SIMILAR PATTERNS OF AMINO ACIDS FOR 5IWU_A_ERYA404

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.
1b74 GLUTAMATE RACEMASE

(Aquifex
pyrophilus) 		PF01177
(Asp_Glu_race) 		5 ILE A 175
TYR A 123
THR A  14
ALA A 122
SER A 207
 None
 1.09A 5iwuA-1b74A:
undetectable		 5iwuA-1b74A:
23.64
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.
1ebv PROSTAGLANDIN H2
SYNTHASE

(Ovis aries) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		5 ILE A 233
HIS A 232
TYR A 234
ALA A 332
ILE A 343
 None
 1.42A 5iwuA-1ebvA:
undetectable		 5iwuA-1ebvA:
18.44
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.
1gzv GLUCOSE-6-PHOSPHATE
ISOMERASE

(Sus scrofa) 		PF00342
(PGI) 		5 THR A 167
PHE A 205
ALA A 224
SER A 159
ILE A 156
 None
None
None
PA5  A 600 (-3.4A)
None
 1.35A 5iwuA-1gzvA:
0.0		 5iwuA-1gzvA:
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.
1jed SULFATE
ADENYLYLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF01747
(ATP-sulfurylase)
PF14306
(PUA_2) 		5 ILE A  82
THR A  38
ALA A 293
SER A 143
ILE A 142
 None
None
ADP  A 635 (-4.4A)
None
None
 1.06A 5iwuA-1jedA:
0.0		 5iwuA-1jedA:
21.28
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		5 ILE A 965
HIS A1006
THR A1363
ALA A 968
ILE A1012
 None
 1.32A 5iwuA-1ofeA:
0.0		 5iwuA-1ofeA:
12.02
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.
1t90 PROBABLE
METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE

(Bacillus
subtilis) 		PF00171
(Aldedh) 		5 ILE A  46
THR A 185
ALA A  54
SER A 225
ILE A 224
 None
 1.15A 5iwuA-1t90A:
0.0		 5iwuA-1t90A:
23.62
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.
1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE

(Shewanella
massilia) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		5 ILE A 422
TYR A 431
THR A 155
SER A 769
ILE A 759
 None
 1.43A 5iwuA-1tmoA:
0.0		 5iwuA-1tmoA:
18.03
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.
1to6 GLYCERATE KINASE

(Neisseria
meningitidis) 		PF02595
(Gly_kinase) 		5 ILE A 247
GLU A 114
PHE A 254
ALA A 253
ILE A 127
 None
 1.31A 5iwuA-1to6A:
0.0		 5iwuA-1to6A:
24.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1to6 GLYCERATE KINASE

(Neisseria
meningitidis) 		PF02595
(Gly_kinase) 		5 THR A  66
GLU A 114
PHE A 254
ALA A 253
ILE A 127
 None
 1.44A 5iwuA-1to6A:
0.0		 5iwuA-1to6A:
24.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vbl PECTATE LYASE 47

(Bacillus sp.
TS-47) 		PF00544
(Pec_lyase_C) 		5 THR A  66
ALA A 410
SER A 191
ILE A 192
PHE A 150
 None
 1.33A 5iwuA-1vblA:
undetectable		 5iwuA-1vblA:
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.
1ve1 O-ACETYLSERINE
SULFHYDRYLASE

(Thermus
thermophilus) 		PF00291
(PALP) 		5 ILE A 167
THR A  10
GLU A  31
ALA A 275
ILE A 180
 None
 1.25A 5iwuA-1ve1A:
undetectable		 5iwuA-1ve1A:
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.
1wl4 ACETYL-COENZYME A
ACETYLTRANSFERASE 2

(Homo sapiens) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 ILE A 280
THR A 365
GLU A 319
ALA A 308
ILE A 390
 None
 1.41A 5iwuA-1wl4A:
undetectable		 5iwuA-1wl4A:
21.95
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.
1x9s DNA POLYMERASE

(Escherichia
virus T7) 		PF00476
(DNA_pol_A) 		5 ILE A 562
GLU A 480
PHE A 524
ALA A 513
ILE A 500
 None
 1.17A 5iwuA-1x9sA:
undetectable		 5iwuA-1x9sA:
17.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xx6 THYMIDINE KINASE

(Clostridium
acetobutylicum) 		PF00265
(TK) 		5 ILE A 141
GLU A  89
ALA A 152
ILE A 128
MET A 132
 None
 1.41A 5iwuA-1xx6A:
undetectable		 5iwuA-1xx6A:
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.
1z7a CONSERVED
HYPOTHETICAL PROTEIN

(Pseudomonas
aeruginosa) 		PF01522
(Polysacc_deac_1) 		5 HIS A 259
HIS A 126
THR A 168
ALA A 106
PHE A  53
 None
 1.26A 5iwuA-1z7aA:
undetectable		 5iwuA-1z7aA:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c4k PHOSPHORIBOSYL
PYROPHOSPHATE
SYNTHETASE-ASSOCIATE
D PROTEIN 1

(Homo sapiens) 		PF13793
(Pribosyltran_N)
PF14572
(Pribosyl_synth) 		5 ILE A  92
THR A  47
GLU A  76
PHE A  11
ILE A  96
 None
 1.42A 5iwuA-2c4kA:
undetectable		 5iwuA-2c4kA:
22.34
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.
2cun PHOSPHOGLYCERATE
KINASE

(Pyrococcus
horikoshii) 		PF00162
(PGK) 		5 HIS A  72
ALA A 148
SER A 116
ILE A  90
PHE A 115
 None
None
None
MPD  A 509 (-3.9A)
None
 1.16A 5iwuA-2cunA:
undetectable		 5iwuA-2cunA:
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.
2cxn GLUCOSE-6-PHOSPHATE
ISOMERASE

(Mus musculus) 		PF00342
(PGI) 		5 THR A 168
PHE A 206
ALA A 225
SER A 160
ILE A 157
 None
None
None
PO4  A1601 (-2.7A)
None
 1.32A 5iwuA-2cxnA:
undetectable		 5iwuA-2cxnA:
21.31
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.
2f3o PYRUVATE
FORMATE-LYASE 2

(Archaeoglobus
fulgidus) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		5 ILE A 314
HIS A 265
THR A 511
GLU A 267
ILE A  54
 None
 1.44A 5iwuA-2f3oA:
undetectable		 5iwuA-2f3oA:
17.25
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.
2g7g RHA04620, PUTATIVE
TRANSCRIPTIONAL
REGULATOR

(Rhodococcus
jostii) 		PF02909
(TetR_C) 		5 ILE A 132
GLU A  72
PHE A  80
ALA A 139
SER A 113
 None
 1.23A 5iwuA-2g7gA:
undetectable		 5iwuA-2g7gA:
22.68
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.
2gfp MULTIDRUG RESISTANCE
PROTEIN D

(Escherichia
coli) 		PF07690
(MFS_1) 		5 ILE A 217
GLU A 326
ALA A 337
SER A 207
MET A 372
 None
 1.18A 5iwuA-2gfpA:
undetectable		 5iwuA-2gfpA:
23.02
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.
2gx8 NIF3-RELATED PROTEIN

(Bacillus cereus) 		PF01784
(NIF3) 		5 ILE A  99
THR A  81
GLU A  90
ALA A  35
ILE A  58
 None
 1.39A 5iwuA-2gx8A:
undetectable		 5iwuA-2gx8A:
21.81
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.
2h12 CITRATE SYNTHASE

(Acetobacter
aceti) 		PF00285
(Citrate_synt) 		5 ILE A  81
HIS A  76
THR A 243
ALA A  88
PHE A 392
 None
None
None
None
CMX  A5001 (-4.9A)
 1.39A 5iwuA-2h12A:
undetectable		 5iwuA-2h12A:
21.06
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.
2nwb CONSERVED DOMAIN
PROTEIN

(Shewanella
oneidensis) 		PF08933
(DUF1864) 		5 ILE A 245
TYR A 163
GLU A 315
ALA A 162
PHE A 310
 None
HEM  A 401 ( 4.8A)
None
None
None
 1.30A 5iwuA-2nwbA:
undetectable		 5iwuA-2nwbA:
20.76
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.
2o1s 1-DEOXY-D-XYLULOSE-5
-PHOSPHATE SYNTHASE

(Escherichia
coli) 		PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
PF13292
(DXP_synthase_N) 		5 THR A  56
ALA A 367
SER A 126
ILE A 127
MET A 164
 None
 1.39A 5iwuA-2o1sA:
undetectable		 5iwuA-2o1sA:
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.
2o2c GLUCOSE-6-PHOSPHATE
ISOMERASE,
GLYCOSOMAL

(Trypanosoma
brucei) 		PF00342
(PGI) 		5 THR A 216
PHE A 254
ALA A 273
SER A 208
ILE A 205
 None
None
None
G6Q  A5001 (-2.7A)
None
 1.35A 5iwuA-2o2cA:
undetectable		 5iwuA-2o2cA:
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.
2odp COMPLEMENT C2

(Homo sapiens) 		PF00089
(Trypsin)
PF00092
(VWA) 		5 THR A 640
ALA A 475
SER A 521
ILE A 520
PHE A 524
 None
 1.36A 5iwuA-2odpA:
undetectable		 5iwuA-2odpA:
22.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q3o 12-OXOPHYTODIENOATE
REDUCTASE 3

(Arabidopsis
thaliana) 		PF00724
(Oxidored_FMN) 		5 ILE A 185
THR A  33
PHE A 104
ALA A 276
SER A 320
 None
FMN  A7401 (-3.8A)
None
None
FMN  A7401 ( 4.2A)
 1.29A 5iwuA-2q3oA:
undetectable		 5iwuA-2q3oA:
21.98
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.
2qt3 N-ISOPROPYLAMMELIDE
ISOPROPYL
AMIDOHYDROLASE

(Pseudomonas sp.
ADP) 		PF01979
(Amidohydro_1) 		5 GLU A 197
PHE A 163
ALA A 159
SER A 228
ILE A 229
 None
 1.25A 5iwuA-2qt3A:
undetectable		 5iwuA-2qt3A:
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.
2qt3 N-ISOPROPYLAMMELIDE
ISOPROPYL
AMIDOHYDROLASE

(Pseudomonas sp.
ADP) 		PF01979
(Amidohydro_1) 		5 ILE A 214
GLU A 197
PHE A 163
ALA A 159
ILE A 229
 None
 1.35A 5iwuA-2qt3A:
undetectable		 5iwuA-2qt3A:
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.
2r9h H(+)/CL(-) EXCHANGE
TRANSPORTER CLCA

(Escherichia
coli) 		PF00654
(Voltage_CLC) 		5 ILE A 410
THR A 226
ALA A 404
ILE A 215
PHE A 219
 None
 1.13A 5iwuA-2r9hA:
undetectable		 5iwuA-2r9hA:
22.00
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.
2w7y PROBABLE SUGAR ABC
TRANSPORTER,
SUGAR-BINDING
PROTEIN

(Streptococcus
pneumoniae) 		PF13416
(SBP_bac_8) 		5 HIS A 395
THR A 149
SER A 303
ILE A 302
PHE A 155
 None
None
None
None
GAL  A1429 ( 4.5A)
 1.43A 5iwuA-2w7yA:
undetectable		 5iwuA-2w7yA:
21.44
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.
2ww2 ALPHA-1,2-MANNOSIDAS
E

(Bacteroides
thetaiotaomicron) 		PF07971
(Glyco_hydro_92) 		5 HIS A  89
PHE A  61
ALA A  54
SER A 102
ILE A 103
 None
 1.40A 5iwuA-2ww2A:
undetectable		 5iwuA-2ww2A:
17.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wzs PUTATIVE
ALPHA-1,2-MANNOSIDAS
E

(Bacteroides
thetaiotaomicron) 		PF07971
(Glyco_hydro_92) 		5 HIS A  83
PHE A  55
ALA A  48
SER A  96
ILE A  97
 None
 1.42A 5iwuA-2wzsA:
1.1		 5iwuA-2wzsA:
16.62
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.
2yg6 PUTRESCINE OXIDASE

(Rhodococcus
erythropolis) 		PF01593
(Amino_oxidase) 		5 ILE A 272
ALA A  36
SER A 421
ILE A 261
PHE A 420
 None
FAD  A 600 (-3.5A)
None
None
None
 1.36A 5iwuA-2yg6A:
undetectable		 5iwuA-2yg6A:
22.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yky BETA-TRANSAMINASE

(Mesorhizobium
sp. LUK) 		PF00202
(Aminotran_3) 		5 ILE A 217
THR A 257
GLU A 254
ALA A 156
SER A 135
 None
 1.15A 5iwuA-2ykyA:
undetectable		 5iwuA-2ykyA:
20.76
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.
2zxq ENDO-ALPHA-N-ACETYLG
ALACTOSAMINIDASE

(Bifidobacterium
longum) 		PF12905
(Glyco_hydro_101)
PF17451
(Glyco_hyd_101C) 		5 ILE A 620
HIS A 435
PHE A 516
ALA A 614
MET A 350
 None
 1.24A 5iwuA-2zxqA:
0.5		 5iwuA-2zxqA:
11.41
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.
3a2f DNA POLYMERASE

(Pyrococcus
furiosus) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		5 ILE A 663
TYR A 702
GLU A 735
ALA A 715
ILE A 656
 None
 1.43A 5iwuA-3a2fA:
undetectable		 5iwuA-3a2fA:
17.45
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.
3b57 LIN1889 PROTEIN

(Listeria
innocua) 		PF01966
(HD) 		5 ILE A  85
THR A 113
GLU A 115
PHE A  57
ALA A  10
 None
 1.37A 5iwuA-3b57A:
undetectable		 5iwuA-3b57A:
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.
3cl6 PUUE ALLANTOINASE

(Pseudomonas
fluorescens) 		PF01522
(Polysacc_deac_1) 		5 HIS A 259
HIS A 126
THR A 168
ALA A 106
PHE A  53
 None
 1.22A 5iwuA-3cl6A:
undetectable		 5iwuA-3cl6A:
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.
3cq5 HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE

(Corynebacterium
glutamicum) 		PF00155
(Aminotran_1_2) 		5 ILE A 247
THR A 210
PHE A 109
ALA A 108
SER A  98
 None
None
None
None
PMP  A 401 (-3.3A)
 1.31A 5iwuA-3cq5A:
undetectable		 5iwuA-3cq5A:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dh4 SODIUM/GLUCOSE
COTRANSPORTER

(Vibrio
parahaemolyticus) 		PF00474
(SSF) 		5 ILE A  97
THR A 514
ALA A 528
ILE A 271
PHE A 106
 None
 1.37A 5iwuA-3dh4A:
undetectable		 5iwuA-3dh4A:
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.
3hjb GLUCOSE-6-PHOSPHATE
ISOMERASE

(Vibrio cholerae) 		PF00342
(PGI) 		5 THR A 167
PHE A 204
ALA A 223
SER A 159
ILE A 156
 None
 1.35A 5iwuA-3hjbA:
undetectable		 5iwuA-3hjbA:
19.60
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.
3hjw PSEUDOURIDINE
SYNTHASE CBF5

(Pyrococcus
furiosus) 		PF01472
(PUA)
PF01509
(TruB_N)
PF08068
(DKCLD)
PF16198
(TruB_C_2) 		5 ILE A 187
GLU A 162
PHE A 135
ALA A 193
ILE A 166
 None
 1.34A 5iwuA-3hjwA:
undetectable		 5iwuA-3hjwA:
24.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3my9 MUCONATE
CYCLOISOMERASE

(Azorhizobium
caulinodans) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A 209
HIS A 173
PHE A 236
PHE A 216
MET A 166
 None
 1.36A 5iwuA-3my9A:
undetectable		 5iwuA-3my9A:
23.97
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.
3nbu GLUCOSE-6-PHOSPHATE
ISOMERASE

(Escherichia
coli) 		PF00342
(PGI) 		5 THR A 166
PHE A 203
ALA A 222
SER A 158
ILE A 155
 None
 1.26A 5iwuA-3nbuA:
undetectable		 5iwuA-3nbuA:
20.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o6b DEFECTIVE IN CULLIN
NEDDYLATION PROTEIN
1
CELL DIVISION
CONTROL PROTEIN 53

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF03556
(Cullin_binding)
PF10557
(Cullin_Nedd8) 		5 ILE B 793
TYR B 811
HIS B 767
GLU A 250
ILE A 257
 None
 0.98A 5iwuA-3o6bB:
undetectable		 5iwuA-3o6bB:
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.
3prl NADP-DEPENDENT
GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Bacillus
halodurans) 		PF00171
(Aldedh) 		5 ILE A 117
THR A 238
ALA A 124
ILE A 212
PHE A 185
 None
 1.40A 5iwuA-3prlA:
undetectable		 5iwuA-3prlA:
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.
3qgu LL-DIAMINOPIMELATE
AMINOTRANSFERASE

(Chlamydomonas
reinhardtii) 		PF00155
(Aminotran_1_2) 		5 ILE A 244
THR A 263
GLU A 276
ALA A 159
SER A 141
 None
None
None
None
SO4  A 451 (-4.8A)
 1.44A 5iwuA-3qguA:
undetectable		 5iwuA-3qguA:
22.71
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.
3thw DNA MISMATCH REPAIR
PROTEIN MSH3

(Homo sapiens) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05192
(MutS_III) 		5 ILE B 666
HIS B 818
ALA B 820
SER B 656
ILE B 654
 None
 1.13A 5iwuA-3thwB:
undetectable		 5iwuA-3thwB:
16.10
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.
3tzw POLYKETIDE SYNTHASE
PKS13

(Mycobacterium
tuberculosis) 		PF00698
(Acyl_transf_1) 		5 ILE A1041
TYR A1033
HIS A 670
ALA A 675
ILE A 661
 None
 1.41A 5iwuA-3tzwA:
undetectable		 5iwuA-3tzwA:
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.
3wrf NON-REDUCING END
BETA-L-ARABINOFURANO
SIDASE

(Bifidobacterium
longum) 		PF07944
(Glyco_hydro_127) 		5 ILE A 138
TYR A 231
GLU A 196
ALA A 257
SER A 217
 None
 1.39A 5iwuA-3wrfA:
undetectable		 5iwuA-3wrfA:
18.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3x3y PHENYLETHYLAMINE
OXIDASE

(Arthrobacter
globiformis) 		PF01179
(Cu_amine_oxid)
PF02728
(Cu_amine_oxidN3) 		5 THR A 377
PHE A 297
ALA A 534
SER A 276
PHE A 398
 None
 1.42A 5iwuA-3x3yA:
3.4		 5iwuA-3x3yA:
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.
4bg2 PATF

(Prochloron
didemni) 		no annotation 5 HIS A 140
GLU A 180
ALA A 108
SER A 236
PHE A 234
 None
 1.34A 5iwuA-4bg2A:
undetectable		 5iwuA-4bg2A:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ff5 GLYCOSYL HYDROLASE
25

(Streptococcus
pneumoniae) 		PF01183
(Glyco_hydro_25) 		5 ILE A  77
HIS A  60
GLU A 108
PHE A 116
ALA A 120
 None
 1.43A 5iwuA-4ff5A:
undetectable		 5iwuA-4ff5A:
22.74
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.
4fwb HALOALKANE
DEHALOGENASE

(Rhodococcus
rhodochrous) 		PF00561
(Abhydrolase_1) 		5 HIS A 272
GLU A 276
PHE A 245
ALA A 145
ILE A 169
 CL  A2003 ( 3.7A)
None
CL  A2003 ( 4.7A)
None
None
 1.31A 5iwuA-4fwbA:
undetectable		 5iwuA-4fwbA:
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.
4kc3 INTERLEUKIN-33
INTERLEUKIN-1
RECEPTOR-LIKE 1

(Homo sapiens;
Homo sapiens) 		PF15095
(IL33)
PF07679
(I-set) 		5 ILE B 214
HIS B 314
PHE B 239
ALA B 248
SER A 170
 None
 1.28A 5iwuA-4kc3B:
undetectable		 5iwuA-4kc3B:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l95 GAMMA-GLUTAMYL
HYDROLASE

(Danio rerio) 		no annotation 5 ILE E 238
THR E 227
GLU E 285
PHE E  37
ALA E 245
 None
 1.41A 5iwuA-4l95E:
undetectable		 5iwuA-4l95E:
21.93
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.
4lyp EXO-BETA-1,4-MANNOSI
DASE

(Rhizomucor
miehei) 		no annotation 5 TYR A 156
THR A 253
PHE A 116
ALA A 152
ILE A 173
 None
 1.32A 5iwuA-4lypA:
undetectable		 5iwuA-4lypA:
21.19
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.
4m64 MELIBIOSE CARRIER
PROTEIN

(Salmonella
enterica) 		PF13347
(MFS_2) 		5 ILE A 415
THR A 425
ALA A 254
SER A 380
PHE A 386
 None
 1.23A 5iwuA-4m64A:
undetectable		 5iwuA-4m64A:
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.
4mll BETA-LACTAMASE OXA-1

(Escherichia
coli) 		PF00905
(Transpeptidase) 		5 ILE A 167
TYR A 141
THR A 219
ALA A  72
SER A 258
 None
None
None
None
1S6  A 301 (-2.4A)
 1.16A 5iwuA-4mllA:
undetectable		 5iwuA-4mllA:
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.
4mll BETA-LACTAMASE OXA-1

(Escherichia
coli) 		PF00905
(Transpeptidase) 		5 TYR A 141
THR A 219
PHE A  69
ALA A  72
SER A 258
 None
None
None
None
1S6  A 301 (-2.4A)
 0.94A 5iwuA-4mllA:
undetectable		 5iwuA-4mllA:
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.
4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE

(Caldalkalibacillus
thermarum) 		PF07992
(Pyr_redox_2) 		5 ILE A 387
TYR A 383
HIS A  42
ALA A 316
ILE A   8
 None
None
None
FAD  A 601 (-3.6A)
None
 1.26A 5iwuA-4nwzA:
undetectable		 5iwuA-4nwzA:
23.57
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.
4o6d NS1

(West Nile virus) 		PF00948
(Flavi_NS1) 		5 ILE B 275
TYR B 323
GLU B 219
ALA B 297
SER B 222
 None
 1.36A 5iwuA-4o6dB:
undetectable		 5iwuA-4o6dB:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4omg GERANYLGERANYL
DIPHOSPHATE CYCLASE

(Streptomyces
melanosporofaciens) 		no annotation 5 THR A  47
GLU A  50
ALA A  60
PHE A  96
MET A 189
 None
 1.44A 5iwuA-4omgA:
undetectable		 5iwuA-4omgA:
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.
4opu CONSERVED ARCHAEAL
PROTEIN

(Sulfolobus
acidocaldarius) 		PF01266
(DAO) 		5 ILE A  10
THR A 292
PHE A 163
ALA A 122
ILE A  42
 None
None
None
FDA  A 501 (-4.0A)
None
 1.44A 5iwuA-4opuA:
undetectable		 5iwuA-4opuA:
23.06
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.
4oqz PUTATIVE
OXIDOREDUCTASE YFJR

(Streptomyces
aurantiacus) 		PF03446
(NAD_binding_2) 		5 TYR A  69
HIS A 113
ALA A 166
ILE A 151
MET A  17
 None
 1.36A 5iwuA-4oqzA:
undetectable		 5iwuA-4oqzA:
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.
4pj3 INTRON-BINDING
PROTEIN AQUARIUS

(Homo sapiens) 		PF13086
(AAA_11)
PF13087
(AAA_12)
PF16399
(Aquarius_N) 		5 THR A1229
ALA A1139
SER A1225
ILE A1224
MET A1214
 None
 1.35A 5iwuA-4pj3A:
undetectable		 5iwuA-4pj3A:
12.08
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.
4v1y ATRAZINE
CHLOROHYDROLASE

(Pseudomonas sp.
ADP) 		PF01979
(Amidohydro_1) 		5 TYR A 111
THR A 241
ALA A 115
SER A 210
ILE A 209
 None
 1.17A 5iwuA-4v1yA:
undetectable		 5iwuA-4v1yA:
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.
4v39 SIALYLTRANSFERASE

(Pasteurella
dagmatis) 		PF11477
(PM0188) 		5 ILE A 150
TYR A 144
HIS A  91
GLU A  62
PHE A  90
 None
 1.36A 5iwuA-4v39A:
undetectable		 5iwuA-4v39A:
24.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wmj GLUCOSE-6-PHOSPHATE
ISOMERASE

(Colias
eurytheme) 		PF00342
(PGI) 		5 THR A 172
PHE A 209
ALA A 228
SER A 164
ILE A 161
 None
 1.34A 5iwuA-4wmjA:
undetectable		 5iwuA-4wmjA:
20.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wso PROBABLE
NICOTINATE-NUCLEOTID
E
ADENYLYLTRANSFERASE

(Burkholderia
thailandensis) 		PF01467
(CTP_transf_like) 		5 ILE A 135
THR A 202
ALA A 156
ILE A 179
PHE A 168
 NAD  A 301 (-4.1A)
None
None
None
None
 1.38A 5iwuA-4wsoA:
undetectable		 5iwuA-4wsoA:
23.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wxx DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Homo sapiens) 		PF00145
(DNA_methylase)
PF01426
(BAH)
PF02008
(zf-CXXC)
PF12047
(DNMT1-RFD) 		5 ILE A1314
PHE A1263
ALA A1317
SER A1161
ILE A1160
 None
 1.36A 5iwuA-4wxxA:
undetectable		 5iwuA-4wxxA:
12.35
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.
4ygu PUTATIVE ADHESIN

(Bacteroides
eggerthii) 		PF10988
(DUF2807) 		5 ILE A  49
GLU A 112
PHE A  38
ALA A 105
SER A 131
 None
 1.32A 5iwuA-4yguA:
undetectable		 5iwuA-4yguA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yue S4B6 FAB HEAVY CHAIN
S4B6 FAB LIGHT CHAIN

(Mus musculus;
Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set)
PF07654
(C1-set)
PF07686
(V-set) 		5 TYR L  99
HIS L  94
THR L  55
PHE H 113
SER H 107
 None
 1.37A 5iwuA-4yueL:
undetectable		 5iwuA-4yueL:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5b2d HN PROTEIN

(Mumps
rubulavirus) 		PF00423
(HN) 		5 ILE A 387
THR A 295
GLU A 393
PHE A 320
ALA A 247
 None
 1.13A 5iwuA-5b2dA:
0.6		 5iwuA-5b2dA:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bnn CAPSID PROTEIN VP2

(Enterovirus D) 		PF00073
(Rhv) 		5 ILE B 108
GLU B 150
PHE B  63
SER B  68
ILE B 228
 None
 1.22A 5iwuA-5bnnB:
undetectable		 5iwuA-5bnnB:
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.
5c1b TRANSITIONAL
ENDOPLASMIC
RETICULUM ATPASE

(Homo sapiens) 		PF00004
(AAA)
PF02359
(CDC48_N)
PF02933
(CDC48_2)
PF09336
(Vps4_C) 		5 ILE A 371
HIS A 404
ALA A 374
SER A 541
ILE A 540
 None
 1.44A 5iwuA-5c1bA:
undetectable		 5iwuA-5c1bA:
18.03
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.
5c9l PLL LECTIN

(Photorhabdus
luminescens) 		PF03984
(DUF346) 		5 ILE A 265
PHE A 234
ALA A 271
SER A 171
ILE A  22
 None
 1.36A 5iwuA-5c9lA:
4.0		 5iwuA-5c9lA:
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.
5gut DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Mus musculus) 		PF00145
(DNA_methylase)
PF01426
(BAH) 		5 ILE A1317
PHE A1266
ALA A1320
SER A1164
ILE A1163
 None
 1.44A 5iwuA-5gutA:
undetectable		 5iwuA-5gutA:
16.33
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.
5h2v IMPORTIN SUBUNIT
BETA-3

(Saccharomyces
cerevisiae) 		PF13513
(HEAT_EZ) 		5 GLU A 396
ALA A 473
SER A 440
ILE A 443
PHE A 439
 None
 1.17A 5iwuA-5h2vA:
undetectable		 5iwuA-5h2vA:
14.85
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.
5hab RIBONUCLEASE J

(Methanolobus
psychrophilus) 		PF07521
(RMMBL)
PF12706
(Lactamase_B_2) 		5 ILE A 154
HIS A  82
THR A 208
GLU A 206
ALA A 104
 None
None
A  C   1 ( 4.4A)
None
None
 1.19A 5iwuA-5habA:
undetectable		 5iwuA-5habA:
23.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5igu MACROLIDE
2'-PHOSPHOTRANSFERAS
E II

(Escherichia
coli) 		PF01636
(APH) 		5 HIS A 202
PHE A 234
ALA A 238
ILE A 277
PHE A 280
 None
 1.29A 5iwuA-5iguA:
31.5		 5iwuA-5iguA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5igu MACROLIDE
2'-PHOSPHOTRANSFERAS
E II

(Escherichia
coli) 		PF01636
(APH) 		5 HIS A 202
THR A 221
GLU A 222
PHE A 234
ALA A 238
 None
 1.08A 5iwuA-5iguA:
31.5		 5iwuA-5iguA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5igu MACROLIDE
2'-PHOSPHOTRANSFERAS
E II

(Escherichia
coli) 		PF01636
(APH) 		5 PHE A 234
ALA A 238
SER A 276
ILE A 277
PHE A 280
 None
 0.76A 5iwuA-5iguA:
31.5		 5iwuA-5iguA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5igu MACROLIDE
2'-PHOSPHOTRANSFERAS
E II

(Escherichia
coli) 		PF01636
(APH) 		5 THR A 221
GLU A 222
PHE A 234
ALA A 238
SER A 276
 None
 0.39A 5iwuA-5iguA:
31.5		 5iwuA-5iguA:
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.
5k04 UNCHARACTERIZED
PROTEIN

(Candida
albicans) 		PF09797
(NatB_MDM20) 		5 ILE A 432
TYR A 427
HIS A 437
THR A 466
SER A 500
 None
 1.41A 5iwuA-5k04A:
undetectable		 5iwuA-5k04A:
16.82
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.
5lki TCDA1

(Photorhabdus
luminescens) 		PF03538
(VRP1) 		5 THR A1054
GLU A1143
PHE A1110
ALA A1096
ILE A1203
 None
 1.21A 5iwuA-5lkiA:
3.1		 5iwuA-5lkiA:
8.32
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.
5ng6 CRISPR-ASSOCIATED
ENDONUCLEASE CPF1

(Francisella
tularensis) 		no annotation 5 ILE A1085
HIS A1261
ALA A1138
ILE A1286
MET A1268
 None
 1.13A 5iwuA-5ng6A:
undetectable		 5iwuA-5ng6A:
13.62
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.
5u4n FRUCTOSE-1

(Neisseria
gonorrhoeae) 		PF01116
(F_bP_aldolase) 		5 HIS A  84
THR A 196
ALA A  51
ILE A  46
MET A   6
 PO4  A 402 (-3.6A)
None
None
None
None
 1.24A 5iwuA-5u4nA:
undetectable		 5iwuA-5u4nA:
20.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5zhg OUTER CAPSID PROTEIN
VP8*

(Rotavirus C) 		no annotation 5 ILE A 150
HIS A  37
PHE A 141
SER A 114
ILE A  17
 None
 1.35A 5iwuA-5zhgA:
1.4		 5iwuA-5zhgA:
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.
6ax8 METHIONINE-TRNA
LIGASE

(Mycobacterium
tuberculosis) 		no annotation 5 ILE A 260
HIS A 268
PHE A 332
ALA A  27
PHE A 183
 None
ME8  A 801 (-4.6A)
None
None
None
 1.44A 5iwuA-6ax8A:
undetectable		 5iwuA-6ax8A:
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.
6brd RIFAMPIN
MONOOXYGENASE

(Streptomyces
venezuelae) 		no annotation 5 TYR A 403
HIS A  90
THR A  68
ILE A 294
MET A  15
 None
 1.26A 5iwuA-6brdA:
undetectable		 5iwuA-6brdA:
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.
6c7y TYROSINE-PROTEIN
KINASE JAK1
SUPPRESSOR OF
CYTOKINE SIGNALING 1

(Homo sapiens;
Gallus gallus) 		no annotation
no annotation 		5 ALA B  76
SER B  66
ILE B  67
PHE B  64
MET A1099
 None
 1.39A 5iwuA-6c7yB:
undetectable		 5iwuA-6c7yB:
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.
6emk SERINE/THREONINE-PRO
TEIN KINASE TOR2

(Saccharomyces
cerevisiae) 		no annotation 5 HIS A 946
GLU A1208
ALA A 940
SER A 990
ILE A 991
 None
 1.35A 5iwuA-6emkA:
1.6		 5iwuA-6emkA:
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.
6f4f GLUTATHIONE
TRANSFERASE

(Trametes
versicolor) 		no annotation 5 ILE A 166
TYR A 206
PHE A 111
ALA A 154
SER A  81
 None
None
None
None
GDN  A 301 (-2.6A)
 1.44A 5iwuA-6f4fA:
undetectable		 5iwuA-6f4fA:
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 POLYMERASE ACIDIC
PROTEIN

(Influenza B
virus) 		no annotation 5 ILE A 269
HIS A 268
TYR A 270
SER A 658
ILE A 686
 None
 1.42A 5iwuA-6f5oA:
undetectable		 5iwuA-6f5oA:
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.
6fm9 UDP-N-ACETYLGLUCOSAM
INE--DOLICHYL-PHOSPH
ATE
N-ACETYLGLUCOSAMINEP
HOSPHOTRANSFERASE

(Homo sapiens) 		no annotation 5 ALA A 183
SER A 204
ILE A 205
PHE A 208
MET A 228
 None
P6L  A 501 (-3.4A)
None
None
None
 1.39A 5iwuA-6fm9A:
undetectable		 5iwuA-6fm9A:
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.
6g2j NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
5

(Mus musculus) 		no annotation 5 ILE L 302
PHE L 335
SER L  99
ILE L 100
PHE L 103
 None
 1.32A 5iwuA-6g2jL:
undetectable		 5iwuA-6g2jL:
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.
6g2j NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
5

(Mus musculus) 		no annotation 5 THR L 369
PHE L 335
SER L  99
ILE L 100
PHE L 103
 None
 1.36A 5iwuA-6g2jL:
undetectable		 5iwuA-6g2jL:
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.
1f1u HOMOPROTOCATECHUATE
2,3-DIOXYGENASE

(Arthrobacter
globiformis) 		PF00903
(Glyoxalase) 		4 GLY A 249
ASP A 154
ILE A 268
TYR A 257
 None
 1.02A 5iwuA-1f1uA:
undetectable		 5iwuA-1f1uA:
20.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f1x HOMOPROTOCATECHUATE
2,3-DIOXYGENASE

(Brevibacterium
fuscum) 		PF00903
(Glyoxalase) 		4 GLY A 249
ASP A 154
ILE A 268
TYR A 257
 None
None
None
FEL  A 500 (-4.7A)
 0.86A 5iwuA-1f1xA:
undetectable		 5iwuA-1f1xA:
21.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fta FRUCTOSE-1,6-BISPHOS
PHATASE

(Homo sapiens) 		PF00316
(FBPase) 		4 GLY A 273
ASP A 251
ILE A 261
TYR A 215
 None
 1.08A 5iwuA-1ftaA:
0.6		 5iwuA-1ftaA:
22.99
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.
1hr7 MITOCHONDRIAL
PROCESSING PEPTIDASE
BETA SUBUNIT

(Saccharomyces
cerevisiae) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		4 GLY B  57
ASP B 164
ARG B 178
TYR B 330
 None
 1.07A 5iwuA-1hr7B:
0.0		 5iwuA-1hr7B:
22.17
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.
1kfi PHOSPHOGLUCOMUTASE 1

(Paramecium
tetraurelia) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		4 GLY A 115
ASP A 208
ILE A 402
ARG A 108
 None
 0.99A 5iwuA-1kfiA:
undetectable		 5iwuA-1kfiA:
21.95
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.
1kp2 ARGININOSUCCINATE
SYNTHETASE

(Escherichia
coli) 		PF00764
(Arginosuc_synth) 		4 GLY A 327
ASP A 135
ILE A 283
TYR A  98
 None
ATP  A 459 (-3.5A)
None
PO4  A 456 (-4.5A)
 1.13A 5iwuA-1kp2A:
0.0		 5iwuA-1kp2A:
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.
1luf MUSCLE-SPECIFIC
TYROSINE KINASE
RECEPTOR MUSK

(Rattus
norvegicus) 		PF07714
(Pkinase_Tyr) 		4 GLY A 798
ASP A 724
ILE A 765
ARG A 766
 None
 1.04A 5iwuA-1lufA:
6.8		 5iwuA-1lufA:
22.93
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.
1mt0 HEMOLYSIN SECRETION
ATP-BINDING PROTEIN

(Escherichia
coli) 		PF00005
(ABC_tran) 		4 GLY A 679
ASP A 630
ILE A 515
TYR A 477
 None
 1.01A 5iwuA-1mt0A:
0.0		 5iwuA-1mt0A:
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.
1rpw TRANSCRIPTIONAL
REGULATOR QACR

(Staphylococcus
aureus) 		PF00440
(TetR_N)
PF08360
(TetR_C_5) 		4 GLY A 158
ILE A 130
TYR A  82
TYR A  92
 None
 1.08A 5iwuA-1rpwA:
undetectable		 5iwuA-1rpwA:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ue8 367AA LONG
HYPOTHETICAL
CYTOCHROME P450

(Sulfurisphaera
tokodaii) 		PF00067
(p450) 		4 ASP A 225
ILE A 299
ARG A 302
TYR A   2
 None
 1.14A 5iwuA-1ue8A:
0.0		 5iwuA-1ue8A:
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.
1ven BETA-AMYLASE

(Bacillus cereus) 		PF00686
(CBM_20)
PF01373
(Glyco_hydro_14) 		4 GLY A 168
ILE A 353
TYR A 310
TYR A 178
 None
None
None
GLC  A 903 (-4.5A)
 0.98A 5iwuA-1venA:
undetectable		 5iwuA-1venA:
22.04
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.
1ven BETA-AMYLASE

(Bacillus cereus) 		PF00686
(CBM_20)
PF01373
(Glyco_hydro_14) 		4 GLY A 171
ILE A 353
TYR A 310
TYR A 178
 GLC  A 900 ( 4.9A)
None
None
GLC  A 903 (-4.5A)
 0.97A 5iwuA-1venA:
undetectable		 5iwuA-1venA:
22.04
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.
1w5d PENICILLIN-BINDING
PROTEIN

(Bacillus
subtilis) 		PF02113
(Peptidase_S13) 		4 GLY A 219
ASP A 129
ILE A 154
TYR A 194
 None
 1.12A 5iwuA-1w5dA:
undetectable		 5iwuA-1w5dA:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xyz 1,4-BETA-D-XYLAN-XYL
ANOHYDROLASE

(Ruminiclostridium
thermocellum) 		PF00331
(Glyco_hydro_10) 		4 GLY A 653
ILE A 658
TYR A 667
TYR A 686
 None
 1.04A 5iwuA-1xyzA:
undetectable		 5iwuA-1xyzA:
20.52
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.
1z6c VITAMIN K-DEPENDENT
PROTEIN S

(Homo sapiens) 		PF07645
(EGF_CA) 		4 GLY A 221
ASP A 182
ILE A 170
ARG A 192
 None
 1.09A 5iwuA-1z6cA:
undetectable		 5iwuA-1z6cA:
12.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c4n PROTEIN NAGD

(Escherichia
coli) 		PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6) 		4 GLY A 151
ASP A 201
ILE A  10
TYR A  44
 None
MG  A1251 (-2.6A)
PO4  A1253 ( 4.2A)
PO4  A1253 (-4.2A)
 1.10A 5iwuA-2c4nA:
undetectable		 5iwuA-2c4nA:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ghs AGR_C_1268P

(Agrobacterium
fabrum) 		PF08450
(SGL) 		4 GLY A 121
ASP A 165
ILE A 151
TYR A 152
 None
 1.11A 5iwuA-2ghsA:
1.6		 5iwuA-2ghsA:
24.28
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.
2gk1 BETA-HEXOSAMINIDASE
SUBUNIT ALPHA
BETA-HEXOSAMINIDASE
SUBUNIT BETA CHAIN A

(Homo sapiens;
Homo sapiens) 		no annotation
no annotation 		4 ASP I 175
ARG I 424
TYR N 456
TYR N 547
 None
 1.13A 5iwuA-2gk1I:
undetectable		 5iwuA-2gk1I:
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.
2h34 SERINE/THREONINE-PRO
TEIN KINASE PKNE

(Mycobacterium
tuberculosis) 		PF00069
(Pkinase) 		4 ILE A 198
ARG A 260
TYR A 199
TYR A 215
 None
 1.13A 5iwuA-2h34A:
6.1		 5iwuA-2h34A:
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.
2olw RIBOSOMAL LARGE
SUBUNIT
PSEUDOURIDINE
SYNTHASE E

(Escherichia
coli) 		PF00849
(PseudoU_synth_2) 		4 GLY A  76
ASP A  81
ILE A 195
TYR A 109
 None
 1.14A 5iwuA-2olwA:
undetectable		 5iwuA-2olwA:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oml RIBOSOMAL LARGE
SUBUNIT
PSEUDOURIDINE
SYNTHASE E

(Escherichia
coli) 		PF00849
(PseudoU_synth_2) 		4 GLY A  76
ASP A  81
ILE A 195
TYR A 109
 None
SO4  A1428 ( 4.9A)
None
SO4  A1424 (-4.3A)
 1.08A 5iwuA-2omlA:
undetectable		 5iwuA-2omlA:
20.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q66 POLY(A) POLYMERASE

(Saccharomyces
cerevisiae) 		PF01909
(NTP_transf_2)
PF04926
(PAP_RNA-bind)
PF04928
(PAP_central) 		4 GLY A  88
ILE A 209
ARG A 212
TYR A 224
 ATP  A 605 (-3.2A)
None
None
ATP  A 605 (-4.5A)
 1.02A 5iwuA-2q66A:
undetectable		 5iwuA-2q66A:
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.
2q6t DNAB REPLICATION
FORK HELICASE

(Thermus
aquaticus) 		PF00772
(DnaB)
PF03796
(DnaB_C) 		4 ASP A 378
ILE A 414
ARG A 373
TYR A 396
 None
 1.08A 5iwuA-2q6tA:
undetectable		 5iwuA-2q6tA:
22.87
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.
2qob EPHRIN RECEPTOR

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 GLY A 821
ASP A 746
ILE A 788
ARG A 789
 None
 1.10A 5iwuA-2qobA:
7.9		 5iwuA-2qobA:
22.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qzu PUTATIVE SULFATASE
YIDJ

(Bacteroides
fragilis) 		PF00884
(Sulfatase) 		4 GLY A  44
ILE A 316
ARG A  39
TYR A 246
 None
 0.88A 5iwuA-2qzuA:
undetectable		 5iwuA-2qzuA:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rhq PHENYLALANYL-TRNA
SYNTHETASE ALPHA
CHAIN
PHENYLALANYL-TRNA
SYNTHETASE BETA
CHAIN

(Staphylococcus
haemolyticus;
Staphylococcus
haemolyticus) 		PF01409
(tRNA-synt_2d)
PF01588
(tRNA_bind)
PF03147
(FDX-ACB)
PF03483
(B3_4)
PF03484
(B5) 		4 GLY B 582
ASP A 317
ILE A 215
TYR A 199
 None
 1.02A 5iwuA-2rhqB:
undetectable		 5iwuA-2rhqB:
16.31
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.
2vsq SURFACTIN SYNTHETASE
SUBUNIT 3

(Bacillus
subtilis) 		PF00501
(AMP-binding)
PF00550
(PP-binding)
PF00668
(Condensation)
PF00975
(Thioesterase)
PF13193
(AMP-binding_C) 		4 GLY A 634
ASP A 664
ILE A 531
TYR A 611
 None
 1.12A 5iwuA-2vsqA:
undetectable		 5iwuA-2vsqA:
12.92
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.
2xts SULFITE
DEHYDROGENASE

(Paracoccus
pantotrophus) 		PF00174
(Oxidored_molyb)
PF03404
(Mo-co_dimer) 		4 GLY A 164
ASP A 396
ILE A 401
ARG A 402
 None
GOL  A1432 (-3.5A)
None
None
 1.07A 5iwuA-2xtsA:
undetectable		 5iwuA-2xtsA:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xts SULFITE
DEHYDROGENASE

(Paracoccus
pantotrophus) 		PF00174
(Oxidored_molyb)
PF03404
(Mo-co_dimer) 		4 GLY A 165
ASP A 396
ILE A 401
ARG A 402
 None
GOL  A1432 (-3.5A)
None
None
 1.04A 5iwuA-2xtsA:
undetectable		 5iwuA-2xtsA:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yr0 HYPOTHETICAL PROTEIN
TTHA0223

(Thermus
thermophilus) 		PF08241
(Methyltransf_11) 		4 GLY A 140
ASP A  68
ILE A  65
TYR A  64
 None
 1.14A 5iwuA-2yr0A:
undetectable		 5iwuA-2yr0A:
20.80
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.
3aq1 THERMOSOME SUBUNIT

(Methanococcoides
burtonii) 		PF00118
(Cpn60_TCP1) 		4 GLY B 152
ASP B  83
ILE B 484
TYR B 471
 None
 1.11A 5iwuA-3aq1B:
undetectable		 5iwuA-3aq1B:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ayf NITRIC OXIDE
REDUCTASE

(Geobacillus
stearothermophilus) 		PF00115
(COX1) 		4 GLY A 652
ASP A 500
ILE A 431
TYR A  93
 HEM  A 802 ( 3.9A)
None
None
HEM  A 801 ( 3.9A)
 1.11A 5iwuA-3ayfA:
undetectable		 5iwuA-3ayfA:
16.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bgw DNAB-LIKE
REPLICATIVE HELICASE

(Bacillus phage
SPP1) 		PF00772
(DnaB)
PF03796
(DnaB_C) 		4 ASP A 373
ILE A 409
ARG A 368
TYR A 391
 None
 1.05A 5iwuA-3bgwA:
undetectable		 5iwuA-3bgwA:
23.95
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.
3bh0 DNAB-LIKE
REPLICATIVE HELICASE

(Bacillus phage
SPP1) 		PF03796
(DnaB_C) 		4 ASP A 373
ILE A 409
ARG A 368
TYR A 391
 None
 1.02A 5iwuA-3bh0A:
undetectable		 5iwuA-3bh0A:
19.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bv4 FRUCTOSE-BISPHOSPHAT
E ALDOLASE A

(Oryctolagus
cuniculus) 		PF00274
(Glycolytic) 		4 GLY A 273
ASP A  33
ILE A  39
ARG A  42
 None
None
None
SO4  A   1 (-3.2A)
 1.03A 5iwuA-3bv4A:
undetectable		 5iwuA-3bv4A:
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.
3bwm CATECHOL
O-METHYLTRANSFERASE

(Homo sapiens) 		PF01596
(Methyltransf_3) 		4 GLY A  66
ASP A 205
ILE A  49
TYR A 147
 SAM  A 301 (-3.2A)
None
None
None
 1.07A 5iwuA-3bwmA:
undetectable		 5iwuA-3bwmA:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dcd GALACTOSE MUTAROTASE
RELATED ENZYME

(Lactobacillus
acidophilus) 		PF01263
(Aldose_epim) 		4 GLY A 145
ASP A   2
ILE A   5
TYR A 115
 None
 0.83A 5iwuA-3dcdA:
undetectable		 5iwuA-3dcdA:
24.07
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.
3dwk PENICILLIN-BINDING
PROTEIN 2

(Staphylococcus
aureus) 		PF00905
(Transpeptidase)
PF00912
(Transgly) 		4 ASP A 241
ARG A 283
TYR A 210
TYR A 196
 None
SO4  A  22 (-2.9A)
None
None
 1.08A 5iwuA-3dwkA:
undetectable		 5iwuA-3dwkA:
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.
3eck PROTEIN
(HOMOPROTOCATECHUATE
2,3-DIOXYGENASE)

(Brevibacterium
fuscum) 		PF00903
(Glyoxalase) 		4 GLY A 249
ASP A 154
ILE A 268
TYR A 257
 None
 1.09A 5iwuA-3eckA:
undetectable		 5iwuA-3eckA:
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.
3ecq ENDO-ALPHA-N-ACETYLG
ALACTOSAMINIDASE

(Streptococcus
pneumoniae) 		PF12905
(Glyco_hydro_101)
PF17451
(Glyco_hyd_101C) 		4 GLY A 619
ASP A 764
ILE A 693
TYR A 701
 None
 1.02A 5iwuA-3ecqA:
undetectable		 5iwuA-3ecqA:
11.74
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.
3f8r THIOREDOXIN
REDUCTASE (TRXB-3)

(Sulfolobus
solfataricus) 		PF07992
(Pyr_redox_2) 		4 GLY A  50
ASP A 148
ILE A 245
ARG A 125
 NAP  A4005 (-3.5A)
None
None
None
 0.89A 5iwuA-3f8rA:
undetectable		 5iwuA-3f8rA:
23.61
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.
3fii BOTULINUM NEUROTOXIN
TYPE F
FRAGMENT OF
VESICLE-ASSOCIATED
MEMBRANE PROTEIN 2

(Clostridium
botulinum;
Homo sapiens) 		PF01742
(Peptidase_M27)
PF00957
(Synaptobrevin) 		4 GLY A 186
ASP B  57
ILE A 230
TYR A 349
 None
 0.82A 5iwuA-3fiiA:
undetectable		 5iwuA-3fiiA:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gr8 NADPH DEHYDROGENASE

(Geobacillus
kaustophilus) 		PF00724
(Oxidored_FMN) 		4 GLY A 187
ASP A 220
ILE A 216
TYR A 234
 None
 1.04A 5iwuA-3gr8A:
undetectable		 5iwuA-3gr8A:
22.13
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.
3ip3 OXIDOREDUCTASE,
PUTATIVE

(Thermotoga
maritima) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 GLY A  11
ASP A 248
ILE A 234
TYR A 236
 None
 0.90A 5iwuA-3ip3A:
undetectable		 5iwuA-3ip3A:
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.
3qbo PHOSPHOSERINE
AMINOTRANSFERASE

(Yersinia pestis) 		PF00266
(Aminotran_5) 		4 ASP A 160
ILE A 291
ARG A 294
TYR A 276
 None
 1.02A 5iwuA-3qboA:
undetectable		 5iwuA-3qboA:
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.
3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE

(Mycobacterium
marinum) 		PF13561
(adh_short_C2) 		4 GLY A  97
ASP A 245
ILE A 248
TYR A 230
 None
 1.00A 5iwuA-3r1iA:
undetectable		 5iwuA-3r1iA:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s29 SUCROSE SYNTHASE 1

(Arabidopsis
thaliana) 		PF00534
(Glycos_transf_1)
PF00862
(Sucrose_synth) 		4 GLY A  95
ASP A 138
ILE A 469
TYR A  99
 None
 1.13A 5iwuA-3s29A:
undetectable		 5iwuA-3s29A:
15.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tl2 MALATE DEHYDROGENASE

(Bacillus
anthracis) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 GLY A 223
ASP A 153
ILE A 210
ARG A 213
 None
 1.13A 5iwuA-3tl2A:
undetectable		 5iwuA-3tl2A:
26.06
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.
3v5q NT-3 GROWTH FACTOR
RECEPTOR

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 GLY A 767
ASP A 679
ILE A 734
ARG A 735
 None
 0.89A 5iwuA-3v5qA:
6.0		 5iwuA-3v5qA:
24.71
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.
3vsz RICIN B LECTIN

(Ruminiclostridium
thermocellum) 		PF04616
(Glyco_hydro_43)
PF14200
(RicinB_lectin_2) 		4 GLY A 175
ILE A 157
ARG A 158
TYR A 206
 None
 1.05A 5iwuA-3vszA:
undetectable		 5iwuA-3vszA:
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.
3zzw TYROSINE-PROTEIN
KINASE TRANSMEMBRANE
RECEPTOR ROR2

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 GLY A 689
ASP A 615
ILE A 656
ARG A 657
 None
 0.99A 5iwuA-3zzwA:
6.4		 5iwuA-3zzwA:
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.
4a1f REPLICATIVE DNA
HELICASE

(Helicobacter
pylori) 		PF03796
(DnaB_C) 		4 ASP A 371
ILE A 441
ARG A 366
TYR A 389
 None
 1.04A 5iwuA-4a1fA:
undetectable		 5iwuA-4a1fA:
22.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4arx PESTICIDAL CRYSTAL
PROTEIN CRY1AC

(Bacillus
thuringiensis) 		PF00555
(Endotoxin_M)
PF03944
(Endotoxin_C)
PF03945
(Endotoxin_N) 		4 GLY A 425
ASP A  62
ILE A  38
TYR A  33
 None
 1.10A 5iwuA-4arxA:
undetectable		 5iwuA-4arxA:
19.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4at3 BDNF/NT-3 GROWTH
FACTORS RECEPTOR

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 GLY A 766
ASP A 692
ILE A 733
ARG A 734
 None
 0.94A 5iwuA-4at3A:
6.2		 5iwuA-4at3A:
22.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4au0 EXOGLUCANASE 2

(Trichoderma
reesei) 		PF01341
(Glyco_hydro_6) 		4 GLY A 183
ASP A 263
ILE A 246
TYR A 242
 None
 1.11A 5iwuA-4au0A:
undetectable		 5iwuA-4au0A:
18.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aw5 EPHRIN TYPE-B
RECEPTOR 4

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 GLY A 293
ASP A 216
ILE A 260
ARG A 261
 None
 1.10A 5iwuA-4aw5A:
7.0		 5iwuA-4aw5A:
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.
4awe ENDO-BETA-D-1,4-MANN
ANASE

(Neurospora
sitophila) 		PF00150
(Cellulase) 		4 GLY A  78
ILE A 363
TYR A 364
TYR A 353
 CL  A1394 ( 3.9A)
None
None
None
 1.03A 5iwuA-4aweA:
undetectable		 5iwuA-4aweA:
21.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cak INTEGRIN ALPHA-IIB
INTEGRIN BETA-3

(Homo sapiens;
Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2)
PF00362
(Integrin_beta)
PF07965
(Integrin_B_tail)
PF07974
(EGF_2)
PF17205
(PSI_integrin) 		4 GLY A 309
ASP B 288
ILE B 226
TYR B 321
 None
 1.13A 5iwuA-4cakA:
undetectable		 5iwuA-4cakA:
14.94
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.
4e3e MAOC DOMAIN PROTEIN
DEHYDRATASE

(Chloroflexus
aurantiacus) 		PF01575
(MaoC_dehydratas) 		4 GLY A 265
ASP A  65
ILE A 255
TYR A 345
 None
 0.81A 5iwuA-4e3eA:
undetectable		 5iwuA-4e3eA:
20.43
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.
4f0i HIGH AFFINITY NERVE
GROWTH FACTOR
RECEPTOR

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 GLY A 723
ASP A 649
ILE A 690
ARG A 691
 None
 0.90A 5iwuA-4f0iA:
4.2		 5iwuA-4f0iA:
23.99
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.
4fz4 UNCHARACTERIZED
PROTEIN CONSERVED IN
BACTERIA

(Streptococcus
suis) 		PF16828
(GAGBD) 		4 GLY A  80
ILE A 152
ARG A 143
TYR A 156
 None
 1.13A 5iwuA-4fz4A:
undetectable		 5iwuA-4fz4A:
20.82
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.
4glf RSFP

(uncultured
bacterium) 		PF01048
(PNP_UDP_1) 		4 GLY A  20
ILE A 174
TYR A 171
TYR A 214
 None
 1.07A 5iwuA-4glfA:
undetectable		 5iwuA-4glfA:
23.98
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.
4gvr METHENYLTETRAHYDROME
THANOPTERIN
CYCLOHYDROLASE

(Archaeoglobus
fulgidus) 		PF02289
(MCH) 		4 GLY A 108
ASP A  37
ILE A  34
TYR A 104
 None
 1.05A 5iwuA-4gvrA:
undetectable		 5iwuA-4gvrA:
21.79
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.
4gzu FERM, RHOGEF AND
PLECKSTRIN
DOMAIN-CONTAINING
PROTEIN 2

(Mus musculus) 		PF00169
(PH)
PF00621
(RhoGEF) 		4 GLY A 617
ASP A 537
ILE A 542
TYR A 702
 None
 1.00A 5iwuA-4gzuA:
undetectable		 5iwuA-4gzuA:
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.
4i5u CHIMERIC CEL6A

(Humicola
insolens;
Trichoderma
reesei;
Chaetomium
thermophilum) 		PF01341
(Glyco_hydro_6) 		4 GLY A 184
ASP A 264
ILE A 247
TYR A 243
 EDO  A 507 (-3.3A)
None
None
None
 1.09A 5iwuA-4i5uA:
undetectable		 5iwuA-4i5uA:
20.79
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.
4kpn NUCLEOSIDE
N-RIBOHYDROLASE 1

(Physcomitrella
patens) 		PF01156
(IU_nuc_hydro) 		4 GLY A 175
ASP A 258
ILE A 254
TYR A 244
 None
CA  A 400 (-2.8A)
None
None
 1.02A 5iwuA-4kpnA:
undetectable		 5iwuA-4kpnA:
20.80
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.
4o0l NADPH-DEPENDENT
3-QUINUCLIDINONE
REDUCTASE

(Rhodotorula
mucilaginosa) 		PF13561
(adh_short_C2) 		4 GLY A 115
ASP A 262
ILE A 265
TYR A 247
 NDP  A 300 (-3.5A)
None
None
None
 0.97A 5iwuA-4o0lA:
undetectable		 5iwuA-4o0lA:
21.81
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.
4p2k EPHRIN TYPE-A
RECEPTOR 2

(Homo sapiens) 		PF07714
(Pkinase_Tyr)
PF14575
(EphA2_TM) 		4 GLY A 814
ASP A 739
ILE A 781
ARG A 782
 None
 1.04A 5iwuA-4p2kA:
7.8		 5iwuA-4p2kA:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q1z PUTATIVE LIPOPROTEIN

(Bacteroides
thetaiotaomicron) 		PF16215
(DUF4876) 		4 GLY A 380
ASP A 329
ILE A 108
TYR A 114
 None
 1.07A 5iwuA-4q1zA:
2.3		 5iwuA-4q1zA:
22.17
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.
4wfn 50S RIBOSOMAL
PROTEIN L19

(Deinococcus
radiodurans) 		PF01245
(Ribosomal_L19) 		4 GLY M  74
ASP M  31
ILE M  55
ARG M  69
 None
 1.11A 5iwuA-4wfnM:
undetectable		 5iwuA-4wfnM:
20.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4whm UDP-GLUCOSE:ANTHOCYA
NIDIN
3-O-GLUCOSYLTRANSFER
ASE

(Clitoria
ternatea) 		PF00201
(UDPGT) 		4 GLY A 369
ASP A 184
ILE A 148
TYR A 145
 GOL  A1003 (-3.7A)
None
None
None
 1.14A 5iwuA-4whmA:
undetectable		 5iwuA-4whmA:
22.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4woq N-ACETYLNEURAMINATE
LYASE

(Clostridioides
difficile) 		PF00701
(DHDPS) 		4 GLY A  56
ASP A 201
ILE A  18
TYR A 147
 None
 1.09A 5iwuA-4woqA:
undetectable		 5iwuA-4woqA:
25.00
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.
4ynu GLUCOSE OXIDASE,
PUTATIVE

(Aspergillus
flavus) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		4 GLY A  88
ASP A 315
ILE A 425
TYR A  65
 FAD  A 601 (-3.0A)
None
None
None
 1.14A 5iwuA-4ynuA:
undetectable		 5iwuA-4ynuA:
19.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ypv EST8

(Parvibaculum) 		PF07859
(Abhydrolase_3) 		4 GLY A  88
ASP A  42
TYR A  83
TYR A 187
 None
 1.12A 5iwuA-4ypvA:
undetectable		 5iwuA-4ypvA:
23.43
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.
4zc0 REPLICATIVE DNA
HELICASE

(Helicobacter
pylori) 		PF00772
(DnaB)
PF03796
(DnaB_C) 		4 ASP A 371
ILE A 441
ARG A 366
TYR A 389
 None
 1.07A 5iwuA-4zc0A:
undetectable		 5iwuA-4zc0A:
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.
5a55 ENDO-ALPHA-N-ACETYLG
ALACTOSAMINIDASE

(Streptococcus
pneumoniae) 		PF12905
(Glyco_hydro_101)
PF17451
(Glyco_hyd_101C) 		4 GLY A 619
ASP A 764
ILE A 693
TYR A 701
 None
 0.96A 5iwuA-5a55A:
undetectable		 5iwuA-5a55A:
14.30
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.
5c1b TRANSITIONAL
ENDOPLASMIC
RETICULUM ATPASE

(Homo sapiens) 		PF00004
(AAA)
PF02359
(CDC48_N)
PF02933
(CDC48_2)
PF09336
(Vps4_C) 		4 GLY A  97
ASP A 204
ILE A  32
ARG A  83
 None
 1.13A 5iwuA-5c1bA:
undetectable		 5iwuA-5c1bA:
18.03
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.
5czj DIHYDRODIPICOLINATE
SYNTHASE

(Sinorhizobium
meliloti) 		PF00701
(DHDPS) 		4 GLY A  97
ASP A 275
ILE A 210
TYR A 161
 None
 1.11A 5iwuA-5czjA:
undetectable		 5iwuA-5czjA:
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.
5efn HDAC6 PROTEIN

(Danio rerio) 		no annotation 4 GLY B 714
ASP B 610
ILE B 666
TYR B 678
 None
K  B 802 (-3.1A)
None
None
 1.14A 5iwuA-5efnB:
undetectable		 5iwuA-5efnB:
19.95
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.
5eyf GLUTAMATE ABC
SUPERFAMILY ATP
BINDING CASSETTE
TRANSPORTER, BINDING
PROTEIN

(Enterococcus
faecium) 		PF00497
(SBP_bac_3) 		4 GLY A  55
ILE A  97
ARG A  96
TYR A 128
 None
None
GGL  A 301 (-3.1A)
None
 1.07A 5iwuA-5eyfA:
undetectable		 5iwuA-5eyfA:
20.52
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.
5g0h HDAC6

(Danio rerio) 		PF00850
(Hist_deacetyl) 		4 GLY A 714
ASP A 610
ILE A 666
TYR A 678
 None
K  A1802 (-3.2A)
None
None
 1.13A 5iwuA-5g0hA:
undetectable		 5iwuA-5g0hA:
17.22
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.
5gjw VOLTAGE-DEPENDENT
CALCIUM CHANNEL
SUBUNIT
ALPHA-2/DELTA-1

(Oryctolagus
cuniculus) 		PF00092
(VWA)
PF08399
(VWA_N)
PF08473
(VGCC_alpha2) 		4 ASP F 764
ARG F 769
TYR F 601
TYR F 782
 None
 1.13A 5iwuA-5gjwF:
undetectable		 5iwuA-5gjwF:
14.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h2t TREHALOSE SYNTHASE

(Thermomonospora
curvata) 		no annotation 4 GLY A  35
ASP A  55
ILE A 110
TYR A  29
 None
 1.10A 5iwuA-5h2tA:
3.0		 5iwuA-5h2tA:
18.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5htk 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
SPHOSPHATASE 2

(Homo sapiens) 		PF00300
(His_Phos_1)
PF01591
(6PF2K) 		4 GLY A  75
ASP A 189
ILE A 194
TYR A 197
 FLC  A 601 (-3.0A)
None
None
GOL  A 606 ( 3.4A)
 0.84A 5iwuA-5htkA:
undetectable		 5iwuA-5htkA:
19.52
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.
5i6z SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER

(Homo sapiens) 		PF00209
(SNF) 		4 GLY A 129
ASP A  98
ILE A  93
TYR A 121
 None
 0.98A 5iwuA-5i6zA:
undetectable		 5iwuA-5i6zA:
21.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5igu MACROLIDE
2'-PHOSPHOTRANSFERAS
E II

(Escherichia
coli) 		PF01636
(APH) 		4 ASP A 200
ILE A 233
ARG A 237
TYR A 273
 None
 0.42A 5iwuA-5iguA:
31.5		 5iwuA-5iguA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5igu MACROLIDE
2'-PHOSPHOTRANSFERAS
E II

(Escherichia
coli) 		PF01636
(APH) 		4 ILE A 233
ARG A 237
TYR A 273
TYR A 289
 None
 0.88A 5iwuA-5iguA:
31.5		 5iwuA-5iguA:
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.
5l1b GLUTAMATE RECEPTOR
2,GLUTAMATE RECEPTOR
2

(Rattus
norvegicus) 		PF00060
(Lig_chan)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		4 GLY A 230
ASP A 138
ILE A 193
TYR A 280
 None
 1.10A 5iwuA-5l1bA:
undetectable		 5iwuA-5l1bA:
16.46
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.
5l6o EPHRIN TYPE-B
RECEPTOR 3

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 GLY A 835
ASP A 758
ILE A 802
ARG A 803
 None
 1.08A 5iwuA-5l6oA:
6.6		 5iwuA-5l6oA:
23.15
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.
5ljo OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTOR BAMA

(Escherichia
coli) 		PF01103
(Bac_surface_Ag)
PF07244
(POTRA) 		4 GLY A 407
ASP A 401
ILE A 352
TYR A 319
 None
 0.97A 5iwuA-5ljoA:
undetectable		 5iwuA-5ljoA:
18.44
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.
5m41 NIGRITOXINE

(Vibrio
nigripulchritudo) 		no annotation 4 GLY A 339
ILE A 499
TYR A 498
TYR A 545
 None
 1.14A 5iwuA-5m41A:
undetectable		 5iwuA-5m41A:
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.
5m41 NIGRITOXINE

(Vibrio
nigripulchritudo) 		no annotation 4 GLY A 433
ASP A 196
ILE A 247
ARG A  28
 None
 1.01A 5iwuA-5m41A:
undetectable		 5iwuA-5m41A:
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.
5mif 'CARBOXYL ESTERASE 2

(Tuber
melanosporum) 		PF07859
(Abhydrolase_3) 		4 GLY A 119
ILE A 132
TYR A 114
TYR A 218
 None
 1.06A 5iwuA-5mifA:
undetectable		 5iwuA-5mifA:
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.
5nmi CYTOCHROME B
CYTOCHROME C1, HEME
PROTEIN,
MITOCHONDRIAL

(Bos taurus;
Bos taurus) 		PF00032
(Cytochrom_B_C)
PF00033
(Cytochrome_B)
PF02167
(Cytochrom_C1) 		4 GLY D 155
ASP C 254
ILE D 116
TYR D 126
 None
None
HEC  D 501 (-4.3A)
HEC  D 501 (-4.2A)
 1.09A 5iwuA-5nmiD:
undetectable		 5iwuA-5nmiD:
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.
5or7 CAPSID PROTEIN

(Norwalk virus) 		no annotation 5 GLY A 327
ASP A 403
ILE A 420
ARG A 268
TYR A 408
 None
None
None
None
NA  A 600 (-4.5A)
 1.40A 5iwuA-5or7A:
undetectable		 5iwuA-5or7A:
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.
5tu0 LMO2125 PROTEIN

(Listeria
monocytogenes) 		PF13416
(SBP_bac_8) 		4 GLY A 304
ILE A 362
ARG A 347
TYR A 365
 None
 1.10A 5iwuA-5tu0A:
undetectable		 5iwuA-5tu0A:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5us8 ARGININOSUCCINATE
SYNTHASE

(Bordetella
pertussis) 		PF00764
(Arginosuc_synth) 		4 GLY A 328
ASP A 136
ILE A 284
TYR A  99
 None
 1.06A 5iwuA-5us8A:
undetectable		 5iwuA-5us8A:
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.
5ux1 TRNA-(MS(2)IO(6)A)-H
YDROXYLASE-LIKE

(Synechococcus
sp. CC9605) 		no annotation 4 GLY A 121
ILE A 187
TYR A 182
TYR A  67
 None
 1.03A 5iwuA-5ux1A:
undetectable		 5iwuA-5ux1A:
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.
6exs PEPTIDE ABC
TRANSPORTER PERMEASE

(Staphylococcus
hominis) 		no annotation 4 GLY A 396
ASP A 326
ARG A 324
TYR A 320
 OLC  A 505 (-3.4A)
None
None
None
 1.08A 5iwuA-6exsA:
undetectable		 5iwuA-6exsA:
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.
6fn1 HUMAN-MOUSE CHIMERIC
ABCB1 (ABCBHM)

(Homo sapiens) 		no annotation 4 GLY A1072
ASP A1199
ILE A1227
TYR A1043
 None
 1.13A 5iwuA-6fn1A:
undetectable		 5iwuA-6fn1A:
undetectable