SIMILAR PATTERNS OF AMINO ACIDS FOR 3AOC_C_ERYC3402_0

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