SIMILAR PATTERNS OF AMINO ACIDS FOR 3SUE_D_SUED1201_1

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ac5 KEX1(DELTA)P

(Saccharomyces
cerevisiae) 		PF00450
(Peptidase_S10) 		5 HIS A 448
ASP A 383
GLY A  75
SER A 176
SER A  89
 None
 1.21A 3sueD-1ac5A:
undetectable		 3sueD-1ac5A:
17.35
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.
1b25 PROTEIN
(FORMALDEHYDE
FERREDOXIN
OXIDOREDUCTASE)

(Pyrococcus
furiosus) 		PF01314
(AFOR_C)
PF02730
(AFOR_N) 		5 GLY A 415
GLY A 314
SER A 315
PHE A 263
ALA A 266
 None
 1.27A 3sueD-1b25A:
undetectable		 3sueD-1b25A:
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.
1cc1 HYDROGENASE (LARGE
SUBUNIT)

(Desulfomicrobium
baculatum) 		PF00374
(NiFeSe_Hases) 		5 PHE L 420
GLY L 419
ARG L 425
GLY L 252
ALA L 423
 None
None
FCO  L 499 (-4.1A)
None
FCO  L 499 (-3.1A)
 1.14A 3sueD-1cc1L:
undetectable		 3sueD-1cc1L:
18.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1cu1 PROTEIN
(PROTEASE/HELICASE
NS3)

(Hepacivirus C) 		PF02907
(Peptidase_S29)
PF07652
(Flavi_DEAD) 		9 GLN A  41
PHE A  43
HIS A  57
GLY A  58
ASP A  81
ARG A 123
GLY A 137
PHE A 154
ALA A 156
 None
 0.52A 3sueD-1cu1A:
34.7		 3sueD-1cu1A:
80.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1cu1 PROTEIN
(PROTEASE/HELICASE
NS3)

(Hepacivirus C) 		PF02907
(Peptidase_S29)
PF07652
(Flavi_DEAD) 		8 GLN A  41
PHE A  43
HIS A  57
GLY A  58
ASP A  81
GLY A 137
SER A 139
PHE A 154
 None
 0.65A 3sueD-1cu1A:
34.7		 3sueD-1cu1A:
80.58
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.
1efp PROTEIN (ELECTRON
TRANSFER
FLAVOPROTEIN)

(Paracoccus
denitrificans) 		PF00766
(ETF_alpha)
PF01012
(ETF) 		5 GLN A 240
HIS A 264
GLY A 242
GLY A 224
ALA A 255
 FAD  A 399 (-3.9A)
FAD  A 399 (-3.9A)
FAD  A 399 (-3.1A)
None
None
 1.07A 3sueD-1efpA:
undetectable		 3sueD-1efpA:
22.56
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.
1efv ELECTRON TRANSFER
FLAVOPROTEIN

(Homo sapiens) 		PF00766
(ETF_alpha)
PF01012
(ETF) 		5 GLN A 262
HIS A 286
GLY A 264
GLY A 246
ALA A 277
 FAD  A 599 (-3.8A)
FAD  A 599 (-3.8A)
FAD  A 599 (-3.1A)
None
None
 1.03A 3sueD-1efvA:
undetectable		 3sueD-1efvA:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jik TYROSYL-TRNA
SYNTHETASE

(Staphylococcus
aureus) 		PF00579
(tRNA-synt_1b) 		5 GLN A 196
GLY A 198
GLY A  83
SER A 154
SER A 164
 545  A 421 (-3.4A)
None
None
None
None
 1.20A 3sueD-1jikA:
undetectable		 3sueD-1jikA:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jkm BREFELDIN A ESTERASE

(Bacillus
subtilis) 		PF07859
(Abhydrolase_3) 		5 HIS A 338
ASP A 308
ARG A 331
GLY A 126
SER A 202
 None
 0.91A 3sueD-1jkmA:
undetectable		 3sueD-1jkmA:
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.
1jkm BREFELDIN A ESTERASE

(Bacillus
subtilis) 		PF07859
(Abhydrolase_3) 		5 HIS A 338
ASP A 308
ARG A 331
GLY A 203
SER A 202
 None
 1.23A 3sueD-1jkmA:
undetectable		 3sueD-1jkmA:
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.
1jxn ANTI-H(O) LECTIN I

(Ulex europaeus) 		PF00139
(Lectin_legB) 		5 PHE A 107
GLY A  88
GLY A 108
SER A 215
ALA A  24
 None
 1.20A 3sueD-1jxnA:
undetectable		 3sueD-1jxnA:
21.54
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.
1k32 TRICORN PROTEASE

(Thermoplasma
acidophilum) 		PF03572
(Peptidase_S41)
PF07676
(PD40)
PF14684
(Tricorn_C1)
PF14685
(Tricorn_PDZ) 		5 HIS A 746
GLY A 993
GLY A 918
SER A 965
SER A 158
 None
 1.18A 3sueD-1k32A:
undetectable		 3sueD-1k32A:
11.09
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.
1kig FACTOR XA

(Bos taurus) 		PF00089
(Trypsin) 		5 GLN H  61
HIS H  57
ASP H 102
GLY H 193
SER H 195
 None
 0.90A 3sueD-1kigH:
9.9		 3sueD-1kigH:
21.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ns3 NS3 PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		5 GLN A  41
HIS A  57
ASP A  81
GLY A 137
SER A 139
 None
 1.06A 3sueD-1ns3A:
30.7		 3sueD-1ns3A:
77.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ns3 NS3 PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		8 GLN A  41
PHE A  43
HIS A  57
GLY A  58
ASP A  81
ARG A 123
GLY A 137
ALA A 156
 None
 0.83A 3sueD-1ns3A:
30.7		 3sueD-1ns3A:
77.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ns3 NS3 PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		8 PHE A  43
HIS A  57
GLY A  58
ASP A  81
ARG A 123
GLY A 137
PHE A 154
ALA A 156
 None
 0.56A 3sueD-1ns3A:
30.7		 3sueD-1ns3A:
77.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1og0 PHOSPHO-2-DEHYDRO-3-
DEOXYHEPTONATE
ALDOLASE

(Saccharomyces
cerevisiae) 		PF00793
(DAHP_synth_1) 		5 GLY A 156
SER A 173
PHE A 196
ALA A 169
SER A 164
 None
None
None
PHE  A1012 (-3.2A)
None
 1.27A 3sueD-1og0A:
undetectable		 3sueD-1og0A:
20.27
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.
1p3c GLUTAMYL-ENDOPEPTIDA
SE

(Bacillus
intermedius) 		PF00089
(Trypsin) 		5 HIS A  47
ASP A  97
GLY A 169
SER A 171
ALA A 188
 None
 0.72A 3sueD-1p3cA:
10.8		 3sueD-1p3cA:
23.01
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.
1ub3 ALDOLASE PROTEIN

(Thermus
thermophilus) 		PF01791
(DeoC) 		5 GLY A 128
ASP A 165
GLY A 155
SER A 153
ALA A 181
 None
None
HPD  A 801 (-3.6A)
None
None
 1.21A 3sueD-1ub3A:
undetectable		 3sueD-1ub3A:
19.15
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.
1umb 2-OXO ACID
DEHYDROGENASE BETA
SUBUNIT

(Thermus
thermophilus) 		PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 GLN B  46
GLY B  43
ASP B  15
GLY B  49
ALA B  19
 None
 1.21A 3sueD-1umbB:
undetectable		 3sueD-1umbB:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fjk FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Thermus
caldophilus) 		PF01116
(F_bP_aldolase) 		5 PHE A 299
GLY A  20
GLY A 300
SER A 301
ALA A 305
 None
 1.29A 3sueD-2fjkA:
undetectable		 3sueD-2fjkA:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nx9 OXALOACETATE
DECARBOXYLASE 2,
SUBUNIT ALPHA

(Vibrio cholerae) 		PF00682
(HMGL-like)
PF02436
(PYC_OADA) 		5 GLY A 242
ASP A  17
ARG A  87
GLY A 182
SER A 345
 None
ZN  A 601 (-2.6A)
None
None
None
 1.24A 3sueD-2nx9A:
undetectable		 3sueD-2nx9A:
18.41
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.
2o69 IRON-UTILIZATION
PERIPLASMIC PROTEIN

(Haemophilus
influenzae) 		PF01547
(SBP_bac_1) 		5 ASP A 295
ARG A 103
GLY A 154
SER A 150
ALA A 148
 None
 1.18A 3sueD-2o69A:
undetectable		 3sueD-2o69A:
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.
2p7u CYSTEINE PROTEASE

(Trypanosoma
brucei) 		PF00112
(Peptidase_C1) 		5 PHE A  61
ASP A  57
GLY A  64
ALA A  27
SER A 183
 D1R  A 300 ( 4.9A)
None
D1R  A 300 (-4.0A)
None
None
 1.27A 3sueD-2p7uA:
undetectable		 3sueD-2p7uA:
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.
2pnc COPPER AMINE
OXIDASE, LIVER
ISOZYME

(Bos taurus) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF02728
(Cu_amine_oxidN3) 		5 GLY A 387
ARG A 622
GLY A 368
ALA A 623
SER A 618
 None
 1.15A 3sueD-2pncA:
undetectable		 3sueD-2pncA:
12.64
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.
2vid SERINE PROTEASE SPLB

(Staphylococcus
aureus) 		PF00089
(Trypsin) 		5 HIS A  39
ASP A  77
GLY A 155
SER A 157
ALA A 174
 None
 0.71A 3sueD-2vidA:
12.3		 3sueD-2vidA:
22.12
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.
2x7j 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE
-1-CARBOXYLATE
SYNTHASE

(Bacillus
subtilis) 		PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
PF16582
(TPP_enzyme_M_2) 		5 GLN A  51
GLY A 466
GLY A 442
PHE A 401
SER A  95
 None
 1.16A 3sueD-2x7jA:
undetectable		 3sueD-2x7jA:
16.84
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.
2x7j 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE
-1-CARBOXYLATE
SYNTHASE

(Bacillus
subtilis) 		PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
PF16582
(TPP_enzyme_M_2) 		5 GLY A 466
ARG A 428
GLY A 442
PHE A 401
SER A  95
 None
 1.28A 3sueD-2x7jA:
undetectable		 3sueD-2x7jA:
16.84
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.
2xfs ORF12

(Streptomyces
clavuligerus) 		PF13354
(Beta-lactamase2) 		5 GLN A 408
GLY A 381
ASP A 325
GLY A 316
SER A 206
 None
 1.24A 3sueD-2xfsA:
undetectable		 3sueD-2xfsA:
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.
2xt6 2-OXOGLUTARATE
DECARBOXYLASE

(Mycolicibacterium
smegmatis) 		PF00198
(2-oxoacid_dh)
PF00676
(E1_dh)
PF02779
(Transket_pyr)
PF16870
(OxoGdeHyase_C) 		5 HIS A 847
GLY A 844
GLY A 887
PHE A 943
ALA A 913
 None
 1.21A 3sueD-2xt6A:
undetectable		 3sueD-2xt6A:
12.15
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.
2z1k (NEO)PULLULANASE

(Thermus
thermophilus) 		PF00128
(Alpha-amylase) 		5 GLN A 284
PHE A 261
GLY A 407
GLY A 260
ALA A 266
 None
 1.17A 3sueD-2z1kA:
undetectable		 3sueD-2z1kA:
17.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z8c INSULIN RECEPTOR

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		5 PHE A1007
GLY A1152
ASP A1132
SER A1006
SER A1086
 None
 1.27A 3sueD-2z8cA:
undetectable		 3sueD-2z8cA:
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.
2zsg AMINOPEPTIDASE P,
PUTATIVE

(Thermotoga
maritima) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		6 GLN A  63
PHE A  38
GLY A  40
GLY A  37
SER A  32
ALA A  30
 None
 1.29A 3sueD-2zsgA:
undetectable		 3sueD-2zsgA:
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.
3aja PUTATIVE
UNCHARACTERIZED
PROTEIN

(Mycolicibacterium
smegmatis) 		PF01083
(Cutinase) 		5 HIS A 300
GLY A 293
ASP A 269
GLY A  83
SER A 176
 None
 1.03A 3sueD-3ajaA:
undetectable		 3sueD-3ajaA:
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.
3c10 HISTONE DEACETYLASE
7A

(Homo sapiens) 		PF00850
(Hist_deacetyl) 		5 HIS A 806
GLY A 811
GLY A 799
ALA A 847
SER A 550
 None
 1.15A 3sueD-3c10A:
undetectable		 3sueD-3c10A:
18.99
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.
3c10 HISTONE DEACETYLASE
7A

(Homo sapiens) 		PF00850
(Hist_deacetyl) 		5 HIS A 806
GLY A 811
GLY A 841
ALA A 847
SER A 550
 None
None
TSN  A 301 ( 3.9A)
None
None
 1.30A 3sueD-3c10A:
undetectable		 3sueD-3c10A:
18.99
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.
3cfx UPF0100 PROTEIN
MA_0280

(Methanosarcina
acetivorans) 		PF13531
(SBP_bac_11) 		5 GLY A  49
ASP A 161
SER A  81
ALA A  79
SER A 105
 WO4  A 701 (-3.2A)
WO4  A 701 (-2.8A)
None
None
None
 1.16A 3sueD-3cfxA:
undetectable		 3sueD-3cfxA:
21.41
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.
3d5e PLATELET-ACTIVATING
FACTOR
ACETYLHYDROLASE

(Homo sapiens) 		PF03403
(PAF-AH_p_II) 		5 GLY A 152
GLY A 271
SER A 150
ALA A 226
SER A 284
 DEP  A 473 (-3.5A)
None
None
None
None
 1.24A 3sueD-3d5eA:
undetectable		 3sueD-3d5eA:
18.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3doc GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE

(Brucella
abortus) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 GLY A  11
ASP A  36
ARG A  80
GLY A 100
PHE A 102
 NAD  A 901 (-2.2A)
NAD  A 901 (-3.6A)
None
NAD  A 901 ( 3.8A)
None
 1.18A 3sueD-3docA:
undetectable		 3sueD-3docA:
22.73
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.
3fcy XYLAN ESTERASE 1

(Thermoanaerobacterium
saccharolyticum) 		PF05448
(AXE1) 		5 PHE A 207
HIS A 301
ASP A 272
GLY A  90
SER A 182
 None
 1.02A 3sueD-3fcyA:
undetectable		 3sueD-3fcyA:
19.26
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.
3ff1 GLUCOSE-6-PHOSPHATE
ISOMERASE

(Staphylococcus
aureus) 		PF00342
(PGI) 		5 GLN A 313
GLY A 371
GLY A 315
PHE A 318
SER A 297
 None
 1.10A 3sueD-3ff1A:
undetectable		 3sueD-3ff1A:
18.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gcw PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF00082
(Peptidase_S8) 		5 GLN A 382
HIS A 226
ASP A 186
GLY A 384
SER A 386
 None
 0.93A 3sueD-3gcwA:
undetectable		 3sueD-3gcwA:
18.22
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.
3k6x SOLUTE-BINDING
PROTEIN MA_0280

(Methanosarcina
acetivorans) 		PF13531
(SBP_bac_11) 		5 GLY A  49
ASP A 161
SER A  81
ALA A  79
SER A 105
 MOO  A 500 (-3.5A)
MOO  A 500 (-2.7A)
None
None
None
 1.21A 3sueD-3k6xA:
undetectable		 3sueD-3k6xA:
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.
3lmk METABOTROPIC
GLUTAMATE RECEPTOR 5

(Homo sapiens) 		PF01094
(ANF_receptor) 		5 ARG A 200
GLY A 303
SER A 304
ALA A 199
SER A 235
 None
 1.22A 3sueD-3lmkA:
undetectable		 3sueD-3lmkA:
17.74
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.
3mfd D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE
DACB

(Bacillus
subtilis) 		PF00768
(Peptidase_S11)
PF07943
(PBP5_C) 		5 HIS A 156
GLY A 157
ASP A 160
GLY A 116
SER A  83
 None
 1.15A 3sueD-3mfdA:
undetectable		 3sueD-3mfdA:
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.
3n0t DIPEPTIDYL PEPTIDASE
2

(Homo sapiens) 		PF05577
(Peptidase_S28) 		5 GLY A 415
ASP A 446
GLY A 424
PHE A 412
ALA A 184
 None
 1.28A 3sueD-3n0tA:
undetectable		 3sueD-3n0tA:
19.37
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.
3qfh EPIDERMIN LEADER
PEPTIDE PROCESSING
SERINE PROTEASE EPIP

(Staphylococcus
aureus) 		PF00082
(Peptidase_S8) 		5 GLN A 389
HIS A 187
ASP A 140
GLY A 391
SER A 393
 None
 0.91A 3sueD-3qfhA:
undetectable		 3sueD-3qfhA:
19.39
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.
3qgu LL-DIAMINOPIMELATE
AMINOTRANSFERASE

(Chlamydomonas
reinhardtii) 		PF00155
(Aminotran_1_2) 		5 PHE A 414
GLY A 380
GLY A 404
ALA A 417
SER A  73
 None
 1.28A 3sueD-3qguA:
undetectable		 3sueD-3qguA:
16.70
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.
3qo6 PROTEASE DO-LIKE 1,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		5 HIS A 173
ASP A 203
GLY A 280
SER A 282
ALA A 299
 None
 0.78A 3sueD-3qo6A:
8.8		 3sueD-3qo6A:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3stj PROTEASE DEGQ

(Escherichia
coli) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		5 HIS A  82
ASP A 112
GLY A 185
SER A 187
ALA A 204
 None
 0.70A 3sueD-3stjA:
4.3		 3sueD-3stjA:
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.
3viu PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE 2

(Thermus
thermophilus) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		5 GLN A 305
GLY A 208
SER A 302
ALA A 263
SER A  39
 None
 1.18A 3sueD-3viuA:
undetectable		 3sueD-3viuA:
15.15
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.
3wmr PROLINE
IMINOPEPTIDASE

(Streptomyces
halstedii) 		PF00561
(Abhydrolase_1) 		5 HIS A 277
ASP A 250
GLY A  38
SER A 110
ALA A 133
 None
 1.19A 3sueD-3wmrA:
undetectable		 3sueD-3wmrA:
16.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ze7 PERIPLASMIC [NIFESE]
HYDROGENASE, LARGE
SUBUNIT,
SELENOCYSTEINE-CONTA
INING

(Desulfovibrio
vulgaris) 		PF00374
(NiFeSe_Hases) 		5 PHE B 417
GLY B 416
ARG B 422
GLY B 249
ALA B 420
 None
None
FCO  B 500 (-4.2A)
None
FCO  B 500 (-3.2A)
 1.08A 3sueD-3ze7B:
undetectable		 3sueD-3ze7B:
18.33
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.
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacterium
smegmatis) 		PF00676
(E1_dh)
PF02779
(Transket_pyr)
PF16870
(OxoGdeHyase_C) 		5 HIS A 847
GLY A 844
GLY A 887
PHE A 943
ALA A 913
 None
 1.22A 3sueD-3zhrA:
undetectable		 3sueD-3zhrA:
14.57
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.
4b46 CELL DIVISION
PROTEIN FTSZ

(Haloferax
volcanii) 		PF00091
(Tubulin) 		5 PHE A   8
GLY A 115
ARG A 354
GLY A  12
SER A 105
 None
 1.27A 3sueD-4b46A:
undetectable		 3sueD-4b46A:
19.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b8s ADP-DEPENDENT
GLUCOKINASE

(Thermococcus
litoralis) 		PF04587
(ADP_PFK_GK) 		5 HIS A 350
GLY A 303
GLY A 450
SER A 454
ALA A 375
 None
GOL  A1468 (-4.5A)
AMP  A1472 ( 3.7A)
GOL  A1468 ( 4.5A)
None
 1.27A 3sueD-4b8sA:
undetectable		 3sueD-4b8sA:
15.96
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.
4c2l ENDO-XYLOGALACTURONA
N HYDROLASE A

(Aspergillus
tubingensis) 		PF00295
(Glyco_hydro_28) 		5 GLN A 319
ASP A 228
GLY A 284
ALA A 232
SER A 237
 SO4  A1410 ( 4.6A)
SO4  A1410 ( 4.1A)
None
None
None
 0.96A 3sueD-4c2lA:
undetectable		 3sueD-4c2lA:
17.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4chb KELCH-LIKE PROTEIN 2

(Homo sapiens) 		PF01344
(Kelch_1) 		5 GLN A 315
PHE A 361
ARG A 437
GLY A 360
SER A 391
 None
 1.24A 3sueD-4chbA:
undetectable		 3sueD-4chbA:
21.96
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.
4cta CINA-LIKE PROTEIN

(Thermus
thermophilus) 		PF00994
(MoCF_biosynth)
PF02464
(CinA) 		5 PHE A 331
GLY A 291
GLY A 332
SER A 333
ALA A 262
 None
 1.23A 3sueD-4ctaA:
undetectable		 3sueD-4ctaA:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fcs VERSATILE PEROXIDASE
VPL2

(Pleurotus
eryngii) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		5 GLY A  51
GLY A  63
SER A  64
PHE A  68
ALA A 131
 CA  A 402 ( 4.7A)
None
CA  A 402 (-2.4A)
None
None
 1.02A 3sueD-4fcsA:
undetectable		 3sueD-4fcsA:
21.02
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.
4i8i HYPOTHETICAL PROTEIN

(Bacteroides
uniformis) 		PF16227
(DUF4886) 		5 GLN A  43
HIS A 226
ASP A 223
GLY A  69
SER A 127
 None
 1.17A 3sueD-4i8iA:
undetectable		 3sueD-4i8iA:
20.57
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.
4j0w U3 SMALL NUCLEOLAR
RNA-INTERACTING
PROTEIN 2

(Homo sapiens) 		PF00400
(WD40) 		5 HIS A 323
GLY A 322
ARG A 401
SER A 340
SER A 395
 None
 1.28A 3sueD-4j0wA:
undetectable		 3sueD-4j0wA:
21.43
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.
4kpu ELECTRON TRANSFER
FLAVOPROTEIN ALPHA
SUBUNIT

(Acidaminococcus
fermentans) 		PF00766
(ETF_alpha)
PF01012
(ETF) 		5 GLN A 266
HIS A 290
GLY A 268
GLY A 250
ALA A 281
 FAD  A 401 (-4.1A)
FAD  A 401 (-3.9A)
FAD  A 401 (-3.3A)
None
None
 1.03A 3sueD-4kpuA:
undetectable		 3sueD-4kpuA:
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.
4mzd NISIN LEADER
PEPTIDE-PROCESSING
SERINE PROTEASE NISP

(Lactococcus
lactis) 		PF00082
(Peptidase_S8) 		5 HIS A 306
ASP A 259
GLY A 510
SER A 512
ALA A 364
 None
 0.72A 3sueD-4mzdA:
undetectable		 3sueD-4mzdA:
17.66
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.
4n0q LEU/ILE/VAL-BINDING
PROTEIN HOMOLOG 3

(Brucella
melitensis) 		PF13458
(Peripla_BP_6) 		5 GLY A 173
ASP A 178
GLY A 246
PHE A 180
LYS A 181
 None
 1.23A 3sueD-4n0qA:
undetectable		 3sueD-4n0qA:
23.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4nwk HCV NS3 1A PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		5 GLN A  41
ARG A 123
GLY A 137
SER A 139
PHE A 154
 2R8  A 301 ( 3.5A)
None
GOL  A 305 ( 3.2A)
2R8  A 301 (-2.6A)
2R8  A 301 (-3.7A)
 0.80A 3sueD-4nwkA:
33.8		 3sueD-4nwkA:
98.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4nwk HCV NS3 1A PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		5 GLN A  41
GLY A 137
SER A 139
PHE A 154
ALA A 157
 2R8  A 301 ( 3.5A)
GOL  A 305 ( 3.2A)
2R8  A 301 (-2.6A)
2R8  A 301 (-3.7A)
2R8  A 301 (-3.8A)
 1.19A 3sueD-4nwkA:
33.8		 3sueD-4nwkA:
98.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4nwk HCV NS3 1A PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		9 GLN A  41
PHE A  43
HIS A  57
GLY A  58
ASP A  81
GLY A 137
SER A 139
PHE A 154
ALA A 156
 2R8  A 301 ( 3.5A)
2R8  A 301 (-4.6A)
2R8  A 301 (-3.3A)
2R8  A 301 (-3.5A)
2R8  A 301 (-3.6A)
GOL  A 305 ( 3.2A)
2R8  A 301 (-2.6A)
2R8  A 301 (-3.7A)
2R8  A 301 (-3.1A)
 0.30A 3sueD-4nwkA:
33.8		 3sueD-4nwkA:
98.98
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.
4oh1 L-IDITOL
2-DEHYDROGENASE

([Clostridium]
scindens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 HIS A  73
GLY A  72
GLY A  46
SER A  47
SER A 164
 ZN  A 401 (-3.5A)
None
OCS  A  45 ( 2.4A)
OCS  A  45 ( 3.0A)
None
 1.20A 3sueD-4oh1A:
undetectable		 3sueD-4oh1A:
19.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oqj PKS

(Streptomyces
albus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 GLY A 434
GLY A 374
SER A 432
ALA A 325
SER A 393
 GOL  A 903 ( 4.0A)
None
None
None
None
 1.20A 3sueD-4oqjA:
undetectable		 3sueD-4oqjA:
14.83
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.
4ov6 PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF00082
(Peptidase_S8) 		5 GLN B 382
HIS B 226
ASP B 186
GLY B 384
SER B 386
 None
 0.95A 3sueD-4ov6B:
undetectable		 3sueD-4ov6B:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r1d UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 5 HIS A 535
ASP A 497
GLY A  56
SER A 256
SER A 142
 None
 1.22A 3sueD-4r1dA:
undetectable		 3sueD-4r1dA:
16.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rt6 HEME/HEMOPEXIN-BINDI
NG PROTEIN

(Haemophilus
influenzae) 		PF05860
(Haemagg_act) 		5 GLY A 711
ASP A 726
ARG A 683
GLY A 708
ALA A 730
 None
 1.17A 3sueD-4rt6A:
undetectable		 3sueD-4rt6A:
12.17
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.
4rus FISH-EGG LECTIN

(Cyprinus carpio) 		PF06462
(Hyd_WA) 		5 GLN A  80
GLY A  91
GLY A  56
ALA A  52
SER A  17
 None
 1.23A 3sueD-4rusA:
undetectable		 3sueD-4rusA:
23.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tu3 PHOSPHOINOSITIDE
PHOSPHATASE SAC1

(Saccharomyces
cerevisiae) 		PF02383
(Syja_N) 		5 GLN X  34
HIS X  30
GLY X  13
ARG X 174
GLY X  37
 None
 1.30A 3sueD-4tu3X:
undetectable		 3sueD-4tu3X:
16.15
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.
4ypj BETA GALACTOSIDASE

(Bacillus
circulans) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		5 PHE A 596
GLY A 623
ASP A 791
GLY A 617
ALA A 795
 None
 1.25A 3sueD-4ypjA:
undetectable		 3sueD-4ypjA:
14.87
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.
4zbt ACETOACETATE
DECARBOXYLASE

(Streptomyces
bingchenggensis) 		PF06314
(ADC) 		5 PHE A 149
ASP A  64
GLY A 150
PHE A  62
SER A 154
 None
 1.25A 3sueD-4zbtA:
undetectable		 3sueD-4zbtA:
23.38
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.
5cxu FERULIC ACID
ESTERASE AMCE1/FAE1A

(Anaeromyces
mucronatus) 		PF00756
(Esterase) 		5 HIS A 253
ASP A 222
GLY A  64
SER A 156
SER A  77
 None
 0.98A 3sueD-5cxuA:
undetectable		 3sueD-5cxuA:
21.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5eqq NS3 PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		9 GLN A1041
PHE A1043
HIS A1057
GLY A1058
ASP A1081
ARG A1123
GLY A1137
PHE A1154
ALA A1156
 5RS  A1203 (-2.9A)
5RS  A1203 (-4.3A)
5RS  A1203 (-2.5A)
5RS  A1203 ( 2.9A)
5RS  A1203 (-3.5A)
5RS  A1203 ( 3.3A)
5RS  A1203 (-3.2A)
5RS  A1203 (-3.3A)
5RS  A1203 (-2.9A)
 0.29A 3sueD-5eqqA:
33.9		 3sueD-5eqqA:
93.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ffq SHUY-LIKE PROTEIN

(Escherichia
coli) 		PF13460
(NAD_binding_10) 		5 PHE A   7
HIS A  86
ARG A 149
GLY A   8
SER A  75
 None
 1.25A 3sueD-5ffqA:
undetectable		 3sueD-5ffqA:
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.
5gk2 KETOSYNTHASE STLD

(Photorhabdus
laumondii) 		PF08541
(ACP_syn_III_C) 		5 GLY A  95
GLY A 129
SER A 340
ALA A 197
SER A  11
 None
 1.25A 3sueD-5gk2A:
undetectable		 3sueD-5gk2A:
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.
5h3h ABHYDROLASE
DOMAIN-CONTAINING
PROTEIN

(Exiguobacterium
antarcticum) 		PF00561
(Abhydrolase_1)
PF08386
(Abhydrolase_4) 		5 HIS A 248
ASP A 220
GLY A  29
SER A  96
ALA A 120
 F50  A 301 (-4.0A)
None
F50  A 301 (-3.4A)
F50  A 301 (-2.4A)
None
 1.28A 3sueD-5h3hA:
undetectable		 3sueD-5h3hA:
23.33
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.
5hc4 LIPOLYTIC ENZYME

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		6 HIS A 317
ASP A 287
ARG A 310
GLY A 107
SER A 188
SER A 330
 TRS  A 402 (-4.3A)
None
None
TRS  A 402 ( 3.8A)
TRS  A 402 (-2.3A)
None
 1.23A 3sueD-5hc4A:
undetectable		 3sueD-5hc4A:
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.
5hc4 LIPOLYTIC ENZYME

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 HIS A 317
ASP A 287
ARG A 310
GLY A 189
SER A 188
 TRS  A 402 (-4.3A)
None
None
TRS  A 402 (-4.1A)
TRS  A 402 (-2.3A)
 1.19A 3sueD-5hc4A:
undetectable		 3sueD-5hc4A:
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.
5i2t PERIODIC TRYPTOPHAN
PROTEIN 2

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		5 HIS A 145
GLY A 144
ASP A 167
PHE A 187
ALA A 170
 None
 1.29A 3sueD-5i2tA:
undetectable		 3sueD-5i2tA:
15.73
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.
5ijl DNA POLYMERASE II
LARGE SUBUNIT

(Pyrococcus
abyssi) 		PF03833
(PolC_DP2) 		5 GLY A 983
ASP A 986
GLY A 145
ALA A 117
SER A 158
 None
 1.29A 3sueD-5ijlA:
undetectable		 3sueD-5ijlA:
11.53
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.
5nkp KELCH-LIKE PROTEIN 3

(Homo sapiens) 		PF01344
(Kelch_1) 		5 GLN A 309
PHE A 355
ARG A 431
GLY A 354
SER A 385
 None
None
None
None
CL  A 602 (-2.9A)
 1.29A 3sueD-5nkpA:
undetectable		 3sueD-5nkpA:
22.65
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.
5o67 FAPF

(Pseudomonas sp.
UK4) 		no annotation 5 PHE B 102
GLY B 104
GLY B 101
SER B 100
SER B 334
 None
 1.24A 3sueD-5o67B:
undetectable		 3sueD-5o67B:
20.90
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.
5t95 PREPHENATE
DEHYDROGENASE 1

(Glycine max) 		PF02153
(PDH) 		5 PHE A  23
GLY A 128
ASP A 222
GLY A  21
SER A  77
 None
TYR  A 302 ( 3.1A)
TYR  A 302 ( 2.9A)
None
NAP  A 301 (-3.5A)
 1.06A 3sueD-5t95A:
undetectable		 3sueD-5t95A:
25.31
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.
5ti1 FUMARYLACETOACETATE
HYDROLASE

(Paraburkholderia
xenovorans) 		PF01557
(FAA_hydrolase)
PF09298
(FAA_hydrolase_N) 		5 PHE A 146
GLY A 177
GLY A 368
SER A 148
ALA A 153
 None
None
MG  A 501 ( 4.7A)
None
None
 1.24A 3sueD-5ti1A:
undetectable		 3sueD-5ti1A:
18.65
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.
5to3 PROTHROMBIN,THROMBOM
ODULIN

(Homo sapiens) 		PF00089
(Trypsin)
PF09064
(Tme5_EGF_like) 		5 HIS B  58
ASP B 114
GLY B 218
SER B 220
ALA B 242
 0G6  B 501 (-2.5A)
None
0G6  B 501 (-3.9A)
0G6  B 501 (-1.3A)
0G6  B 501 (-3.4A)
 0.73A 3sueD-5to3B:
10.1		 3sueD-5to3B:
16.63
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.
5tr9 FERREDOXIN-NADP
REDUCTASE

(Neisseria
gonorrhoeae) 		PF00175
(NAD_binding_1) 		5 GLY A 266
GLY A 129
SER A 130
PHE A  80
ALA A  81
 FAD  A 301 (-4.9A)
EDO  A 304 (-3.3A)
FAD  A 301 (-2.8A)
None
FAD  A 301 (-3.8A)
 1.18A 3sueD-5tr9A:
undetectable		 3sueD-5tr9A:
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.
5upr TRIOSEPHOSPHATE
ISOMERASE

(Toxoplasma
gondii) 		PF00121
(TIM) 		5 PHE A 121
GLY A 123
GLY A 120
PHE A 345
ALA A 370
 None
 1.27A 3sueD-5uprA:
undetectable		 3sueD-5uprA:
21.66
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.
5vlh PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF00082
(Peptidase_S8)
PF05922
(Inhibitor_I9) 		5 GLN A 382
HIS A 226
ASP A 186
GLY A 384
SER A 386
 None
 0.89A 3sueD-5vlhA:
undetectable		 3sueD-5vlhA:
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.
5wdx JFH-1 NS3

(Hepacivirus C) 		no annotation 8 GLN A  41
PHE A  43
HIS A  57
ARG A 123
GLY A 137
SER A 139
PHE A 154
ALA A 156
 None
 0.64A 3sueD-5wdxA:
27.3		 3sueD-5wdxA:
21.85
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.
5wdx JFH-1 NS3

(Hepacivirus C) 		no annotation 9 PHE A  43
HIS A  57
GLY A  58
ASP A  81
ARG A 123
GLY A 137
SER A 139
PHE A 154
ALA A 156
 None
 0.46A 3sueD-5wdxA:
27.3		 3sueD-5wdxA:
21.85
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.
6arx ACETYLCHOLINESTERASE

(Anopheles
gambiae) 		no annotation 5 GLY A 279
SER A 280
PHE A 281
ALA A 394
SER A 367
 None
 1.21A 3sueD-6arxA:
undetectable		 3sueD-6arxA:
19.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6dkh L-IDONATE
5-DEHYDROGENASE
(NAD(P)(+))

(Escherichia
coli) 		no annotation 5 HIS A  65
GLY A  64
GLY A  41
SER A  42
SER A 289
 None
 1.11A 3sueD-6dkhA:
undetectable		 3sueD-6dkhA:
17.33
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.
6ei3 PROTON-DEPENDENT
OLIGOPEPTIDE
TRANSPORTER FAMILY
PROTEIN

(Xanthomonas
campestris) 		no annotation 5 HIS A 105
GLY A 191
GLY A  35
SER A  32
PHE A  33
 None
 1.13A 3sueD-6ei3A:
undetectable		 3sueD-6ei3A:
17.27
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.
6fkx ACETYL XYLAN
ESTERASE

(metagenome) 		no annotation 5 HIS C 304
ASP C 275
ARG C 297
GLY C  92
SER C 185
 None
 0.84A 3sueD-6fkxC:
undetectable		 3sueD-6fkxC:
21.84