxin) 		5 LEU A  72
ILE A 149
VAL A  75
LEU A 134
LEU A 138
 None
 1.02A 1s19A-2g0fA:
undetectable		 1s19A-2g0fA:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2g0f THIOL:DISULFIDE
INTERCHANGE PROTEIN
DSBE

(Escherichia
coli) 		PF08534
(Redoxin) 		5 LEU A  72
VAL A  71
ILE A 149
LEU A 134
LEU A 138
 None
 1.00A 1s19A-2g0fA:
undetectable		 1s19A-2g0fA:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hrb CARBONYL REDUCTASE
[NADPH] 3

(Homo sapiens) 		PF00106
(adh_short) 		5 LEU A 256
VAL A 252
VAL A  33
LEU A  50
LEU A  55
 None
 1.16A 1s19A-2hrbA:
undetectable		 1s19A-2hrbA:
23.23
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.
2j4d CRYPTOCHROME DASH

(Arabidopsis
thaliana) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		5 LEU A 190
VAL A 187
ILE A 337
SER A 336
TYR A 331
 None
 1.14A 1s19A-2j4dA:
undetectable		 1s19A-2j4dA:
17.79
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.
2j6h GLUCOSAMINE-FRUCTOSE
-6-PHOSPHATE
AMINOTRANSFERASE

(Escherichia
coli) 		PF01380
(SIS)
PF13522
(GATase_6) 		5 LEU A 152
LEU A 146
VAL A 145
LEU A 178
LEU A 206
 None
 1.10A 1s19A-2j6hA:
undetectable		 1s19A-2j6hA:
18.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2o4j VITAMIN D3 RECEPTOR

(Rattus
norvegicus) 		PF00104
(Hormone_recep) 		12 LEU A 223
LEU A 229
VAL A 230
ILE A 267
SER A 271
SER A 274
TRP A 282
CYH A 284
TYR A 291
VAL A 296
LEU A 305
LEU A 309
 None
VD4  A 500 ( 4.8A)
VD4  A 500 ( 4.6A)
VD4  A 500 ( 4.7A)
VD4  A 500 ( 3.9A)
VD4  A 500 ( 2.9A)
VD4  A 500 ( 3.7A)
VD4  A 500 ( 3.4A)
None
VD4  A 500 ( 4.4A)
None
None
 0.28A 1s19A-2o4jA:
38.8		 1s19A-2o4jA:
89.35
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.
2qm3 PREDICTED
METHYLTRANSFERASE

(Pyrococcus
furiosus) 		PF01861
(DUF43) 		5 LEU A  25
VAL A  24
ILE A  51
VAL A  67
LEU A 303
 None
 1.15A 1s19A-2qm3A:
undetectable		 1s19A-2qm3A:
23.56
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.
2qrd SNF1-LIKE PROTEIN
KINASE SSP2

(Schizosaccharomyces
pombe) 		PF16579
(AdenylateSensor) 		5 ILE A 497
SER A 499
TRP A 501
LEU A 573
LEU A 569
 None
 0.94A 1s19A-2qrdA:
undetectable		 1s19A-2qrdA:
19.32
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.
2qru UNCHARACTERIZED
PROTEIN

(Enterococcus
faecalis) 		PF07859
(Abhydrolase_3) 		5 LEU A  76
LEU A 109
SER A 227
SER A 213
CYH A 211
 EDO  A 279 (-4.7A)
None
None
None
None
 1.18A 1s19A-2qruA:
undetectable		 1s19A-2qruA:
23.18
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.
2v1u CELL DIVISION
CONTROL PROTEIN 6
HOMOLOG

(Aeropyrum
pernix) 		PF09079
(Cdc6_C)
PF13191
(AAA_16) 		5 LEU A 314
LEU A 308
VAL A 307
ILE A 350
VAL A 376
 None
 1.01A 1s19A-2v1uA:
undetectable		 1s19A-2v1uA:
21.16
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.
2xtl CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN

(Streptococcus
agalactiae) 		PF16569
(GramPos_pilinBB)
PF16570
(GramPos_pilinD3) 		5 VAL A 197
SER A 238
TYR A 331
LEU A 284
LEU A 286
 None
 1.16A 1s19A-2xtlA:
undetectable		 1s19A-2xtlA:
22.58
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.
2y0e UDP-GLUCOSE
DEHYDROGENASE

(Burkholderia
cepacia) 		PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N) 		5 LEU A  39
VAL A  44
ILE A  46
CYH A  28
VAL A  54
 None
 1.17A 1s19A-2y0eA:
undetectable		 1s19A-2y0eA:
18.26
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.
2z2r NUCLEOSOME ASSEMBLY
PROTEIN

(Saccharomyces
cerevisiae) 		PF00956
(NAP) 		5 LEU A 190
LEU A 196
VAL A 199
ILE A 344
LEU A 231
 None
 1.08A 1s19A-2z2rA:
undetectable		 1s19A-2z2rA:
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.
3bhi CARBONYL REDUCTASE
[NADPH] 1

(Homo sapiens) 		PF00106
(adh_short) 		5 LEU A 255
VAL A 251
VAL A  32
LEU A  49
LEU A  54
 None
 1.14A 1s19A-3bhiA:
undetectable		 1s19A-3bhiA:
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.
3c7o ENDO-1,4-BETA-XYLANA
SE

(Bacillus
subtilis) 		PF03422
(CBM_6)
PF04616
(Glyco_hydro_43) 		5 LEU A 204
VAL A 211
ILE A 202
TYR A 119
LEU A 161
 None
FMT  A2057 ( 4.5A)
None
None
None
 1.01A 1s19A-3c7oA:
undetectable		 1s19A-3c7oA:
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.
3cuq VACUOLAR-SORTING
PROTEIN SNF8
VACUOLAR
PROTEIN-SORTING-ASSO
CIATED PROTEIN 36

(Homo sapiens;
Homo sapiens) 		PF04157
(EAP30)
PF04157
(EAP30) 		5 LEU A 154
LEU B 272
VAL B 273
ILE B 252
LEU B 294
 None
 1.04A 1s19A-3cuqA:
undetectable		 1s19A-3cuqA:
23.94
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.
3cuq VACUOLAR-SORTING
PROTEIN SNF8
VACUOLAR
PROTEIN-SORTING-ASSO
CIATED PROTEIN 36

(Homo sapiens;
Homo sapiens) 		PF04157
(EAP30)
PF04157
(EAP30) 		5 LEU A 154
VAL B 273
ILE B 252
LEU B 294
LEU B 301
 None
 0.98A 1s19A-3cuqA:
undetectable		 1s19A-3cuqA:
23.94
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.
3dla GLUTAMINE-DEPENDENT
NAD(+) SYNTHETASE

(Mycobacterium
tuberculosis) 		PF00795
(CN_hydrolase)
PF02540
(NAD_synthase) 		5 LEU A 166
LEU A  47
VAL A  14
ILE A 250
LEU A 279
 None
 1.10A 1s19A-3dlaA:
undetectable		 1s19A-3dlaA:
18.06
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.
3f1v DNA POLYMERASE III
SUBUNIT BETA

(Escherichia
coli) 		PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3) 		5 LEU A 331
LEU A 325
VAL A 324
LEU A 256
LEU A 290
 None
 1.00A 1s19A-3f1vA:
undetectable		 1s19A-3f1vA:
19.74
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.
3f1x SERINE
ACETYLTRANSFERASE

(Bacteroides
vulgatus) 		PF00132
(Hexapep) 		5 LEU A 254
VAL A 278
ILE A 282
VAL A 270
LEU A 267
 None
 1.02A 1s19A-3f1xA:
2.2		 1s19A-3f1xA:
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.
3fot 15-O-ACETYLTRANSFERA
SE

(Fusarium
sporotrichioides) 		PF07428
(Tri3) 		5 LEU A 322
LEU A 316
VAL A 315
ILE A 365
SER A 388
 None
 1.10A 1s19A-3fotA:
undetectable		 1s19A-3fotA:
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.
3gc3 BETA-ARRESTIN-1

(Bos taurus) 		PF00339
(Arrestin_N)
PF02752
(Arrestin_C) 		5 LEU A 343
VAL A 253
TYR A 238
VAL A 319
LEU A 129
 None
 0.99A 1s19A-3gc3A:
undetectable		 1s19A-3gc3A:
19.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i2m ORF59

(Human
gammaherpesvirus
8) 		PF04929
(Herpes_DNAp_acc) 		5 VAL X 191
TRP X 271
VAL X 202
LEU X 168
LEU X 269
 None
 1.13A 1s19A-3i2mX:
undetectable		 1s19A-3i2mX:
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.
3kh9 THIOL:DISULFIDE
INTERCHANGE PROTEIN
DSBE

(Pseudomonas
aeruginosa) 		PF08534
(Redoxin) 		5 LEU A  66
ILE A 143
VAL A  69
LEU A 128
LEU A 132
 None
 0.94A 1s19A-3kh9A:
undetectable		 1s19A-3kh9A:
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.
3m9b PROTEASOME-ASSOCIATE
D ATPASE

(Mycobacterium
tuberculosis) 		PF16450
(Prot_ATP_ID_OB) 		5 ILE A 193
TYR A 228
VAL A 186
LEU A 164
LEU A 220
 None
 1.18A 1s19A-3m9bA:
undetectable		 1s19A-3m9bA:
25.44
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.
3mgx PUTATIVE P450
MONOOXYGENASE

(Amycolatopsis
balhimycina) 		PF00067
(p450) 		5 LEU A 359
VAL A 358
ILE A 244
VAL A 369
LEU A 389
 None
 1.09A 1s19A-3mgxA:
undetectable		 1s19A-3mgxA:
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.
3mx9 PROTEIN SCV3V2(G19S)

(Chlamydomonas
reinhardtii) 		PF00961
(LAGLIDADG_1) 		5 LEU A 112
LEU A 106
VAL A 105
ILE A  23
LEU A  78
 None
 1.18A 1s19A-3mx9A:
undetectable		 1s19A-3mx9A:
22.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mx9 PROTEIN SCV3V2(G19S)

(Chlamydomonas
reinhardtii) 		PF00961
(LAGLIDADG_1) 		5 LEU A 303
LEU A 297
VAL A 296
ILE A 214
LEU A 269
 None
 1.17A 1s19A-3mx9A:
undetectable		 1s19A-3mx9A:
22.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qvq PHOSPHODIESTERASE
OLEI02445

(Oleispira
antarctica) 		PF03009
(GDPD) 		5 LEU A 224
VAL A  11
ILE A  37
SER A  17
SER A  18
 None
 0.99A 1s19A-3qvqA:
undetectable		 1s19A-3qvqA:
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.
3szb ALDEHYDE
DEHYDROGENASE

(Homo sapiens) 		PF00171
(Aldedh) 		5 LEU A  29
LEU A  67
VAL A  66
LEU A 136
LEU A 149
 None
 1.14A 1s19A-3szbA:
undetectable		 1s19A-3szbA:
18.82
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.
3t04 MONOBODY 7C12

(Homo sapiens) 		PF00041
(fn3) 		5 VAL D  81
ILE D  97
SER D  95
TYR D  84
VAL D  38
 None
 1.07A 1s19A-3t04D:
undetectable		 1s19A-3t04D:
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.
3tp9 BETA-LACTAMASE AND
RHODANESE DOMAIN
PROTEIN

(Alicyclobacillus
acidocaldarius) 		PF00581
(Rhodanese)
PF00753
(Lactamase_B) 		5 LEU A 105
LEU A 128
TYR A 130
VAL A 110
LEU A   3
 None
 1.18A 1s19A-3tp9A:
undetectable		 1s19A-3tp9A:
18.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wgp VITAMIN D3 RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		12 LEU A 227
LEU A 233
VAL A 234
ILE A 271
SER A 275
SER A 278
TRP A 286
CYH A 288
TYR A 295
VAL A 300
LEU A 309
LEU A 313
 None
ED9  A 501 ( 4.3A)
None
ED9  A 501 (-4.5A)
ED9  A 501 (-3.9A)
ED9  A 501 (-2.7A)
ED9  A 501 (-3.5A)
ED9  A 501 (-3.4A)
None
ED9  A 501 (-4.5A)
ED9  A 501 (-4.9A)
None
 0.16A 1s19A-3wgpA:
42.0		 1s19A-3wgpA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wwy D-LACTATE
DEHYDROGENASE

(Fusobacterium
nucleatum) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 LEU A 114
LEU A 206
SER A 222
VAL A 258
LEU A 287
 None
 1.07A 1s19A-3wwyA:
undetectable		 1s19A-3wwyA:
21.35
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.
3zzi ACETYLGLUTAMATE
KINASE

(Saccharomyces
cerevisiae) 		PF00696
(AA_kinase)
PF04768
(NAT) 		5 LEU A 269
LEU A 133
VAL A 132
ILE A 233
LEU A 113
 None
 1.01A 1s19A-3zziA:
undetectable		 1s19A-3zziA:
20.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gw9 BACTERIOPHYTOCHROME

(Rhodopseudomonas
palustris) 		PF00360
(PHY)
PF00989
(PAS)
PF01590
(GAF)
PF08446
(PAS_2) 		5 LEU A 209
ILE A 253
SER A 468
LEU A 218
LEU A 258
 None
BLA  A 900 (-4.2A)
BLA  A 900 (-3.9A)
None
None
 1.17A 1s19A-4gw9A:
undetectable		 1s19A-4gw9A:
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.
4h5u PROBABLE HYDROLASE
NIT2

(Saccharomyces
cerevisiae) 		PF00795
(CN_hydrolase) 		5 LEU A 112
VAL A  88
ILE A  30
SER A  74
LEU A  23
 None
 1.05A 1s19A-4h5uA:
undetectable		 1s19A-4h5uA:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h7u PYRANOSE
DEHYDROGENASE

(Leucoagaricus
meleagris) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 LEU A  43
VAL A 243
ILE A 290
SER A 294
LEU A 541
 None
FED  A 801 (-3.8A)
FED  A 801 (-4.9A)
None
None
 1.16A 1s19A-4h7uA:
undetectable		 1s19A-4h7uA:
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.
4npk EXTENDED
SYNAPTOTAGMIN-2

(Homo sapiens) 		PF00168
(C2) 		5 ILE A 418
SER A 427
TRP A 438
LEU A 491
LEU A 458
 None
 1.02A 1s19A-4npkA:
undetectable		 1s19A-4npkA:
23.49
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.
4opm LIPASE

(Acinetobacter
baumannii) 		PF12697
(Abhydrolase_6) 		5 LEU A 264
VAL A 167
ILE A 301
LEU A  71
LEU A  91
 None
 1.07A 1s19A-4opmA:
undetectable		 1s19A-4opmA:
23.27
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.
4p42 EXTENDED
SYNAPTOTAGMIN-2

(Homo sapiens) 		PF00168
(C2)
PF17047
(SMP_LBD) 		5 ILE A 390
SER A 399
TRP A 410
LEU A 463
LEU A 430
 None
 1.02A 1s19A-4p42A:
undetectable		 1s19A-4p42A:
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.
4pii N-GLYCOSYLASE/DNA
LYASE

(Pyrococcus
furiosus) 		PF09171
(AGOG) 		5 LEU A 233
LEU A 217
ILE A 179
LEU A   4
LEU A 186
 None
 1.11A 1s19A-4piiA:
undetectable		 1s19A-4piiA:
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.
4psw HISTONE
ACETYLTRANSFERASE
TYPE B CATALYTIC
SUBUNIT

(Saccharomyces
cerevisiae) 		PF00583
(Acetyltransf_1)
PF10394
(Hat1_N) 		5 VAL A  69
ILE A  54
SER A  22
TYR A  66
VAL A  96
 None
 1.13A 1s19A-4pswA:
undetectable		 1s19A-4pswA:
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.
4puc SUSD HOMOLOG

(Bacteroides
uniformis) 		PF12741
(SusD-like) 		5 LEU A 118
ILE A 140
SER A 187
TYR A 134
LEU A 199
 None
 1.14A 1s19A-4pucA:
undetectable		 1s19A-4pucA:
20.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qi4 CELLOBIOSE
DEHYDROGENASE

(Crassicarpon
hotsonii) 		PF00732
(GMC_oxred_N)
PF00734
(CBM_1)
PF05199
(GMC_oxred_C) 		5 LEU A 256
VAL A 440
ILE A 488
SER A 492
LEU A 733
 None
FAD  A 901 (-4.1A)
None
None
None
 1.16A 1s19A-4qi4A:
undetectable		 1s19A-4qi4A:
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.
4qi7 CELLOBIOSE
DEHYDROGENASE

(Neurospora
crassa) 		PF00732
(GMC_oxred_N)
PF00734
(CBM_1)
PF05199
(GMC_oxred_C)
PF16010
(CDH-cyt) 		5 LEU A 256
VAL A 440
ILE A 488
SER A 492
LEU A 732
 None
FAD  A 902 (-4.0A)
None
None
None
 1.14A 1s19A-4qi7A:
undetectable		 1s19A-4qi7A:
14.55
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.
4rh7 GREEN FLUORESCENT
PROTEIN/CYTOPLASMIC
DYNEIN 2 HEAVY CHAIN
1

(Homo sapiens;
synthetic
construct) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		5 LEU A1904
SER A2049
TRP A2051
LEU A1939
LEU A1996
 None
 1.11A 1s19A-4rh7A:
undetectable		 1s19A-4rh7A:
6.18
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.
4rzi 3-KETOACYL-ACYL
CARRIER PROTEIN
REDUCTASE

(Synechocystis
sp. PCC 6803) 		no annotation 5 LEU B 232
VAL B 175
ILE B 211
LEU B  28
LEU B  27
 None
 1.14A 1s19A-4rziB:
undetectable		 1s19A-4rziB:
25.35
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.
4uuc ANKYRIN REPEAT AND
SOCS BOX PROTEIN 11

(Homo sapiens) 		PF12796
(Ank_2)
PF13637
(Ank_4) 		5 LEU A 150
VAL A 149
SER A 143
SER A 141
LEU A  78
 None
 1.17A 1s19A-4uucA:
undetectable		 1s19A-4uucA:
23.66
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.
4wzf 1,3-BETA-GLUCANASE

(Mycobacterium
tuberculosis) 		PF00722
(Glyco_hydro_16) 		5 LEU A 108
VAL A 288
CYH A 150
VAL A 106
LEU A 129
 None
None
None
None
EDO  A 403 (-4.7A)
 1.15A 1s19A-4wzfA:
undetectable		 1s19A-4wzfA:
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.
4z5p CYTOCHROME P450
HYDROXYLASE

(Streptomyces
atroolivaceus) 		PF00067
(p450) 		5 LEU A 262
LEU A 253
VAL A 249
ILE A 136
LEU A 124
 None
 1.18A 1s19A-4z5pA:
undetectable		 1s19A-4z5pA:
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.
5a6d DNA POLYMERASE
SLIDING CLAMP

(Thermococcus
gammatolerans) 		PF00705
(PCNA_N)
PF02747
(PCNA_C) 		5 LEU A  53
VAL A  36
ILE A   5
LEU A 115
LEU A  99
 None
 1.12A 1s19A-5a6dA:
undetectable		 1s19A-5a6dA:
22.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cb2 PROTEIN SEY1

(Candida
albicans) 		PF05879
(RHD3) 		5 LEU A 153
VAL A 152
ILE A  61
VAL A 202
LEU A 269
 None
 1.10A 1s19A-5cb2A:
undetectable		 1s19A-5cb2A:
16.89
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.
5cej 3-OXOACYL-[ACYL-CARR
IER PROTEIN]
REDUCTASE

(Yersinia pestis) 		PF13561
(adh_short_C2) 		5 LEU A 235
VAL A 179
ILE A 215
LEU A  25
LEU A  24
 None
 1.15A 1s19A-5cejA:
undetectable		 1s19A-5cejA:
22.95
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.
5csa ACETYL-COA
CARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00364
(Biotin_lipoyl)
PF08326
(ACC_central) 		5 LEU A1177
VAL A1129
TYR A1105
LEU A1069
LEU A1072
 None
 1.09A 1s19A-5csaA:
undetectable		 1s19A-5csaA:
15.11
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.
5csl ACETYL-COA
CARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF01039
(Carboxyl_trans)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
PF08326
(ACC_central) 		5 LEU A1177
VAL A1129
TYR A1105
LEU A1069
LEU A1072
 None
 1.18A 1s19A-5cslA:
undetectable		 1s19A-5cslA:
8.18
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.
5ee0 OBG-LIKE ATPASE 1

(Oryza sativa) 		PF01926
(MMR_HSR1)
PF06071
(YchF-GTPase_C) 		5 LEU A  47
VAL A  66
ILE A 295
SER A 289
LEU A 228
 None
 0.92A 1s19A-5ee0A:
undetectable		 1s19A-5ee0A:
21.59
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.
5end 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
REDUCTASE FABG

(Vibrio cholerae) 		PF13561
(adh_short_C2) 		5 LEU A 239
VAL A 183
ILE A 219
LEU A  29
LEU A  28
 None
 1.11A 1s19A-5endA:
undetectable		 1s19A-5endA:
21.63
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.
5g06 EXOSOME COMPLEX
COMPONENT RRP40

(Saccharomyces
cerevisiae) 		PF15985
(KH_6) 		5 VAL G 158
TYR G 208
VAL G 196
LEU G 175
LEU G 178
 None
 1.14A 1s19A-5g06G:
undetectable		 1s19A-5g06G:
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.
5gj3 PERIPLASMIC BINDING
PROTEIN

(Roseiflexus sp.
RS-1) 		PF01497
(Peripla_BP_2) 		5 LEU A 236
VAL A 235
ILE A 259
LEU A 328
LEU A 333
 None
 1.12A 1s19A-5gj3A:
undetectable		 1s19A-5gj3A:
21.68
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.
5h2v IMPORTIN SUBUNIT
BETA-3

(Saccharomyces
cerevisiae) 		PF13513
(HEAT_EZ) 		5 ILE A 564
SER A 605
VAL A 542
LEU A 502
LEU A 514
 None
 1.17A 1s19A-5h2vA:
undetectable		 1s19A-5h2vA:
12.93
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.
5hdt SISTER CHROMATID
COHESION PROTEIN
PDS5 HOMOLOG B

(Homo sapiens) 		no annotation 5 LEU A 355
VAL A 385
ILE A 382
TRP A 435
LEU A 412
 None
 1.10A 1s19A-5hdtA:
undetectable		 1s19A-5hdtA:
12.79
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.
5i2x ADRENOCORTICAL
DYSPLASIA PROTEIN
HOMOLOG

(Homo sapiens) 		PF10341
(TPP1) 		5 LEU A 144
VAL A 205
TYR A 202
VAL A 153
LEU A 102
 None
 1.15A 1s19A-5i2xA:
undetectable		 1s19A-5i2xA:
22.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5i6e ACETYL-COA
CARBOXYLASE

(Saccharomyces
cerevisiae) 		PF08326
(ACC_central) 		5 LEU A1177
VAL A1129
TYR A1105
LEU A1069
LEU A1072
 None
 1.09A 1s19A-5i6eA:
undetectable		 1s19A-5i6eA:
16.37
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.
5ij6 LIPOATE--PROTEIN
LIGASE

(Enterococcus
faecalis) 		PF03099
(BPL_LplA_LipB)
PF10437
(Lip_prot_lig_C) 		5 LEU A 271
ILE A 283
TYR A 305
VAL A 303
LEU A 314
 None
 1.16A 1s19A-5ij6A:
undetectable		 1s19A-5ij6A:
21.14
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.
5irm UNCHARACTERIZED
PROTEIN

(Oryctolagus
cuniculus) 		PF05729
(NACHT)
PF13516
(LRR_6) 		5 LEU A 959
VAL A 952
ILE A 975
LEU A1018
LEU A1011
 None
 0.98A 1s19A-5irmA:
undetectable		 1s19A-5irmA:
14.53
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.
5k9z PUTATIVE SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE

(Paraburkholderia
xenovorans) 		PF13561
(adh_short_C2) 		5 LEU A 248
VAL A 189
ILE A 228
TYR A 234
LEU A  34
 None
 1.08A 1s19A-5k9zA:
undetectable		 1s19A-5k9zA:
19.33
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.
5lb3 ATP-DEPENDENT DNA
HELICASE Q5

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF16124
(RecQ_Zn_bind) 		5 VAL B  76
ILE B 128
TYR B  62
LEU B 183
LEU B 151
 None
 1.12A 1s19A-5lb3B:
undetectable		 1s19A-5lb3B:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mvd DIHYDROOROTATE
DEHYDROGENASE
(QUINONE),
MITOCHONDRIAL

(Homo sapiens) 		PF01180
(DHO_dh) 		6 LEU A 182
LEU A 253
VAL A 252
ILE A 277
VAL A 213
LEU A 230
 None
 1.37A 1s19A-5mvdA:
undetectable		 1s19A-5mvdA:
22.62
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.
5n8n EVPB FAMILY TYPE VI
SECRETION PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 5 LEU B 391
SER B 195
CYH B 162
LEU B 231
LEU B 179
 None
 1.12A 1s19A-5n8nB:
undetectable		 1s19A-5n8nB:
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.
5nit GLUCOSE OXIDASE

(Aspergillus
niger) 		no annotation 5 LEU A  47
VAL A 250
ILE A 297
SER A 301
LEU A 544
 None
FAD  A 601 (-4.0A)
None
None
None
 1.06A 1s19A-5nitA:
undetectable		 1s19A-5nitA:
18.87
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.
5u1s SEPARIN

(Saccharomyces
cerevisiae) 		PF03568
(Peptidase_C50) 		5 LEU A1264
LEU A1411
ILE A1171
LEU A1199
LEU A1197
 None
 1.13A 1s19A-5u1sA:
undetectable		 1s19A-5u1sA:
10.89
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.
5ur2 BIFUNCTIONAL PROTEIN
PUTA

(Bdellovibrio
bacteriovorus) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		5 VAL A 927
ILE A 913
SER A 909
LEU A 891
LEU A 887
 None
 1.09A 1s19A-5ur2A:
undetectable		 1s19A-5ur2A:
13.52
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.
5ve8 KAP123

(Kluyveromyces
lactis) 		no annotation 5 LEU A 499
LEU A 487
ILE A 445
CYH A 510
LEU A 419
 None
 0.94A 1s19A-5ve8A:
undetectable		 1s19A-5ve8A:
13.08
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.
5xsq NUCLEOPROTEIN

(Marburg
marburgvirus) 		PF05505
(Ebola_NP) 		5 LEU A 297
VAL A 216
ILE A 220
VAL A 302
LEU A 309
 None
 1.13A 1s19A-5xsqA:
undetectable		 1s19A-5xsqA:
22.09
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.
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		no annotation 5 LEU A 392
LEU A 552
VAL A 551
VAL A 575
LEU A 447
 None
 1.14A 1s19A-5xxoA:
undetectable		 1s19A-5xxoA:
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.
5y89 PUTATIVE HEMIN
TRANSPORT SYSTEM,
SUBSTRATE-BINDING
PROTEIN

(Burkholderia
cenocepacia) 		no annotation 5 LEU A 187
VAL A 186
ILE A 210
LEU A 277
LEU A 282
 None
 1.09A 1s19A-5y89A:
undetectable		 1s19A-5y89A:
20.33
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.
6btm ALTERNATIVE COMPLEX
III SUBUNIT E

(Flavobacterium
johnsoniae) 		no annotation 5 LEU E 181
LEU E 175
VAL E 174
ILE E 144
SER E 143
 None
None
None
HEC  E 201 ( 4.7A)
HEC  E 201 ( 4.6A)
 1.14A 1s19A-6btmE:
undetectable		 1s19A-6btmE:
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.
6d9y SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Paraburkholderia
phymatum) 		no annotation 5 LEU A 164
LEU A 122
VAL A 123
VAL A 115
LEU A  40
 None
 1.12A 1s19A-6d9yA:
undetectable		 1s19A-6d9yA:
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.
6dfu TRYPTOPHAN--TRNA
LIGASE

(Haemophilus
influenzae) 		no annotation 5 VAL A  29
ILE A  72
SER A   8
LEU A 209
LEU A  16
 None
 1.08A 1s19A-6dfuA:
undetectable		 1s19A-6dfuA:
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.
6fob VITAMIN D3 RECEPTOR
A

(Danio rerio) 		no annotation 12 LEU A 255
LEU A 261
VAL A 262
ILE A 299
SER A 303
SER A 306
TRP A 314
CYH A 316
TYR A 323
VAL A 328
LEU A 337
LEU A 341
 None
DZW  A 501 ( 4.5A)
None
DZW  A 501 (-4.7A)
DZW  A 501 (-3.8A)
DZW  A 501 (-2.7A)
DZW  A 501 (-3.5A)
DZW  A 501 (-3.4A)
DZW  A 501 (-3.6A)
DZW  A 501 ( 4.3A)
None
None
 0.30A 1s19A-6fobA:
37.4		 1s19A-6fobA:
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.
1ddh MHC CLASS I H-2DD
HEAVY CHAIN

(Mus musculus) 		PF00129
(MHC_I)
PF07654
(C1-set) 		4 TYR A 113
SER A   4
ARG A   6
HIS A 263
 None
 1.50A 1s19A-1ddhA:
0.0		 1s19A-1ddhA:
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.
1r3n BETA-ALANINE
SYNTHASE

(Lachancea
kluyveri) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 SER A 172
ARG A 166
HIS A 226
HIS A 114
 None
None
ZN  A 500 (-3.2A)
ZN  A 500 (-3.2A)
 1.43A 1s19A-1r3nA:
undetectable		 1s19A-1r3nA:
20.92
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.
1zkl HIGH-AFFINITY
CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 7A

(Homo sapiens) 		PF00233
(PDEase_I) 		4 SER A 236
ARG A 350
HIS A 225
HIS A 181
 None
 1.32A 1s19A-1zklA:
0.0		 1s19A-1zklA:
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.
2k1g LIPOPROTEIN SPR

(Escherichia
coli) 		PF00877
(NLPC_P60) 		4 SER A  61
ARG A  86
HIS A 131
HIS A 119
 None
 1.21A 1s19A-2k1gA:
0.0		 1s19A-2k1gA:
20.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2o4j VITAMIN D3 RECEPTOR

(Rattus
norvegicus) 		PF00104
(Hormone_recep) 		5 TYR A 143
SER A 233
ARG A 270
HIS A 301
HIS A 393
 VD4  A 500 ( 4.7A)
VD4  A 500 ( 2.8A)
VD4  A 500 ( 4.0A)
VD4  A 500 ( 3.9A)
VD4  A 500 ( 3.9A)
 0.16A 1s19A-2o4jA:
38.8		 1s19A-2o4jA:
89.35
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.
2psb YERB PROTEIN

(Bacillus
subtilis) 		PF11258
(DUF3048)
PF17479
(DUF3048_C) 		4 TYR A 199
SER A 212
HIS A 141
HIS A  40
 None
 1.26A 1s19A-2psbA:
undetectable		 1s19A-2psbA:
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.
2qb6 EXOPOLYPHOSPHATASE

(Saccharomyces
cerevisiae) 		PF01368
(DHH)
PF02833
(DHHA2) 		4 SER A 204
ARG A 208
HIS A 149
HIS A 148
 GOL  A 804 (-3.2A)
GOL  A 804 (-3.0A)
SO4  A 501 (-4.2A)
MN  A 401 ( 3.3A)
 1.28A 1s19A-2qb6A:
0.0		 1s19A-2qb6A:
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.
2z6v PUTATIVE
UNCHARACTERIZED
PROTEIN

(Mycobacterium
avium) 		PF13469
(Sulfotransfer_3) 		4 TYR A 104
SER A 114
HIS A 175
HIS A 232
 None
 1.49A 1s19A-2z6vA:
0.0		 1s19A-2z6vA:
21.64
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.
3dty OXIDOREDUCTASE,
GFO/IDH/MOCA FAMILY

(Pseudomonas
syringae group
genomosp. 3) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 SER A 200
ARG A 230
HIS A 174
HIS A 177
 None
 1.40A 1s19A-3dtyA:
0.0		 1s19A-3dtyA:
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.
3kw8 PUTATIVE COPPER
OXIDASE

(Streptomyces
coelicolor) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 SER A 120
ARG A 128
HIS A 104
HIS A 156
 None
 0.91A 1s19A-3kw8A:
undetectable		 1s19A-3kw8A:
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.
3mdn GLUTAMINE
AMINOTRANSFERASE
CLASS-II DOMAIN
PROTEIN

(Ruegeria
pomeroyi) 		PF13230
(GATase_4) 		4 SER A 208
ARG A 199
HIS A 100
HIS A 111
 None
 1.48A 1s19A-3mdnA:
undetectable		 1s19A-3mdnA:
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.
3no4 CREATININE
AMIDOHYDROLASE

(Nostoc
punctiforme) 		PF02633
(Creatininase) 		4 SER A 216
ARG A 213
HIS A 110
HIS A  71
 None
None
UNL  A 350 ( 4.3A)
UNL  A 350 ( 4.1A)
 1.31A 1s19A-3no4A:
undetectable		 1s19A-3no4A:
21.88
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.
3riq TAILSPIKE PROTEIN

(Salmonella
virus 9NA) 		PF09251
(PhageP22-tail) 		4 TYR A 225
ARG A 247
HIS A 214
HIS A 216
 None
 1.49A 1s19A-3riqA:
undetectable		 1s19A-3riqA:
17.71
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.
3s0m OXALATE
DECARBOXYLASE OXDC

(Bacillus
subtilis) 		PF00190
(Cupin_1) 		4 TYR A 283
SER A  81
HIS A  95
HIS A 140
 None
None
MN  A 500 ( 3.3A)
MN  A 500 (-3.5A)
 1.46A 1s19A-3s0mA:
undetectable		 1s19A-3s0mA:
21.11
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.
3t9w SMALL LACCASE,
MULTI-COPPER OXIDASE

(Amycolatopsis
sp. ATCC 39116) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 SER A 108
ARG A 116
HIS A  92
HIS A 144
 None
 0.90A 1s19A-3t9wA:
undetectable		 1s19A-3t9wA:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tbb SMALL LACCASE,
OXIDOREDUCTASE

(Streptomyces
viridosporus) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 SER A 115
ARG A 123
HIS A  99
HIS A 151
 None
None
CU  A  12 ( 3.3A)
CU  A  12 (-3.4A)
 0.91A 1s19A-3tbbA:
undetectable		 1s19A-3tbbA:
18.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wgp VITAMIN D3 RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 TYR A 143
SER A 237
ARG A 274
HIS A 305
HIS A 397
 ED9  A 501 (-3.7A)
ED9  A 501 (-2.7A)
ED9  A 501 (-2.9A)
ED9  A 501 (-3.9A)
ED9  A 501 (-3.9A)
 0.13A 1s19A-3wgpA:
42.0		 1s19A-3wgpA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b6z FAMILY M14
UNASSIGNED PEPTIDASE

(Burkholderia
cenocepacia) 		PF00246
(Peptidase_M14) 		4 SER A 246
ARG A 245
HIS A 268
HIS A 171
 None
None
ZN  A 385 (-3.2A)
ZN  A 385 ( 3.2A)
 1.49A 1s19A-4b6zA:
undetectable		 1s19A-4b6zA:
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.
4gyb COPPER OXIDASE

(Streptomyces
lividans) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 SER A 120
ARG A 128
HIS A 104
HIS A 156
 None
 0.97A 1s19A-4gybA:
undetectable		 1s19A-4gybA:
18.13
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.
4w1t COPPER OXIDASE

(Streptomyces
sviceus) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 SER A 117
ARG A 125
HIS A 101
HIS A 153
 None
None
CU  A 404 (-3.1A)
CU  A 404 (-3.0A)
 0.91A 1s19A-4w1tA:
undetectable		 1s19A-4w1tA:
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.
4ymk ACYL-COA DESATURASE
1

(Mus musculus) 		PF00487
(FA_desaturase) 		4 SER A 120
ARG A 154
HIS A 265
HIS A 298
 None
None
ZN  A 402 (-3.4A)
ZN  A 402 (-3.4A)
 1.18A 1s19A-4ymkA:
undetectable		 1s19A-4ymkA:
22.29
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.
5ehf LACCASE

(Antrodiella
faginea) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 TYR A 489
SER A  62
HIS A 450
HIS A 400
 None
None
CU  A 507 (-3.2A)
CU  A 507 ( 3.1A)
 1.46A 1s19A-5ehfA:
undetectable		 1s19A-5ehfA:
18.06
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.
5mkm TWO-DOMAIN LACCASE

(Streptomyces
griseoflavus) 		no annotation 4 SER A 121
ARG A 129
HIS A 105
HIS A 157
 None
None
CU  A 402 (-3.2A)
CU  A 402 ( 3.2A)
 0.94A 1s19A-5mkmA:
undetectable		 1s19A-5mkmA:
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.
5nag KYNURENINE
3-MONOOXYGENASE

(Pseudomonas
fluorescens) 		PF01494
(FAD_binding_3) 		4 TYR A 382
SER A 375
HIS A 240
HIS A 191
 None
 1.30A 1s19A-5nagA:
undetectable		 1s19A-5nagA:
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.
5tpr 3-DEHYDROQUINATE
SYNTHASE

(Trichormus
variabilis) 		PF01761
(DHQ_synthase) 		4 TYR A 138
SER A 152
HIS A 271
HIS A 287
 None
None
ZN  A 501 (-3.3A)
NAD  A 503 (-3.1A)
 1.44A 1s19A-5tprA:
undetectable		 1s19A-5tprA:
22.62
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.
5v4r LA-RELATED PROTEIN 1

(Homo sapiens) 		no annotation 4 TYR A 883
SER A 843
ARG A 847
HIS A 797
 MGT  A1001 (-3.9A)
None
None
None
 1.39A 1s19A-5v4rA:
undetectable		 1s19A-5v4rA:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yh1 -

(-) 		no annotation 4 SER A 401
ARG A 360
HIS A 462
HIS A 463
 None
None
MN  A 805 (-3.6A)
None
 1.42A 1s19A-5yh1A:
undetectable		 1s19A-5yh1A:
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.
6azt ASPARAGINYL
ENDOPEPTIDASE 1

(Helianthus
annuus) 		no annotation 4 TYR A 316
SER A 242
HIS A 178
HIS A  76
 None
None
SNN  A 177 (-3.6A)
SNN  A 177 ( 3.3A)
 1.40A 1s19A-6aztA:
undetectable		 1s19A-6aztA:
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.
6c66 UNCHARACTERIZED
PROTEIN

(Thermobifida
fusca) 		no annotation 4 TYR I 182
SER I 156
ARG I 160
HIS I 218
 None
 1.47A 1s19A-6c66I:
undetectable		 1s19A-6c66I:
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.
6fob VITAMIN D3 RECEPTOR
A

(Danio rerio) 		no annotation 5 TYR A 175
SER A 265
ARG A 302
HIS A 333
HIS A 423
 None
DZW  A 501 (-3.0A)
DZW  A 501 (-3.8A)
DZW  A 501 (-3.9A)
DZW  A 501 (-4.0A)
 0.17A 1s19A-6fobA:
37.4		 1s19A-6fobA:
undetectable