SIMILAR PATTERNS OF AMINO ACIDS FOR 3AOC_C_ERYC3402

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.
1a9n U2A'
SPLICEOSOMAL U2B''

(Homo sapiens;
Homo sapiens) 		PF14580
(LRR_9)
PF00076
(RRM_1) 		5 SER B  29
MET B  17
MET B  82
ILE B  14
LEU A 145
 None
 1.35A 3aocC-1a9nB:
3.0		 3aocC-1a9nB:
8.26
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.
1g7u 2-DEHYDRO-3-DEOXYPHO
SPHOOCTONATE
ALDOLASE

(Escherichia
coli) 		PF00793
(DAHP_synth_1) 		5 SER A  57
MET A 148
PHE A 155
ILE A 151
GLU A 239
 None
 1.42A 3aocC-1g7uA:
0.0		 3aocC-1g7uA:
15.44
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.
1gzk RAC-BETA
SERINE/THREONINE
PROTEIN KINASE

(Homo sapiens) 		PF00069
(Pkinase)
PF00433
(Pkinase_C) 		5 SER A 261
PHE A 409
PHE A 254
ILE A 412
ASP A 284
 None
 1.42A 3aocC-1gzkA:
0.0		 3aocC-1gzkA:
15.33
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.
1ihm CAPSID PROTEIN

(Norwalk virus) 		PF00915
(Calici_coat)
PF08435
(Calici_coat_C) 		5 MET A1332
ILE A1330
LEU A1356
GLU A1313
GLU A1303
 None
 1.37A 3aocC-1ihmA:
0.0		 3aocC-1ihmA:
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.
1mi8 DNAB INTEIN

(Synechocystis
sp. PCC 6803) 		PF14890
(Intein_splicing) 		5 SER A   3
PHE A  75
PHE A 145
ILE A 150
LEU A  23
 None
 1.45A 3aocC-1mi8A:
undetectable		 3aocC-1mi8A:
10.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nhc POLYGALACTURONASE I

(Aspergillus
niger) 		PF00295
(Glyco_hydro_28) 		5 SER A  75
PHE A 170
PHE A  79
ILE A 150
PHE A  85
 None
 1.05A 3aocC-1nhcA:
undetectable		 3aocC-1nhcA:
14.64
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.
1qge PROTEIN
(TRIACYLGLYCEROL
HYDROLASE)
PROTEIN
(TRIACYLGLYCEROL
HYDROLASE)

(Burkholderia
glumae;
Burkholderia
glumae) 		PF00561
(Abhydrolase_1)
no annotation 		5 SER E 270
SER D  54
LEU D 164
ASP D 121
GLU D 118
 None
 1.43A 3aocC-1qgeE:
undetectable		 3aocC-1qgeE:
7.45
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.
1qor QUINONE
OXIDOREDUCTASE

(Escherichia
coli) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 SER A  90
PHE A 284
ILE A 287
LEU A 325
ASP A  44
 None
 1.35A 3aocC-1qorA:
0.0		 3aocC-1qorA:
16.41
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.
1siq GLUTARYL-COA
DEHYDROGENASE

(Homo sapiens) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 SER A  98
MET A  56
PHE A  48
ILE A  52
PHE A  27
 None
 1.45A 3aocC-1siqA:
undetectable		 3aocC-1siqA:
17.36
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.
1vjz ENDOGLUCANASE

(Thermotoga
maritima) 		PF00150
(Cellulase) 		5 PHE A  30
ILE A  79
LEU A 136
ASP A 176
GLU A 139
 None
 1.28A 3aocC-1vjzA:
undetectable		 3aocC-1vjzA:
15.59
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.
1xmb IAA-AMINO ACID
HYDROLASE HOMOLOG 2

(Arabidopsis
thaliana) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 PHE A 295
LEU A 198
ASP A 112
GLU A 173
GLU A 172
 None
 1.39A 3aocC-1xmbA:
6.4		 3aocC-1xmbA:
18.10
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.
2b24 NAPHTHALENE
DIOXYGENASE LARGE
SUBUNIT

(Rhodococcus sp.
NCIMB 12038) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		5 SER A 303
PHE A 156
PHE A 299
LEU A 205
GLU A  37
 None
 1.30A 3aocC-2b24A:
undetectable		 3aocC-2b24A:
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.
2bf4 NADPH-CYTOCHROME
P450 REDUCTASE

(Saccharomyces
cerevisiae) 		PF00175
(NAD_binding_1)
PF00258
(Flavodoxin_1)
PF00667
(FAD_binding_1) 		5 PHE A 333
ILE A 352
PHE A 321
ASP A  74
GLU A  73
 None
None
None
FMN  A 752 (-3.5A)
None
 1.44A 3aocC-2bf4A:
undetectable		 3aocC-2bf4A:
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.
2gep SULFITE REDUCTASE
HEMOPROTEIN

(Escherichia
coli) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		5 SER A 530
MET A 474
PHE A 548
ILE A 472
PHE A 454
 None
 1.27A 3aocC-2gepA:
undetectable		 3aocC-2gepA:
19.08
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.
2h8q RED FLUORESCENT
PROTEIN DRFP583

(Discosoma sp.) 		PF01353
(GFP) 		5 SER A 179
SER A  62
PHE A 124
ILE A  29
PHE A  56
 None
 1.28A 3aocC-2h8qA:
undetectable		 3aocC-2h8qA:
11.56
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.
2hhl CTD SMALL
PHOSPHATASE-LIKE
PROTEIN

(Homo sapiens) 		PF03031
(NIF) 		5 SER A 146
SER A 118
LEU A  88
ASP A  36
GLU A  37
 None
 1.31A 3aocC-2hhlA:
undetectable		 3aocC-2hhlA:
11.10
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.
2iai PUTATIVE
TRANSCRIPTIONAL
REGULATOR SCO3833

(Streptomyces
coelicolor) 		PF00440
(TetR_N) 		5 MET A  93
ILE A 161
PHE A 127
ASP A 137
GLU A 141
 None
 1.45A 3aocC-2iaiA:
undetectable		 3aocC-2iaiA:
12.75
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.
2np0 BOTULINUM NEUROTOXIN
TYPE B

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N) 		5 SER A1023
SER A 964
MET A1055
ILE A1053
LEU A 974
 None
 1.34A 3aocC-2np0A:
1.0		 3aocC-2np0A:
21.47
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.
2nz2 ARGININOSUCCINATE
SYNTHASE

(Homo sapiens) 		PF00764
(Arginosuc_synth) 		5 SER A 134
SER A  92
PHE A  72
ILE A  38
LEU A 320
 None
 1.47A 3aocC-2nz2A:
undetectable		 3aocC-2nz2A:
17.26
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.
2ocz 3-DEHYDROQUINATE
DEHYDRATASE

(Streptococcus
pyogenes) 		PF01487
(DHquinase_I) 		5 SER A 116
MET A 178
ILE A 176
PHE A 120
LEU A  61
 None
EDO  A 503 ( 4.3A)
None
None
None
 1.41A 3aocC-2oczA:
undetectable		 3aocC-2oczA:
11.69
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.
2oz8 MLL7089 PROTEIN

(Mesorhizobium
japonicum) 		PF13378
(MR_MLE_C) 		5 SER A 292
PHE A  52
LEU A 251
ASP A 223
GLU A 222
 None
 1.33A 3aocC-2oz8A:
undetectable		 3aocC-2oz8A:
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.
2wym L-ASCORBATE-6-PHOSPH
ATE LACTONASE ULAG

(Escherichia
coli) 		PF13483
(Lactamase_B_3) 		5 MET A  40
PHE A 321
ILE A  48
PHE A  38
ASP A 328
 None
 1.24A 3aocC-2wymA:
undetectable		 3aocC-2wymA:
15.17
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.
2xpz LEUKOTRIENE A-4
HYDROLASE

(Saccharomyces
cerevisiae) 		PF01433
(Peptidase_M1)
PF09127
(Leuk-A4-hydro_C) 		5 PHE A 285
ILE A 338
LEU A 552
ASP A 393
GLU A 430
 None
 1.41A 3aocC-2xpzA:
undetectable		 3aocC-2xpzA:
20.56
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.
3a14 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE

(Thermotoga
maritima) 		PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C) 		5 PHE A 327
ILE A 330
PHE A 309
LEU A 161
ASP A 142
 None
None
None
None
MG  A 900 ( 2.6A)
 1.27A 3aocC-3a14A:
undetectable		 3aocC-3a14A:
16.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ct9 ACETYLORNITHINE
DEACETYLASE

(Bacteroides
thetaiotaomicron) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 SER A  72
MET A 165
ILE A 319
LEU A  19
GLU A  11
 None
 1.45A 3aocC-3ct9A:
5.8		 3aocC-3ct9A:
16.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dla GLUTAMINE-DEPENDENT
NAD(+) SYNTHETASE

(Mycobacterium
tuberculosis) 		PF00795
(CN_hydrolase)
PF02540
(NAD_synthase) 		5 SER A 281
SER A 570
ILE A 672
ASP A 275
GLU A 277
 None
 1.39A 3aocC-3dlaA:
undetectable		 3aocC-3dlaA:
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.
3f6f CG18548-PA
(IP02196P)
(IP02193P)

(Drosophila
melanogaster) 		PF00043
(GST_C)
PF13417
(GST_N_3) 		5 SER A  66
PHE A 118
ILE A 117
LEU A 161
ASP A 101
 None
 1.38A 3aocC-3f6fA:
undetectable		 3aocC-3f6fA:
12.29
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.
3gdb PUTATIVE
UNCHARACTERIZED
PROTEIN SPR0440

(Streptococcus
pneumoniae) 		PF03644
(Glyco_hydro_85) 		5 SER A 260
PHE A 494
PHE A 409
GLU A 178
GLU A 265
 None
 1.43A 3aocC-3gdbA:
undetectable		 3aocC-3gdbA:
22.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hba PUTATIVE
PHOSPHOSUGAR
ISOMERASE

(Shewanella
denitrificans) 		PF01380
(SIS) 		5 SER A 159
PHE A  63
ILE A  94
LEU A  23
GLU A  30
 None
 1.20A 3aocC-3hbaA:
undetectable		 3aocC-3hbaA:
16.72
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.
3i7f ASPARTYL-TRNA
SYNTHETASE

(Entamoeba
histolytica) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		5 SER A 470
MET A 350
ILE A 335
PHE A 354
GLU A 517
 None
 1.10A 3aocC-3i7fA:
undetectable		 3aocC-3i7fA:
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.
3l39 PUTATIVE PHOU-LIKE
PHOSPHATE REGULATORY
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF01865
(PhoU_div) 		5 SER A 114
ILE A 105
LEU A 168
ASP A 163
GLU A 159
 PO4  A 220 (-2.8A)
None
None
None
None
 1.39A 3aocC-3l39A:
undetectable		 3aocC-3l39A:
11.51
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.
3stg 2-DEHYDRO-3-DEOXYPHO
SPHOOCTONATE
ALDOLASE

(Neisseria
meningitidis) 		PF00793
(DAHP_synth_1) 		5 SER A  54
MET A 144
PHE A 151
ILE A 147
GLU A 224
 None
 1.47A 3aocC-3stgA:
undetectable		 3aocC-3stgA:
13.90
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.
3t24 PORIN

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		5 SER A 201
SER A 239
PHE A 185
ILE A 281
LEU A 252
 None
 1.33A 3aocC-3t24A:
undetectable		 3aocC-3t24A:
17.38
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.
3txo PROTEIN KINASE C ETA
TYPE

(Homo sapiens) 		PF00069
(Pkinase)
PF00433
(Pkinase_C) 		5 SER A 465
PHE A 614
PHE A 458
ILE A 617
ASP A 488
 None
 1.27A 3aocC-3txoA:
undetectable		 3aocC-3txoA:
15.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3txx PUTRESCINE
CARBAMOYLTRANSFERASE

(Enterococcus
faecalis) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 SER A  58
MET A  46
MET A 101
PHE A  48
LEU A 270
 None
 1.47A 3aocC-3txxA:
undetectable		 3aocC-3txxA:
15.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3w9h ACRIFLAVINE
RESISTANCE PROTEIN B

(Escherichia
coli) 		PF00873
(ACR_tran) 		6 SER A  79
MET A 575
PHE A 615
ASP A 681
GLU A 683
GLU A 826
 None
 1.17A 3aocC-3w9hA:
57.1		 3aocC-3w9hA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3w9h ACRIFLAVINE
RESISTANCE PROTEIN B

(Escherichia
coli) 		PF00873
(ACR_tran) 		5 SER A  79
SER A 133
ASP A 681
GLU A 683
GLU A 826
 None
 1.02A 3aocC-3w9hA:
57.1		 3aocC-3w9hA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3w9h ACRIFLAVINE
RESISTANCE PROTEIN B

(Escherichia
coli) 		PF00873
(ACR_tran) 		9 SER A  79
SER A 135
MET A 573
PHE A 615
ILE A 626
PHE A 666
ASP A 681
GLU A 683
GLU A 826
 None
 0.48A 3aocC-3w9hA:
57.1		 3aocC-3w9hA:
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.
3wdo MFS TRANSPORTER

(Escherichia
coli) 		PF07690
(MFS_1) 		5 MET A 121
MET A 137
PHE A 144
ILE A 140
LEU A 215
 None
 1.40A 3aocC-3wdoA:
0.5		 3aocC-3wdoA:
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.
4d1y PUTATIVE PROTEASE I

(Bacteroides
thetaiotaomicron) 		PF01965
(DJ-1_PfpI) 		5 MET A  94
PHE A 119
ILE A  97
PHE A  81
LEU A 133
 None
 1.47A 3aocC-4d1yA:
undetectable		 3aocC-4d1yA:
12.55
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.
4fai CG5976, ISOFORM B

(Drosophila
melanogaster) 		PF04389
(Peptidase_M28) 		5 SER A 154
PHE A 281
LEU A 185
ASP A 294
GLU A 190
 None
None
None
None
PBD  A 402 (-3.5A)
 1.39A 3aocC-4faiA:
undetectable		 3aocC-4faiA:
15.40
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.
4fdh CYTOCHROME P450
11B2, MITOCHONDRIAL

(Homo sapiens) 		PF00067
(p450) 		5 MET A 230
PHE A 223
PHE A 264
LEU A 132
GLU A 302
 None
 1.17A 3aocC-4fdhA:
undetectable		 3aocC-4fdhA:
19.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fhn NUCLEOPORIN NUP120

(Schizosaccharomyces
pombe) 		PF11715
(Nup160) 		5 SER B 186
MET B 111
PHE B 167
ILE B 131
LEU B 254
 None
 1.48A 3aocC-4fhnB:
undetectable		 3aocC-4fhnB:
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.
4fmv GLUCURONOARABINOXYLA
N
ENDO-1,4-BETA-XYLANA
SE

([Clostridium]
papyrosolvens) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		5 MET A 199
MET A 162
ILE A 189
LEU A  48
GLU A  52
 None
 1.34A 3aocC-4fmvA:
undetectable		 3aocC-4fmvA:
17.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g38 SULFITE REDUCTASE
[NADPH] HEMOPROTEIN
BETA-COMPONENT

(Escherichia
coli) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		5 SER A 530
MET A 474
PHE A 548
ILE A 472
PHE A 454
 None
 1.34A 3aocC-4g38A:
undetectable		 3aocC-4g38A:
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.
4gv1 RAC-ALPHA
SERINE/THREONINE-PRO
TEIN KINASE

(Homo sapiens) 		PF00069
(Pkinase)
PF00433
(Pkinase_C) 		5 SER A 259
PHE A 408
PHE A 252
ILE A 411
ASP A 283
 None
 1.34A 3aocC-4gv1A:
undetectable		 3aocC-4gv1A:
15.71
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.
4k37 ANAEROBIC
SULFATASE-MATURATING
ENZYME

(Clostridium
perfringens) 		PF04055
(Radical_SAM)
PF13186
(SPASM)
PF13353
(Fer4_12) 		5 SER A  46
MET A  39
PHE A  61
ILE A   8
GLU A 299
 None
 1.39A 3aocC-4k37A:
undetectable		 3aocC-4k37A:
15.66
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.
4o7i 3'(2'),5'-BISPHOSPHA
TE NUCLEOTIDASE,
PUTATIVE

(Entamoeba
histolytica) 		PF00459
(Inositol_P) 		5 ILE A 294
PHE A 282
LEU A 136
GLU A  70
GLU A  69
 None
None
None
None
MG  A 401 (-2.7A)
 1.08A 3aocC-4o7iA:
undetectable		 3aocC-4o7iA:
15.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ovr TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Xanthobacter
autotrophicus) 		PF03480
(DctP) 		5 SER A 172
MET A 316
PHE A 110
ILE A 320
LEU A 137
 None
 1.28A 3aocC-4ovrA:
undetectable		 3aocC-4ovrA:
16.28
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.
4pka PATATIN-17

(Solanum
cardiophyllum) 		PF01734
(Patatin) 		5 SER X 153
MET X 253
ILE X 245
PHE X 307
ASP X  35
 MIS  X  77 ( 4.7A)
None
None
None
None
 1.36A 3aocC-4pkaX:
undetectable		 3aocC-4pkaX:
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.
4qfh GLUCOSE-6-PHOSPHATE
ISOMERASE

(Trypanosoma
cruzi) 		PF00342
(PGI) 		5 MET A 230
ILE A 340
PHE A 232
LEU A 399
GLU A 548
 None
 1.43A 3aocC-4qfhA:
undetectable		 3aocC-4qfhA:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w91 AMINOTRANSFERASE

(Brucella suis) 		PF00266
(Aminotran_5) 		5 MET A 301
ILE A 309
PHE A  87
ASP A 208
GLU A 130
 None
None
None
LLP  A 234 ( 2.5A)
None
 1.47A 3aocC-4w91A:
undetectable		 3aocC-4w91A:
18.30
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.
4wen K88 FIMBRIAL PROTEIN
AC

(Escherichia
coli) 		PF02432
(Fimbrial_K88) 		5 SER A 224
MET A 215
PHE A 159
ILE A 158
ASP A 206
 None
 1.39A 3aocC-4wenA:
undetectable		 3aocC-4wenA:
15.17
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.
4zdn AT-LESS POLYKETIDE
SYNTHASE

(Streptomyces
platensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 SER A 895
PHE A 939
ILE A 874
LEU A 789
ASP A 775
 None
 1.17A 3aocC-4zdnA:
undetectable		 3aocC-4zdnA:
21.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5eno MULTIDRUG EFFLUX
PUMP SUBUNIT
ACRB,MULTIDRUG
EFFLUX PUMP SUBUNIT
ACRB

(Escherichia
coli) 		PF00873
(ACR_tran) 		5 SER A  79
PHE A 664
ASP A 681
GLU A 683
GLU A 826
 None
 1.09A 3aocC-5enoA:
47.3		 3aocC-5enoA:
73.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5eno MULTIDRUG EFFLUX
PUMP SUBUNIT
ACRB,MULTIDRUG
EFFLUX PUMP SUBUNIT
ACRB

(Escherichia
coli) 		PF00873
(ACR_tran) 		9 SER A  79
SER A 135
MET A 573
PHE A 615
ILE A 626
PHE A 666
ASP A 681
GLU A 683
GLU A 826
 None
 0.68A 3aocC-5enoA:
47.3		 3aocC-5enoA:
73.16
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.
5hlb PENICILLIN-BINDING
PROTEIN 1B

(Escherichia
coli) 		PF00905
(Transpeptidase)
PF00912
(Transgly)
PF14814
(UB2H) 		5 SER A 716
MET A 154
PHE A 175
ILE A 152
ASP A 443
 None
 1.47A 3aocC-5hlbA:
undetectable		 3aocC-5hlbA:
22.69
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.
5iw7 RIBOSOME BIOGENESIS
PROTEIN
TSR1,RIBOSOME
BIOGENESIS PROTEIN
TSR1

(Saccharomyces
cerevisiae) 		PF04950
(RIBIOP_C)
PF08142
(AARP2CN) 		5 SER A 520
PHE A 730
ILE A 733
LEU A 697
GLU A 516
 None
 1.06A 3aocC-5iw7A:
undetectable		 3aocC-5iw7A:
21.09
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.
5jbo BETA-GLUCOSIDASE

(Trichoderma
harzianum) 		PF00232
(Glyco_hydro_1) 		5 SER A  81
PHE A 160
PHE A 104
ILE A 109
PHE A  67
 None
 1.26A 3aocC-5jboA:
undetectable		 3aocC-5jboA:
16.76
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.
5ko1 MIXED LINEAGE KINASE
DOMAIN-LIKE PROTEIN

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		5 MET A 283
PHE A 232
ILE A 281
LEU A 317
GLU A 327
 6UY  A 501 (-3.8A)
None
None
None
None
 1.26A 3aocC-5ko1A:
undetectable		 3aocC-5ko1A:
15.46
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.
5lc5 NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
1

(Bos taurus) 		PF00146
(NADHdh) 		5 MET H 233
PHE H 259
PHE H 237
ILE H 236
LEU H 100
 None
 1.31A 3aocC-5lc5H:
undetectable		 3aocC-5lc5H:
14.63
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.
5lc5 NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
1

(Bos taurus) 		PF00146
(NADHdh) 		5 SER H 157
MET H 233
PHE H 259
PHE H 237
LEU H 100
 None
 1.20A 3aocC-5lc5H:
undetectable		 3aocC-5lc5H:
14.63
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.
5nv8 EF-P ARGININE 32
RHAMNOSYL-TRANSFERAS
E

(Pseudomonas
putida) 		PF10093
(DUF2331) 		5 SER A 275
ILE A  18
PHE A 252
LEU A 190
GLU A 194
 TRH  A 401 (-2.9A)
None
TRH  A 401 (-3.6A)
None
None
 1.50A 3aocC-5nv8A:
undetectable		 3aocC-5nv8A:
16.28
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.
5u8e ARGININE KINASE

(Polybetes
pythagoricus) 		PF00217
(ATP-gua_Ptrans)
PF02807
(ATP-gua_PtransN) 		5 SER A 122
MET A 342
ILE A 346
LEU A 219
GLU A 162
 None
 1.50A 3aocC-5u8eA:
1.3		 3aocC-5u8eA:
17.24
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.
5u8s CELL DIVISION
CONTROL PROTEIN 45

(Saccharomyces
cerevisiae) 		PF02724
(CDC45) 		5 MET E 362
MET E 366
PHE E 392
PHE E 363
LEU E 328
 None
 1.43A 3aocC-5u8sE:
undetectable		 3aocC-5u8sE:
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.
5ukh UNCHARACTERIZED
PROTEIN

(Streptococcus
intermedius) 		no annotation 5 SER A 340
PHE A 238
ILE A 246
PHE A 322
LEU A 373
 None
 1.45A 3aocC-5ukhA:
undetectable		 3aocC-5ukhA:
17.13
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.
5uqj U6 SNRNA
PHOSPHODIESTERASE

(Saccharomyces
cerevisiae) 		PF09749
(HVSL) 		5 MET A 155
PHE A  81
ILE A 276
PHE A 151
GLU A 181
 None
 1.25A 3aocC-5uqjA:
undetectable		 3aocC-5uqjA:
11.25
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.
5wkh T-CELL RECEPTOR
ALPHA VARIABLE
30,T-CELL RECEPTOR,
SP3.4 ALPHA CHAIN
D30 TCR BETA CHAIN

(Homo sapiens;
Homo sapiens) 		PF07686
(V-set)
PF09291
(DUF1968)
no annotation 		5 SER D 183
PHE D 199
ILE D 166
LEU E 210
GLU E 145
 None
 1.15A 3aocC-5wkhD:
undetectable		 3aocC-5wkhD:
11.38
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.
5wpw 11S GLOBULIN ISOFORM
1

(Cocos nucifera) 		no annotation 5 SER A  97
SER A  82
MET A 328
ILE A 405
LEU A 191
 None
 1.44A 3aocC-5wpwA:
undetectable		 3aocC-5wpwA:
18.01
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		5 MET C3959
ILE C4116
PHE C3961
LEU C3970
GLU C2904
 None
 1.39A 3aocC-5y3rC:
undetectable		 3aocC-5y3rC:
13.94
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.
6eqn TRYPTOPHAN SYNTHASE
BETA CHAIN 2

(Sulfobacillus) 		no annotation 5 SER B 412
MET B 158
ILE B 156
LEU B 416
GLU B 383
 PLP  B 501 (-2.5A)
None
None
None
PLP  B 501 (-3.9A)
 1.19A 3aocC-6eqnB:
undetectable		 3aocC-6eqnB:
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.
6f9n CLEAVAGE AND
POLYADENYLATION
SPECIFICITY FACTOR
SUBUNIT 1

(Homo sapiens) 		no annotation 5 PHE A 164
ILE A 247
PHE A 208
LEU A  96
GLU A 107
 None
 1.34A 3aocC-6f9nA:
undetectable		 3aocC-6f9nA:
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.
1a5l UREASE (ALPHA
SUBUNIT)

(Klebsiella
aerogenes) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		3 THR C 273
SER C 355
LYS C 406
 None
 1.00A 3aocC-1a5lC:
0.0		 3aocC-1a5lC:
19.59
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.
1ded CYCLODEXTRIN
GLUCANOTRANSFERASE

(Bacillus sp.
1011) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C) 		3 THR A 516
SER A   7
LYS A 131
 None
 0.92A 3aocC-1dedA:
0.0		 3aocC-1dedA:
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.
1dx8 RUBREDOXIN

(Guillardia
theta) 		PF00301
(Rubredoxin) 		3 THR A  32
SER A  38
LYS A  50
 None
 1.16A 3aocC-1dx8A:
undetectable		 3aocC-1dx8A:
5.22
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.
1fhf SEED COAT PEROXIDASE

(Glycine max) 		PF00141
(peroxidase) 		3 THR A  10
SER A  96
LYS A  84
 None
 1.21A 3aocC-1fhfA:
undetectable		 3aocC-1fhfA:
16.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ft5 CYTOCHROME C554

(Nitrosomonas
europaea) 		PF13435
(Cytochrome_C554) 		3 THR A  55
SER A  33
LYS A  43
 None
HEM  A 216 ( 2.4A)
HEM  A 214 ( 4.8A)
 1.18A 3aocC-1ft5A:
undetectable		 3aocC-1ft5A:
11.38
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.
1g1t E-SELECTIN

(Homo sapiens) 		PF00008
(EGF)
PF00059
(Lectin_C) 		3 THR A   5
SER A  43
LYS A  96
 None
 1.17A 3aocC-1g1tA:
undetectable		 3aocC-1g1tA:
8.61
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.
1g38 MODIFICATION
METHYLASE TAQI

(Thermus
aquaticus) 		PF07669
(Eco57I)
PF12950
(TaqI_C) 		3 THR A 294
SER A 272
LYS A 276
 None
 1.07A 3aocC-1g38A:
0.0		 3aocC-1g38A:
17.96
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.
1hno D3,D2-ENOYL COA
ISOMERASE ECI1

(Saccharomyces
cerevisiae) 		PF00378
(ECH_1) 		3 THR A  57
SER A 112
LYS A 237
 None
 0.89A 3aocC-1hnoA:
0.0		 3aocC-1hnoA:
13.81
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.
1kcl CYCLODEXTRIN
GLYCOSYLTRANSFERASE

(Bacillus
circulans) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C) 		3 THR A 514
SER A 543
LYS A 526
 None
 1.17A 3aocC-1kclA:
0.0		 3aocC-1kclA:
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.
1kcl CYCLODEXTRIN
GLYCOSYLTRANSFERASE

(Bacillus
circulans) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C) 		3 THR A 516
SER A   7
LYS A 131
 None
 0.96A 3aocC-1kclA:
0.0		 3aocC-1kclA:
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.
1kv9 TYPE II
QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE

(Pseudomonas
putida) 		PF13360
(PQQ_2)
PF13442
(Cytochrome_CBB3) 		3 THR A 145
SER A 153
LYS A 100
 None
PQQ  A 801 ( 4.8A)
None
 1.10A 3aocC-1kv9A:
0.0		 3aocC-1kv9A:
21.22
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.
1lv7 FTSH

(Escherichia
coli) 		PF00004
(AAA) 		3 THR A 277
SER A 220
LYS A 144
 None
 0.87A 3aocC-1lv7A:
undetectable		 3aocC-1lv7A:
15.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1m9i ANNEXIN VI

(Homo sapiens) 		PF00191
(Annexin) 		3 THR A 577
SER A 542
LYS A 540
 None
 1.19A 3aocC-1m9iA:
0.0		 3aocC-1m9iA:
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.
1n4k INOSITOL
1,4,5-TRISPHOSPHATE
RECEPTOR TYPE 1

(Mus musculus) 		PF01365
(RYDR_ITPR)
PF02815
(MIR) 		3 THR A 397
SER A 354
LYS A 417
 None
 0.97A 3aocC-1n4kA:
undetectable		 3aocC-1n4kA:
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.
1ncb IGG2A-KAPPA NC41 FAB
(HEAVY CHAIN)

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 116
SER H 216
LYS H 218
 None
 0.87A 3aocC-1ncbH:
undetectable		 3aocC-1ncbH:
12.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nlr ENDO-1,4-BETA-GLUCAN
ASE

(Streptomyces
lividans) 		PF01670
(Glyco_hydro_12) 		3 THR A 183
SER A 162
LYS A 123
 None
MHO  A 122 ( 3.5A)
MHO  A 122 ( 3.5A)
 0.83A 3aocC-1nlrA:
undetectable		 3aocC-1nlrA:
13.03
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.
1oi7 SUCCINYL-COA
SYNTHETASE ALPHA
CHAIN

(Thermus
thermophilus) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		3 THR A 186
SER A 212
LYS A 261
 None
 0.91A 3aocC-1oi7A:
undetectable		 3aocC-1oi7A:
15.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pzd COATOMER GAMMA
SUBUNIT

(Bos taurus) 		PF08752
(COP-gamma_platf)
PF16381
(Coatomer_g_Cpla) 		3 THR A 759
SER A 633
LYS A 631
 None
 1.16A 3aocC-1pzdA:
2.9		 3aocC-1pzdA:
14.68
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.
1sq5 PANTOTHENATE KINASE

(Escherichia
coli) 		PF00485
(PRK) 		3 THR A1293
SER A1096
LYS A1101
 None
None
ADP  A5001 (-2.8A)
 1.21A 3aocC-1sq5A:
undetectable		 3aocC-1sq5A:
14.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wnb PUTATIVE BETAINE
ALDEHYDE
DEHYDROGENASE

(Escherichia
coli) 		PF00171
(Aldedh) 		3 THR A 228
SER A 174
LYS A 172
 NAI  A1001 (-2.9A)
NAI  A1001 (-4.4A)
NAI  A1001 (-2.8A)
 1.21A 3aocC-1wnbA:
undetectable		 3aocC-1wnbA:
19.91
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.
1wyt GLYCINE
DEHYDROGENASE
SUBUNIT 2
(P-PROTEIN)

(Thermus
thermophilus) 		PF02347
(GDC-P) 		3 THR B 210
SER B  73
LYS B 266
 None
 1.17A 3aocC-1wytB:
2.1		 3aocC-1wytB:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xqs HSPBP1 PROTEIN

(Homo sapiens) 		PF08609
(Fes1) 		3 THR A 347
SER A 298
LYS A 265
 None
 0.70A 3aocC-1xqsA:
undetectable		 3aocC-1xqsA:
14.27
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.
2ava ACYL CARRIER PROTEIN
I, CHLOROPLAST

(Spinacia
oleracea) 		PF00550
(PP-binding) 		3 THR A  66
SER A  10
LYS A  14
 None
 0.87A 3aocC-2avaA:
undetectable		 3aocC-2avaA:
7.20
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.
2da0 130-KDA
PHOSPHATIDYLINOSITOL
4,5-BIPHOSPHATE-DEPE
NDENT ARF1
GTPASE-ACTIVATING
PROTEIN

(Homo sapiens) 		PF00169
(PH) 		3 THR A  45
SER A  20
LYS A  18
 None
 1.18A 3aocC-2da0A:
undetectable		 3aocC-2da0A:
8.39
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.
2dws COPPER-CONTAINING
NITRITE REDUCTASE

(Rhodobacter
sphaeroides) 		PF00394
(Cu-oxidase)
PF07732
(Cu-oxidase_3) 		3 THR A 244
SER A 248
LYS A 346
 None
 0.82A 3aocC-2dwsA:
undetectable		 3aocC-2dwsA:
16.55
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.
2iye COPPER-TRANSPORTING
ATPASE

(Sulfolobus
solfataricus) 		PF00702
(Hydrolase) 		3 THR A 420
SER A 541
LYS A 569
 None
SO4  A1636 ( 3.8A)
SO4  A1636 (-2.9A)
 1.14A 3aocC-2iyeA:
undetectable		 3aocC-2iyeA:
14.92
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.
2qzx CANDIDAPEPSIN-5

(Candida
albicans) 		PF00026
(Asp) 		3 THR A 166
SER A 334
LYS A 178
 None
 1.11A 3aocC-2qzxA:
undetectable		 3aocC-2qzxA:
16.07
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.
2vws YFAU, 2-KETO-3-DEOXY
SUGAR ALDOLASE

(Escherichia
coli) 		PF03328
(HpcH_HpaI) 		3 THR A 112
SER A 145
LYS A  10
 None
 1.16A 3aocC-2vwsA:
undetectable		 3aocC-2vwsA:
14.26
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.
2w40 GLYCEROL KINASE,
PUTATIVE

(Plasmodium
falciparum) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		3 THR A 130
SER A 137
LYS A 140
 EDO  A1506 (-4.1A)
EDO  A1510 ( 4.5A)
None
 1.15A 3aocC-2w40A:
undetectable		 3aocC-2w40A:
19.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wae PENICILLIN-BINDING
PROTEIN 2B

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		3 THR A 392
SER A 386
LYS A 615
 None
 1.14A 3aocC-2waeA:
3.0		 3aocC-2waeA:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yn0 TRANSCRIPTION FACTOR
TAU 55 KDA SUBUNIT

(Saccharomyces
cerevisiae) 		PF00300
(His_Phos_1) 		3 THR A 244
SER A 199
LYS A 173
 None
 1.11A 3aocC-2yn0A:
undetectable		 3aocC-2yn0A:
14.00
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.
2yoc PULLULANASE

(Klebsiella
oxytoca) 		PF02922
(CBM_48)
PF03714
(PUD)
PF11852
(DUF3372) 		3 THR A 374
SER A 558
LYS A 436
 None
 1.08A 3aocC-2yocA:
undetectable		 3aocC-2yocA:
24.41
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.
2yv5 YJEQ PROTEIN

(Aquifex
aeolicus) 		PF03193
(RsgA_GTPase) 		3 THR A  88
SER A 174
LYS A 228
 None
GDP  A1001 ( 4.1A)
None
 1.14A 3aocC-2yv5A:
undetectable		 3aocC-2yv5A:
14.78
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.
2z4q ANTI EGFR ANTIBODY
FAB, HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR B 121
SER B 208
LYS B 210
 None
 1.09A 3aocC-2z4qB:
undetectable		 3aocC-2z4qB:
11.57
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.
3al0 GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT A

(Thermotoga
maritima) 		PF01425
(Amidase) 		3 THR A 227
SER A 218
LYS A  97
 None
 1.02A 3aocC-3al0A:
undetectable		 3aocC-3al0A:
18.31
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.
3any ETHANOLAMINE
AMMONIA-LYASE HEAVY
CHAIN

(Escherichia
coli) 		PF06751
(EutB) 		3 THR A 113
SER A 106
LYS A 140
 None
 1.11A 3aocC-3anyA:
undetectable		 3aocC-3anyA:
18.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bmw CYCLOMALTODEXTRIN
GLUCANOTRANSFERASE

(Thermoanaerobacterium
thermosulfurigenes) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG) 		3 THR A 516
SER A   7
LYS A 132
 None
 1.03A 3aocC-3bmwA:
undetectable		 3aocC-3bmwA:
20.73
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.
3d3a BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF01301
(Glyco_hydro_35) 		3 THR A 235
SER A 276
LYS A 338
 None
 1.10A 3aocC-3d3aA:
undetectable		 3aocC-3d3aA:
20.17
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.
3dan CYTOCHROME P450 74A2

(Parthenium
argentatum) 		PF00067
(p450) 		3 THR A  93
SER A 110
LYS A 424
 None
HEM  A 600 ( 3.9A)
HEM  A 600 (-2.7A)
 1.21A 3aocC-3danA:
undetectable		 3aocC-3danA:
18.60
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.
3f8h PUTATIVE POLYKETIDE
CYCLASE

(Ruegeria sp.
TM1040) 		PF12680
(SnoaL_2) 		3 THR A   4
SER A  25
LYS A  41
 None
 0.96A 3aocC-3f8hA:
undetectable		 3aocC-3f8hA:
9.33
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.
3fhc ATP-DEPENDENT RNA
HELICASE DDX19B

(Homo sapiens) 		PF00270
(DEAD) 		3 THR B 276
SER B 140
LYS B 144
 None
 1.01A 3aocC-3fhcB:
undetectable		 3aocC-3fhcB:
12.48
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.
3fze PROTEIN STE5

(Saccharomyces
cerevisiae) 		PF12194
(Ste5_C) 		3 THR A 619
SER A 709
LYS A 739
 None
 1.04A 3aocC-3fzeA:
undetectable		 3aocC-3fzeA:
10.01
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.
3gmw BETA-LACTAMASE
INHIBITORY PROTEIN
BLIP-I

(Streptomyces
exfoliatus) 		PF07467
(BLIP) 		3 THR B 132
SER B  79
LYS B  81
 None
 0.90A 3aocC-3gmwB:
undetectable		 3aocC-3gmwB:
9.10
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.
3hv1 POLAR AMINO ACID ABC
UPTAKE TRANSPORTER
SUBSTRATE BINDING
PROTEIN

(Streptococcus
thermophilus) 		PF00497
(SBP_bac_3) 		3 THR A 114
SER A 120
LYS A 240
 None
 1.11A 3aocC-3hv1A:
undetectable		 3aocC-3hv1A:
14.34
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.
3hxl UNCHARACTERIZED
PROTEIN DSY3957

(Desulfitobacterium
hafniense) 		PF04984
(Phage_sheath_1)
PF17481
(Phage_sheath_1N)
PF17482
(Phage_sheath_1C) 		3 THR A 262
SER A 207
LYS A 213
 None
 1.21A 3aocC-3hxlA:
undetectable		 3aocC-3hxlA:
18.81
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.
3ju8 SUCCINYLGLUTAMIC
SEMIALDEHYDE
DEHYDROGENASE

(Pseudomonas
aeruginosa) 		PF00171
(Aldedh) 		3 THR A 226
SER A 172
LYS A 170
 NAD  A 501 (-3.3A)
NAD  A 501 (-4.3A)
NAD  A 501 (-2.7A)
 1.05A 3aocC-3ju8A:
1.2		 3aocC-3ju8A:
20.44
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.
3k32 UNCHARACTERIZED
PROTEIN MJ0690

(Methanocaldococcus
jannaschii) 		no annotation 3 THR A 191
SER A 148
LYS A 197
 None
 1.18A 3aocC-3k32A:
undetectable		 3aocC-3k32A:
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.
3n23 SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1

(Sus scrofa) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF13246
(Cation_ATPase) 		3 THR A 219
SER A 477
LYS A 480
 None
 1.10A 3aocC-3n23A:
4.1		 3aocC-3n23A:
23.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ohn OUTER MEMBRANE USHER
PROTEIN FIMD

(Escherichia
coli) 		PF00577
(Usher) 		3 THR A 487
SER A 503
LYS A 483
 None
 1.19A 3aocC-3ohnA:
undetectable		 3aocC-3ohnA:
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.
3rsj BONT/F

(Clostridium
botulinum) 		PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N) 		3 THR A1141
SER A1002
LYS A1007
 None
 1.19A 3aocC-3rsjA:
undetectable		 3aocC-3rsjA:
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.
3u4a JMB19063

(compost
metagenome) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		3 THR A 620
SER A 562
LYS A 564
 None
 1.19A 3aocC-3u4aA:
undetectable		 3aocC-3u4aA:
22.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ugg SUCROSE:(SUCROSE/FRU
CTAN)
6-FRUCTOSYLTRANSFERA
SE

(Pachysandra
terminalis) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		3 THR A 507
SER A 459
LYS A 463
 None
 1.05A 3aocC-3uggA:
undetectable		 3aocC-3uggA:
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.
3zl8 UDP-N-ACETYLMURAMOYL
-TRIPEPTIDE--D-ALANY
L-D-ALANINE LIGASE

(Thermotoga
maritima) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		3 THR A 183
SER A  90
LYS A  93
 None
None
ADP  A1441 (-2.8A)
 1.11A 3aocC-3zl8A:
undetectable		 3aocC-3zl8A:
19.57
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.
4c13 UDP-N-ACETYLMURAMOYL
-L-ALANYL-D-GLUTAMAT
E--L-LYSINE LIGASE

(Staphylococcus
aureus) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		3 THR A  32
SER A 158
LYS A 162
 None
 1.18A 3aocC-4c13A:
undetectable		 3aocC-4c13A:
18.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4efi 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE

(Paraburkholderia
xenovorans) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		3 THR A 358
SER A  68
LYS A 163
 None
 1.16A 3aocC-4efiA:
undetectable		 3aocC-4efiA:
17.03
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.
4eze HALOACID
DEHALOGENASE-LIKE
HYDROLASE

(Salmonella
enterica) 		PF12710
(HAD) 		3 THR A  96
SER A 180
LYS A 225
 None
 1.14A 3aocC-4ezeA:
3.6		 3aocC-4ezeA:
15.17
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.
4fcs VERSATILE PEROXIDASE
VPL2

(Pleurotus
eryngii) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		3 THR A  73
SER A  86
LYS A  89
 None
 1.08A 3aocC-4fcsA:
undetectable		 3aocC-4fcsA:
15.68
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.
4fg0 POLYPROTEIN

(Saint Louis
encephalitis
virus) 		PF00869
(Flavi_glycoprot)
PF02832
(Flavi_glycop_C) 		3 THR A 357
SER A  29
LYS A  44
 None
 1.00A 3aocC-4fg0A:
undetectable		 3aocC-4fg0A:
16.41
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.
4i8q PUTATIVE BETAINE
ALDEHYDE
DEHYROGENASE

(Solanum
lycopersicum) 		PF00171
(Aldedh) 		3 THR A 242
SER A 187
LYS A 185
 NAD  A 601 (-2.8A)
NAD  A 601 (-3.5A)
NAD  A 601 (-2.7A)
 1.16A 3aocC-4i8qA:
undetectable		 3aocC-4i8qA:
18.47
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.
4jrf PUTATIVE CELL
ADHESION PROTEIN

(Bacteroides
ovatus) 		PF15495
(Fimbrillin_C) 		3 THR A 487
SER A 280
LYS A 246
 PG4  A 614 (-3.6A)
None
None
 1.21A 3aocC-4jrfA:
undetectable		 3aocC-4jrfA:
19.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4loa DE-NOVO DESIGN
AMIDASE

(synthetic
construct) 		PF01202
(SKI) 		3 THR A 134
SER A  13
LYS A  17
 None
 0.95A 3aocC-4loaA:
undetectable		 3aocC-4loaA:
9.97
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.
4n7b LYTB

(Plasmodium
falciparum) 		PF02401
(LYTB) 		3 THR A 200
SER A 194
LYS A 103
 None
None
NA  A 405 ( 4.6A)
 0.86A 3aocC-4n7bA:
undetectable		 3aocC-4n7bA:
18.78
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.
4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C)
PF08367
(M16C_assoc) 		3 THR D 872
SER D 882
LYS D 885
 None
None
MLY  D 884 ( 3.1A)
 1.17A 3aocC-4ngeD:
5.2		 3aocC-4ngeD:
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.
4oe5 DELTA-1-PYRROLINE-5-
CARBOXYLATE
DEHYDROGENASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00171
(Aldedh) 		3 THR A 290
SER A 208
LYS A 233
 None
 1.02A 3aocC-4oe5A:
undetectable		 3aocC-4oe5A:
19.65
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.
4p4s INTERFERON-INDUCED
GTP-BINDING PROTEIN
MX1
INTERFERON-INDUCED
GTP-BINDING PROTEIN
MX1

(Homo sapiens;
Homo sapiens) 		PF00350
(Dynamin_N)
PF01031
(Dynamin_M)
PF00350
(Dynamin_N)
PF01031
(Dynamin_M) 		3 THR A 225
SER B  80
LYS B  83
 None
GCP  B 701 (-4.5A)
GCP  B 701 (-2.5A)
 1.20A 3aocC-4p4sA:
undetectable		 3aocC-4p4sA:
13.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p4s INTERFERON-INDUCED
GTP-BINDING PROTEIN
MX1
INTERFERON-INDUCED
GTP-BINDING PROTEIN
MX1

(Homo sapiens;
Homo sapiens) 		PF00350
(Dynamin_N)
PF01031
(Dynamin_M)
PF00350
(Dynamin_N)
PF01031
(Dynamin_M) 		3 THR B 225
SER A  80
LYS A  83
 None
GCP  A 401 (-4.4A)
GCP  A 401 (-2.6A)
 1.16A 3aocC-4p4sB:
3.0		 3aocC-4p4sB:
16.50
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.
4pba UNCHARACTERIZED
PROTEIN ABASI

(Acinetobacter
baumannii) 		no annotation 3 THR B 246
SER B 239
LYS B  55
 None
 1.17A 3aocC-4pbaB:
undetectable		 3aocC-4pbaB:
15.00
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.
4tm3 KTZI

(Kutzneria sp.
744) 		PF13434
(K_oxygenase) 		3 THR A 274
SER A 406
LYS A  67
 None
None
BR  A 504 (-4.0A)
 1.19A 3aocC-4tm3A:
undetectable		 3aocC-4tm3A:
17.31
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.
4txa ROQUIN-1

(Mus musculus) 		PF13445
(zf-RING_UBOX) 		3 THR A 167
SER A 160
LYS A 136
 None
 1.13A 3aocC-4txaA:
undetectable		 3aocC-4txaA:
19.02
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.
4u0p LIPOYL SYNTHASE 2

(Thermosynechococcus
elongatus) 		PF04055
(Radical_SAM) 		3 THR B  55
SER B 282
LYS B 206
 NA  B 304 (-4.0A)
NA  B 304 ( 4.9A)
None
 1.14A 3aocC-4u0pB:
undetectable		 3aocC-4u0pB:
14.80
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.
4xnu INTEGRAL MEMBRANE
PROTEIN-DOPAMINE
TRANSPORTER

(Drosophila
melanogaster) 		PF00209
(SNF) 		3 THR A  29
SER A 259
LYS A 263
 None
 1.20A 3aocC-4xnuA:
undetectable		 3aocC-4xnuA:
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.
4xzk PUTATIVE
NAD(+)--ARGININE
ADP-RIBOSYLTRANSFERA
SE VIS

(Vibrio
splendidus) 		PF03496
(ADPrib_exo_Tox) 		3 THR A  82
SER A 234
LYS A 122
 None
 1.18A 3aocC-4xzkA:
undetectable		 3aocC-4xzkA:
12.28
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.
4z42 UREASE SUBUNIT ALPHA

(Yersinia
enterocolitica) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		3 THR C 278
SER C 360
LYS C 411
 None
 0.74A 3aocC-4z42C:
undetectable		 3aocC-4z42C:
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.
4zb6 PCURE2P4

(Phanerochaete
chrysosporium) 		PF00043
(GST_C)
PF02798
(GST_N) 		3 THR A  98
SER A  93
LYS A 165
 None
 0.96A 3aocC-4zb6A:
undetectable		 3aocC-4zb6A:
11.26
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.
4zb8 PCURE2P6

(Phanerochaete
chrysosporium) 		PF00043
(GST_C)
PF02798
(GST_N) 		3 THR A  97
SER A  92
LYS A 164
 None
 0.94A 3aocC-4zb8A:
undetectable		 3aocC-4zb8A:
10.98
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.
4zk6 QUINOLINATE SYNTHASE
A

(Pyrococcus
horikoshii) 		PF02445
(NadA) 		3 THR A 263
SER A  78
LYS A 275
 None
 1.21A 3aocC-4zk6A:
undetectable		 3aocC-4zk6A:
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.
5amw FRA A 2 ALLERGEN

(Fragaria x
ananassa) 		PF00407
(Bet_v_1) 		3 THR A   8
SER A 142
LYS A 146
 None
 1.21A 3aocC-5amwA:
undetectable		 3aocC-5amwA:
10.75
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.
5bpz ANAPC5 PROTEIN

(Xenopus laevis) 		no annotation 3 THR A 120
SER A  45
LYS A  55
 None
 1.05A 3aocC-5bpzA:
undetectable		 3aocC-5bpzA:
10.00
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.
5csa ACETYL-COA
CARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00364
(Biotin_lipoyl)
PF08326
(ACC_central) 		3 THR A1288
SER A1306
LYS A1328
 None
 0.89A 3aocC-5csaA:
3.0		 3aocC-5csaA:
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.
5csl ACETYL-COA
CARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF01039
(Carboxyl_trans)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
PF08326
(ACC_central) 		3 THR A1288
SER A1306
LYS A1328
 None
 1.02A 3aocC-5cslA:
2.3		 3aocC-5cslA:
19.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5eno MULTIDRUG EFFLUX
PUMP SUBUNIT
ACRB,MULTIDRUG
EFFLUX PUMP SUBUNIT
ACRB

(Escherichia
coli) 		PF00873
(ACR_tran) 		3 THR A  91
SER A 134
LYS A 292
 None
 0.56A 3aocC-5enoA:
47.3		 3aocC-5enoA:
73.16
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.
5ey5 LBCA-B

(synthetic
construct) 		PF00291
(PALP) 		3 THR B 382
SER B 296
LYS B 257
 None
 1.15A 3aocC-5ey5B:
undetectable		 3aocC-5ey5B:
17.88
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.
5fji BETA-GLUCOSIDASE

(Aspergillus
fumigatus) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		3 THR A 656
SER A 594
LYS A 596
 EDO  A1875 ( 4.7A)
None
None
 1.11A 3aocC-5fjiA:
undetectable		 3aocC-5fjiA:
21.83
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.
5gja 1-AMINOCYCLOPROPANE-
1-CARBOXYLATE
OXIDASE 2

(Arabidopsis
thaliana) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		3 THR A 228
SER A 234
LYS A 295
 None
 1.16A 3aocC-5gjaA:
undetectable		 3aocC-5gjaA:
12.85
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.
5gwj DNA TOPOISOMERASE
2-BETA

(Homo sapiens) 		PF00521
(DNA_topoisoIV)
PF01751
(Toprim)
PF16898
(TOPRIM_C) 		3 THR A1012
SER A1015
LYS A1027
 None
 1.12A 3aocC-5gwjA:
2.1		 3aocC-5gwjA:
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.
5hdm GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE
1, CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00202
(Aminotran_3) 		3 THR A 168
SER A 183
LYS A 143
 None
 1.16A 3aocC-5hdmA:
1.3		 3aocC-5hdmA:
19.31
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.
5i6h ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01039
(Carboxyl_trans)
PF08326
(ACC_central) 		3 THR A1087
SER A1306
LYS A1350
 None
 1.04A 3aocC-5i6hA:
undetectable		 3aocC-5i6hA:
21.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5izd D-GLYCERALDEHYDE
DEHYDROGENASE
(NADP(+))

(Thermoplasma
acidophilum) 		PF00171
(Aldedh) 		3 THR A 229
SER A 174
LYS A 172
 NAP  A 601 (-3.3A)
NAP  A 601 (-3.4A)
NAP  A 601 (-3.0A)
 1.10A 3aocC-5izdA:
1.7		 3aocC-5izdA:
19.78
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.
5j84 DIHYDROXY-ACID
DEHYDRATASE

(Rhizobium
leguminosarum) 		PF00920
(ILVD_EDD) 		3 THR A 202
SER A 276
LYS A 397
 None
 1.09A 3aocC-5j84A:
undetectable		 3aocC-5j84A:
20.64
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.
5k6o B-GLUCOSIDASE

(metagenome) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		3 THR A 280
SER A 222
LYS A 224
 None
 1.02A 3aocC-5k6oA:
undetectable		 3aocC-5k6oA:
21.55
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.
5okd CYTOCHROME C1, HEME
PROTEIN,
MITOCHONDRIAL

(Bos taurus) 		no annotation 3 THR D 188
SER D  20
LYS D 202
 None
 0.92A 3aocC-5okdD:
undetectable		 3aocC-5okdD:
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.
5oqr CONDENSIN COMPLEX
SUBUNIT 3

(Schizosaccharomyces
pombe) 		no annotation 3 THR A 803
SER A 767
LYS A 771
 None
 1.06A 3aocC-5oqrA:
3.5		 3aocC-5oqrA:
20.56
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.
5t96 HE PROTEIN

(Salmon isavirus) 		PF06215
(ISAV_HA) 		3 THR A  92
SER A  67
LYS A 171
 None
 1.16A 3aocC-5t96A:
undetectable		 3aocC-5t96A:
16.93
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.
5thx FERREDOXIN--NADP
REDUCTASE

(Neisseria
gonorrhoeae) 		PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		3 THR A  21
SER A  57
LYS A 127
 None
 0.88A 3aocC-5thxA:
undetectable		 3aocC-5thxA:
13.84
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.
5wab PUTATIVE
BETA-GLUCOSIDASE

(Bifidobacterium
adolescentis) 		no annotation 3 THR A  43
SER A  52
LYS A  65
 None
 1.14A 3aocC-5wabA:
undetectable		 3aocC-5wabA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y89 PUTATIVE HEMIN
TRANSPORT SYSTEM,
SUBSTRATE-BINDING
PROTEIN

(Burkholderia
cenocepacia) 		no annotation 3 THR A  72
SER A 107
LYS A 141
 HEM  A 401 (-3.1A)
None
None
 1.06A 3aocC-5y89A:
undetectable		 3aocC-5y89A:
14.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yq7 CYTOCHROME SUBUNIT
OF PHOTOSYNTHETIC
REACTION CENTER

(Roseiflexus
castenholzii) 		no annotation 3 THR C 212
SER C 251
LYS C 257
 HEM  C 503 (-3.0A)
None
None
 1.15A 3aocC-5yq7C:
undetectable		 3aocC-5yq7C:
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.
6bsz METABOTROPIC
GLUTAMATE RECEPTOR 8

(Homo sapiens) 		no annotation 3 THR A 179
SER A 310
LYS A 314
 GGL  A 601 (-3.2A)
None
GGL  A 601 (-3.0A)
 1.17A 3aocC-6bszA:
undetectable		 3aocC-6bszA:
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.
6cei G117

(Conus
geographus) 		no annotation 3 THR A   4
SER A  17
LYS A  32
 None
 1.11A 3aocC-6ceiA:
undetectable		 3aocC-6ceiA:
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.
6fmq -

(-) 		no annotation 3 THR A 588
SER A 592
LYS A 551
 None
 0.93A 3aocC-6fmqA:
undetectable		 3aocC-6fmqA:
undetectable