SIMILAR PATTERNS OF AMINO ACIDS FOR 3ETE_F_H3PF552

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.
1dct PROTEIN
(MODIFICATION
METHYLASE HAEIII)

(Haemophilus
influenzae) 		PF00145
(DNA_methylase) 		4 LYS A 102
ILE A  97
ILE A  95
TYR A 135
 None
 1.13A 3eteD-1dctA:
3.7
3eteF-1dctA:
4.0		 3eteD-1dctA:
22.52
3eteF-1dctA:
22.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ft9 CARBON MONOXIDE
OXIDATION SYSTEM
TRANSCRIPTION
REGULATOR

(Rhodospirillum
rubrum) 		PF13545
(HTH_Crp_2) 		4 ILE A 144
HIS A 146
ILE A 139
TYR A 192
 None
 1.06A 3eteD-1ft9A:
undetectable
3eteF-1ft9A:
undetectable		 3eteD-1ft9A:
18.33
3eteF-1ft9A:
18.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ggp PROTEIN (LECTIN 1 A
CHAIN)

(Trichosanthes
kirilowii) 		PF00161
(RIP) 		4 MET A 161
ILE A 158
ILE A 127
TYR A 113
 None
 1.15A 3eteD-1ggpA:
undetectable
3eteF-1ggpA:
undetectable		 3eteD-1ggpA:
20.58
3eteF-1ggpA:
20.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hkx CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE II ALPHA
CHAIN

(Mus musculus) 		PF08332
(CaMKII_AD) 		4 ILE A 464
HIS A 456
ILE A 350
TYR A 431
 None
 0.82A 3eteD-1hkxA:
undetectable
3eteF-1hkxA:
undetectable		 3eteD-1hkxA:
14.97
3eteF-1hkxA:
14.97
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.
1kkh MEVALONATE KINASE

(Methanocaldococcus
jannaschii) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		4 LYS A 227
HIS A 249
LYS A 253
ILE A 221
 None
 0.80A 3eteD-1kkhA:
undetectable
3eteF-1kkhA:
0.6		 3eteD-1kkhA:
22.85
3eteF-1kkhA:
22.85
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.
1nvt SHIKIMATE
5'-DEHYDROGENASE

(Methanocaldococcus
jannaschii) 		PF01488
(Shikimate_DH)
PF08501
(Shikimate_dh_N) 		4 ILE A  98
LYS A  61
ILE A  65
TYR A  43
 None
 1.06A 3eteD-1nvtA:
9.2
3eteF-1nvtA:
4.7		 3eteD-1nvtA:
21.56
3eteF-1nvtA:
21.56
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.
1u1h 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE

(Arabidopsis
thaliana) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		4 ILE A 120
HIS A 118
LYS A 111
TYR A 161
 None
None
SO4  A 769 ( 4.5A)
None
 1.12A 3eteD-1u1hA:
undetectable
3eteF-1u1hA:
undetectable		 3eteD-1u1hA:
21.43
3eteF-1u1hA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xp3 ENDONUCLEASE IV

(Bacillus
anthracis) 		PF01261
(AP_endonuc_2) 		4 ILE A 233
HIS A 244
ILE A   4
TYR A 275
 None
 1.17A 3eteD-1xp3A:
undetectable
3eteF-1xp3A:
undetectable		 3eteD-1xp3A:
20.76
3eteF-1xp3A:
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.
1y17 ANTICOAGULANT
PROTEIN A

(Deinagkistrodon
acutus) 		PF00059
(Lectin_C) 		4 ILE A  68
HIS A  65
ILE A  55
TYR A  14
 None
 0.97A 3eteD-1y17A:
undetectable
3eteF-1y17A:
undetectable		 3eteD-1y17A:
13.08
3eteF-1y17A:
13.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ygu LEUKOCYTE COMMON
ANTIGEN

(Homo sapiens) 		PF00102
(Y_phosphatase) 		4 ILE A 715
HIS A 788
ILE A 824
TYR A 687
 None
 1.18A 3eteD-1yguA:
undetectable
3eteF-1yguA:
undetectable		 3eteD-1yguA:
23.60
3eteF-1yguA:
23.60
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.
1yq9 PERIPLASMIC [NIFE]
HYDROGENASE SMALL
SUBUNIT

(Desulfovibrio
gigas) 		PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		4 ILE A  72
HIS A  13
ILE A  95
TYR A  93
 None
 1.03A 3eteD-1yq9A:
undetectable
3eteF-1yq9A:
undetectable		 3eteD-1yq9A:
19.68
3eteF-1yq9A:
19.68
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.
2ejc PANTOATE--BETA-ALANI
NE LIGASE

(Thermotoga
maritima) 		PF02569
(Pantoate_ligase) 		4 LYS A  12
ILE A   4
HIS A  92
ILE A   7
 None
None
ZN  A 503 (-3.5A)
ZN  A 501 ( 4.9A)
 1.03A 3eteD-2ejcA:
undetectable
3eteF-2ejcA:
undetectable		 3eteD-2ejcA:
21.80
3eteF-2ejcA:
21.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2f9z PROTEIN (CHEMOTAXIS
METHYLATION PROTEIN)

(Thermotoga
maritima) 		PF03975
(CheD) 		4 ILE C 117
HIS C 111
ILE C  86
TYR C 134
 None
 1.13A 3eteD-2f9zC:
2.7
3eteF-2f9zC:
2.7		 3eteD-2f9zC:
18.71
3eteF-2f9zC:
18.71
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.
2fhx SPM-1

(Pseudomonas
aeruginosa) 		PF00753
(Lactamase_B) 		4 MET B 299
ILE B 223
HIS B 263
ILE B 260
 None
None
CSO  B 221 (-3.5A)
None
 1.10A 3eteD-2fhxB:
undetectable
3eteF-2fhxB:
undetectable		 3eteD-2fhxB:
19.50
3eteF-2fhxB:
19.50
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.
2gf0 GTP-BINDING PROTEIN
DI-RAS1

(Homo sapiens) 		PF00071
(Ras) 		4 ILE A 114
HIS A  80
ILE A  76
TYR A 101
 None
 0.97A 3eteD-2gf0A:
undetectable
3eteF-2gf0A:
undetectable		 3eteD-2gf0A:
16.97
3eteF-2gf0A:
16.97
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.
2iir ACETATE KINASE

(Thermotoga
maritima) 		PF00871
(Acetate_kinase) 		4 MET A  20
ILE A  18
ILE A 390
TYR A 185
 None
 1.04A 3eteD-2iirA:
undetectable
3eteF-2iirA:
2.1		 3eteD-2iirA:
23.20
3eteF-2iirA:
23.20
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.
2jg6 DNA-3-METHYLADENINE
GLYCOSIDASE

(Staphylococcus
aureus) 		PF03352
(Adenine_glyco) 		4 ILE A  85
HIS A  88
LYS A  91
ILE A  95
 None
 1.10A 3eteD-2jg6A:
undetectable
3eteF-2jg6A:
undetectable		 3eteD-2jg6A:
17.10
3eteF-2jg6A:
17.10
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.
2jjy ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE

(Francisella
tularensis) 		PF13561
(adh_short_C2) 		4 ILE A  11
HIS A  89
ILE A  20
TYR A  22
 None
 1.11A 3eteD-2jjyA:
4.4
3eteF-2jjyA:
4.2		 3eteD-2jjyA:
20.97
3eteF-2jjyA:
20.97
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.
2klx GLUTAREDOXIN

(Bartonella
henselae) 		PF00462
(Glutaredoxin) 		4 ILE A  55
HIS A  61
ILE A   5
TYR A  29
 None
 1.12A 3eteD-2klxA:
undetectable
3eteF-2klxA:
undetectable		 3eteD-2klxA:
13.96
3eteF-2klxA:
13.96
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.
2lns ANTERIOR GRADIENT
PROTEIN 2 HOMOLOG

(Homo sapiens) 		PF13899
(Thioredoxin_7) 		4 MET A 164
ILE A 128
HIS A  77
ILE A  74
 None
 1.15A 3eteD-2lnsA:
undetectable
3eteF-2lnsA:
undetectable		 3eteD-2lnsA:
15.73
3eteF-2lnsA:
15.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nq5 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE

(Streptococcus
mutans) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		4 ILE A 640
LYS A 673
ILE A 651
TYR A 633
 None
 1.15A 3eteD-2nq5A:
undetectable
3eteF-2nq5A:
undetectable		 3eteD-2nq5A:
22.43
3eteF-2nq5A:
22.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2otd GLYCEROPHOSPHODIESTE
R PHOSPHODIESTERASE

(Shigella
flexneri) 		PF03009
(GDPD) 		4 LYS A  32
ILE A 237
HIS A  12
ILE A  27
 None
None
PO4  A 301 (-4.0A)
None
 1.03A 3eteD-2otdA:
undetectable
3eteF-2otdA:
undetectable		 3eteD-2otdA:
18.45
3eteF-2otdA:
18.45
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.
2r9l PUTATIVE DNA
LIGASE-LIKE PROTEIN

(Mycobacterium
tuberculosis) 		no annotation 4 MET A  40
ILE A  44
HIS A 111
ILE A 102
 None
None
EDO  A 295 (-3.8A)
None
 1.02A 3eteD-2r9lA:
undetectable
3eteF-2r9lA:
undetectable		 3eteD-2r9lA:
22.18
3eteF-2r9lA:
22.18
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.
2x3l ORN/LYS/ARG
DECARBOXYLASE FAMILY
PROTEIN

(Staphylococcus
aureus) 		PF01276
(OKR_DC_1)
PF03711
(OKR_DC_1_C) 		4 ILE A  99
HIS A 121
ILE A 176
TYR A 204
 None
 1.14A 3eteD-2x3lA:
undetectable
3eteF-2x3lA:
2.3		 3eteD-2x3lA:
23.05
3eteF-2x3lA:
23.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xod NRDI PROTEIN

(Bacillus
anthracis) 		PF07972
(Flavodoxin_NdrI) 		4 ILE A  32
LYS A  64
ILE A  37
TYR A   5
 None
None
None
CAC  A1121 (-4.6A)
 1.06A 3eteD-2xodA:
undetectable
3eteF-2xodA:
undetectable		 3eteD-2xodA:
14.31
3eteF-2xodA:
14.31
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.
2yv1 SUCCINYL-COA LIGASE
[ADP-FORMING]
SUBUNIT ALPHA

(Methanocaldococcus
jannaschii) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		4 MET A 155
ILE A 170
HIS A 168
ILE A 281
 None
 1.07A 3eteD-2yv1A:
7.0
3eteF-2yv1A:
6.5		 3eteD-2yv1A:
21.41
3eteF-2yv1A:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ahi XYLULOSE
5-PHOSPHATE/FRUCTOSE
6-PHOSPHATE
PHOSPHOKETOLASE

(Bifidobacterium
breve) 		PF03894
(XFP)
PF09363
(XFP_C)
PF09364
(XFP_N) 		4 ILE A 180
HIS A 213
ILE A 295
TYR A 242
 None
HTL  A 827 ( 4.3A)
None
None
 1.06A 3eteD-3ahiA:
undetectable
3eteF-3ahiA:
undetectable		 3eteD-3ahiA:
21.10
3eteF-3ahiA:
21.10
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.
3ct7 D-ALLULOSE-6-PHOSPHA
TE 3-EPIMERASE

(Escherichia
coli) 		PF00834
(Ribul_P_3_epim) 		4 MET A 213
ILE A   3
HIS A  30
ILE A  22
 None
None
MG  A 232 (-3.5A)
None
 1.00A 3eteD-3ct7A:
undetectable
3eteF-3ct7A:
undetectable		 3eteD-3ct7A:
17.77
3eteF-3ct7A:
17.77
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.
3d6t LEUCINE-RICH REPEAT
SERINE/THREONINE-PRO
TEIN KINASE 2

(Homo sapiens) 		PF08477
(Roc) 		4 LYS B1468
ILE B1482
LYS B1439
TYR B1419
 None
 1.18A 3eteD-3d6tB:
undetectable
3eteF-3d6tB:
undetectable		 3eteD-3d6tB:
15.94
3eteF-3d6tB:
15.94
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.
3e9d ZGC:56074

(Danio rerio) 		PF00300
(His_Phos_1) 		4 MET A  81
ILE A  63
HIS A  11
ILE A  68
 None
None
PO4  A 266 (-4.0A)
None
 1.13A 3eteD-3e9dA:
undetectable
3eteF-3e9dA:
undetectable		 3eteD-3e9dA:
19.68
3eteF-3e9dA:
19.68
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.
3eb8 CYSTEINE
PROTEASE-LIKE VIRA

(Shigella
flexneri) 		PF06872
(EspG) 		4 ILE A 395
HIS A 135
LYS A 133
ILE A 292
 None
 0.79A 3eteD-3eb8A:
undetectable
3eteF-3eb8A:
undetectable		 3eteD-3eb8A:
21.63
3eteF-3eb8A:
21.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eb8 CYSTEINE
PROTEASE-LIKE VIRA

(Shigella
flexneri) 		PF06872
(EspG) 		4 ILE A 395
HIS A 135
LYS A 133
TYR A 293
 None
 0.91A 3eteD-3eb8A:
undetectable
3eteF-3eb8A:
undetectable		 3eteD-3eb8A:
21.63
3eteF-3eb8A:
21.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3edi TOLLOID-LIKE PROTEIN
1

(Homo sapiens) 		PF01400
(Astacin) 		4 MET A  29
HIS A  92
ILE A  77
TYR A  17
 None
ZN  A 210 (-3.2A)
None
DMS  A 215 (-4.3A)
 1.06A 3eteD-3ediA:
undetectable
3eteF-3ediA:
undetectable		 3eteD-3ediA:
18.84
3eteF-3ediA:
18.84
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.
3ee1 EFFECTOR PROTEIN
VIRA

(Shigella
flexneri) 		PF06872
(EspG) 		4 ILE A 395
HIS A 135
LYS A 133
ILE A 292
 None
 0.85A 3eteD-3ee1A:
undetectable
3eteF-3ee1A:
undetectable		 3eteD-3ee1A:
21.17
3eteF-3ee1A:
21.17
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.
3ee1 EFFECTOR PROTEIN
VIRA

(Shigella
flexneri) 		PF06872
(EspG) 		4 ILE A 395
HIS A 135
LYS A 133
TYR A 293
 None
 0.90A 3eteD-3ee1A:
undetectable
3eteF-3ee1A:
undetectable		 3eteD-3ee1A:
21.17
3eteF-3ee1A:
21.17
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.
3fxb TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Ruegeria
pomeroyi) 		PF03480
(DctP) 		4 MET A 264
ILE A 201
ILE A 194
TYR A 190
 None
 1.10A 3eteD-3fxbA:
undetectable
3eteF-3fxbA:
undetectable		 3eteD-3fxbA:
20.48
3eteF-3fxbA:
20.48
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.
3g7u CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Escherichia
coli) 		PF00145
(DNA_methylase) 		4 ILE A 121
LYS A 125
ILE A 129
TYR A 102
 None
None
None
GOL  A 402 ( 4.3A)
 1.06A 3eteD-3g7uA:
3.4
3eteF-3g7uA:
3.4		 3eteD-3g7uA:
20.94
3eteF-3g7uA:
20.94
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.
3gs6 BETA-HEXOSAMINIDASE

(Vibrio cholerae) 		PF00933
(Glyco_hydro_3) 		4 MET A 155
ILE A 106
HIS A 108
ILE A  59
 None
 1.16A 3eteD-3gs6A:
undetectable
3eteF-3gs6A:
undetectable		 3eteD-3gs6A:
20.70
3eteF-3gs6A:
20.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hh8 METAL ABC
TRANSPORTER
SUBSTRATE-BINDING
LIPOPROTEIN

(Streptococcus
pyogenes) 		PF01297
(ZnuA) 		4 ILE A 149
LYS A 156
ILE A 154
TYR A 292
 None
 0.87A 3eteD-3hh8A:
undetectable
3eteF-3hh8A:
undetectable		 3eteD-3hh8A:
20.85
3eteF-3hh8A:
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.
3hko CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE WITH A KINASE
DOMAIN AND 2
CALMODULIN-LIKE EF
HANDS

(Cryptosporidium
parvum) 		PF00069
(Pkinase) 		4 ILE A  35
HIS A  11
ILE A  38
TYR A  76
 None
 1.12A 3eteD-3hkoA:
undetectable
3eteF-3hkoA:
undetectable		 3eteD-3hkoA:
21.83
3eteF-3hkoA:
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.
3ibx PUTATIVE THIAMINASE
II

(Helicobacter
pylori) 		PF03070
(TENA_THI-4) 		4 ILE A  19
HIS A  21
ILE A  14
TYR A   8
 None
 0.87A 3eteD-3ibxA:
undetectable
3eteF-3ibxA:
undetectable		 3eteD-3ibxA:
18.04
3eteF-3ibxA:
18.04
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.
3jrp FUSION PROTEIN OF
PROTEIN TRANSPORT
PROTEIN SEC13 AND
NUCLEOPORIN NUP145

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		4 ILE A 141
HIS A 144
LYS A 183
TYR A 187
 None
 1.12A 3eteD-3jrpA:
undetectable
3eteF-3jrpA:
undetectable		 3eteD-3jrpA:
22.97
3eteF-3jrpA:
22.97
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.
3kb6 D-LACTATE
DEHYDROGENASE

(Aquifex
aeolicus) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		4 ILE A  46
HIS A  69
ILE A  78
TYR A  82
 None
 1.09A 3eteD-3kb6A:
6.5
3eteF-3kb6A:
10.9		 3eteD-3kb6A:
20.56
3eteF-3kb6A:
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.
3kbq PROTEIN TA0487

(Thermoplasma
acidophilum) 		PF00994
(MoCF_biosynth) 		4 MET A 161
ILE A 145
ILE A  25
TYR A  34
 None
 1.16A 3eteD-3kbqA:
3.1
3eteF-3kbqA:
3.5		 3eteD-3kbqA:
17.37
3eteF-3kbqA:
17.37
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.
3kds CELL DIVISION
PROTEIN FTSH

(Thermotoga
maritima) 		PF00004
(AAA)
PF01434
(Peptidase_M41) 		4 LYS E 589
ILE E 445
HIS E 423
ILE E 582
 None
None
ZN  E 996 ( 3.3A)
None
 1.13A 3eteD-3kdsE:
undetectable
3eteF-3kdsE:
undetectable		 3eteD-3kdsE:
23.43
3eteF-3kdsE:
23.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m07 PUTATIVE ALPHA
AMYLASE

(Salmonella
enterica) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		4 MET A 118
ILE A 147
HIS A 189
TYR A 138
 None
 1.14A 3eteD-3m07A:
undetectable
3eteF-3m07A:
undetectable		 3eteD-3m07A:
22.51
3eteF-3m07A:
22.51
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.
3orw PHOSPHOTRIESTERASE

(Geobacillus
kaustophilus) 		PF02126
(PTE) 		4 ILE A 176
HIS A 178
ILE A 204
TYR A 225
 None
CO  A 328 (-3.3A)
None
None
 1.11A 3eteD-3orwA:
undetectable
3eteF-3orwA:
undetectable		 3eteD-3orwA:
22.87
3eteF-3orwA:
22.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qfw RIBULOSE-1,5-BISPHOS
PHATE
CARBOXYLASE/OXYGENAS
E LARGE SUBUNIT

(Rhodopseudomonas
palustris) 		PF00016
(RuBisCO_large) 		4 LYS A 139
ILE A 151
HIS A 153
ILE A 163
 None
 1.08A 3eteD-3qfwA:
undetectable
3eteF-3qfwA:
undetectable		 3eteD-3qfwA:
21.83
3eteF-3qfwA:
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.
3syj ADHESION AND
PENETRATION PROTEIN
AUTOTRANSPORTER

(Haemophilus
influenzae) 		PF02395
(Peptidase_S6)
PF03212
(Pertactin) 		4 LYS A 725
HIS A 645
LYS A 718
ILE A 720
 None
 1.16A 3eteD-3syjA:
undetectable
3eteF-3syjA:
undetectable		 3eteD-3syjA:
20.65
3eteF-3syjA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tdg PUTATIVE
UNCHARACTERIZED
PROTEIN

(Helicobacter
pylori) 		no annotation 4 MET A 201
ILE A 137
ILE A 215
TYR A 222
 None
FMT  A 360 (-4.6A)
None
None
 1.15A 3eteD-3tdgA:
undetectable
3eteF-3tdgA:
undetectable		 3eteD-3tdgA:
20.44
3eteF-3tdgA:
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.
3tqq METHIONYL-TRNA
FORMYLTRANSFERASE

(Coxiella
burnetii) 		PF00551
(Formyl_trans_N)
PF02911
(Formyl_trans_C) 		4 MET A 244
ILE A 246
HIS A 283
ILE A 273
 None
 1.07A 3eteD-3tqqA:
3.1
3eteF-3tqqA:
3.1		 3eteD-3tqqA:
21.27
3eteF-3tqqA:
21.27
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.
3wrf NON-REDUCING END
BETA-L-ARABINOFURANO
SIDASE

(Bifidobacterium
longum) 		PF07944
(Glyco_hydro_127) 		4 ILE A 138
HIS A 142
ILE A 197
TYR A 219
 None
 0.94A 3eteD-3wrfA:
undetectable
3eteF-3wrfA:
undetectable		 3eteD-3wrfA:
22.92
3eteF-3wrfA:
22.92
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.
4a2w RETINOIC ACID
INDUCIBLE PROTEIN I

(Anas
platyrhynchos) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF16739
(CARD_2) 		4 ILE A 373
HIS A 284
ILE A 407
TYR A 386
 None
 1.12A 3eteD-4a2wA:
undetectable
3eteF-4a2wA:
undetectable		 3eteD-4a2wA:
19.67
3eteF-4a2wA:
19.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bzj PROTEIN TRANSPORT
PROTEIN SEC13

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		4 ILE B 141
HIS B 144
LYS B 183
TYR B 187
 None
 1.11A 3eteD-4bzjB:
undetectable
3eteF-4bzjB:
undetectable		 3eteD-4bzjB:
20.00
3eteF-4bzjB:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cq1 POLYPYRIMIDINE
TRACT-BINDING
PROTEIN 2

(Homo sapiens) 		PF00076
(RRM_1)
PF13893
(RRM_5) 		4 MET A 400
ILE A 405
ILE A 380
TYR A 362
 None
 1.13A 3eteD-4cq1A:
undetectable
3eteF-4cq1A:
undetectable		 3eteD-4cq1A:
18.65
3eteF-4cq1A:
18.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cx9 CYTOCHROME C, CLASS
II

(Shewanella
frigidimarina) 		PF01322
(Cytochrom_C_2) 		4 ILE A  60
LYS A  65
ILE A   9
TYR A  11
 SO4  A1132 ( 3.9A)
None
HEC  A1129 ( 4.7A)
None
 1.16A 3eteD-4cx9A:
undetectable
3eteF-4cx9A:
undetectable		 3eteD-4cx9A:
14.46
3eteF-4cx9A:
14.46
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.
4d61 EUKARYOTIC PEPTIDE
CHAIN RELEASE FACTOR
GTP-BINDING SUBUNIT
ERF3A

(Homo sapiens) 		PF01201
(Ribosomal_S8e) 		4 MET i 334
ILE i 529
HIS i 531
ILE i 526
 None
 1.16A 3eteD-4d61i:
undetectable
3eteF-4d61i:
undetectable		 3eteD-4d61i:
23.86
3eteF-4d61i:
23.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4db1 MYOSIN-7

(Homo sapiens) 		PF00063
(Myosin_head)
PF02736
(Myosin_N) 		4 ILE A 356
HIS A 358
ILE A 313
TYR A 283
 None
 0.97A 3eteD-4db1A:
undetectable
3eteF-4db1A:
undetectable		 3eteD-4db1A:
20.72
3eteF-4db1A:
20.72
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.
4gl2 INTERFERON-INDUCED
HELICASE C
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00271
(Helicase_C)
PF04851
(ResIII)
PF11648
(RIG-I_C-RD) 		4 ILE A 441
HIS A 346
ILE A 484
TYR A 454
 None
 1.07A 3eteD-4gl2A:
undetectable
3eteF-4gl2A:
undetectable		 3eteD-4gl2A:
22.27
3eteF-4gl2A:
22.27
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.
4gq2 NUCLEOPORIN NUP120

(Schizosaccharomyces
pombe) 		PF11715
(Nup160) 		4 ILE M 636
LYS M 713
ILE M 702
TYR M 619
 None
 1.14A 3eteD-4gq2M:
undetectable
3eteF-4gq2M:
undetectable		 3eteD-4gq2M:
19.96
3eteF-4gq2M:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gx8 DNA POLYMERASE III
SUBUNIT EPSILON,DNA
POLYMERASE III
SUBUNIT ALPHA

(Escherichia
coli) 		PF02811
(PHP) 		4 ILE A 110
HIS A  53
ILE A 107
TYR A  99
 None
 0.94A 3eteD-4gx8A:
undetectable
3eteF-4gx8A:
undetectable		 3eteD-4gx8A:
20.72
3eteF-4gx8A:
20.72
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.
4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN

(Paraburkholderia
xenovorans;
Rhodopseudomonas
palustris) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 MET A 270
HIS A 201
ILE A 274
TYR A 313
 None
MLY  A  62 ( 3.6A)
None
None
 1.14A 3eteD-4gxrA:
5.0
3eteF-4gxrA:
4.4		 3eteD-4gxrA:
22.98
3eteF-4gxrA:
22.98
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.
4i6v AMIDOHYDROLASE 2

(Planctopirus
limnophila) 		PF02614
(UxaC) 		4 LYS A 367
ILE A 369
HIS A  25
ILE A 316
 None
None
ZN  A 501 (-3.4A)
None
 0.91A 3eteD-4i6vA:
undetectable
3eteF-4i6vA:
undetectable		 3eteD-4i6vA:
22.81
3eteF-4i6vA:
22.81
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.
4ici PUTATIVE
FLAVOPROTEIN

(Bacteroides
eggerthii) 		PF12682
(Flavodoxin_4) 		4 ILE A 129
LYS A 100
ILE A  64
TYR A 114
 None
 1.17A 3eteD-4iciA:
2.1
3eteF-4iciA:
2.1		 3eteD-4iciA:
17.68
3eteF-4iciA:
17.68
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.
4iuw NEUTRAL
ENDOPEPTIDASE

(Lactobacillus
rhamnosus) 		PF01431
(Peptidase_M13)
PF05649
(Peptidase_M13_N) 		4 MET A 375
ILE A 446
HIS A 477
ILE A 346
 None
None
ZN  A 701 ( 3.2A)
None
 0.93A 3eteD-4iuwA:
undetectable
3eteF-4iuwA:
undetectable		 3eteD-4iuwA:
21.68
3eteF-4iuwA:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kho UNCHARACTERIZED
PROTEIN SPT16M

(Chaetomium
thermophilum) 		PF08512
(Rtt106)
PF08644
(SPT16) 		4 ILE A 714
HIS A 733
LYS A 746
ILE A 738
 None
 1.05A 3eteD-4khoA:
undetectable
3eteF-4khoA:
undetectable		 3eteD-4khoA:
22.98
3eteF-4khoA:
22.98
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.
4ktp GLYCOSIDE HYDROLASE
FAMILY 65 CENTRAL
CATALYTIC

([Bacillus]
selenitireducens) 		PF03632
(Glyco_hydro_65m)
PF03633
(Glyco_hydro_65C)
PF03636
(Glyco_hydro_65N) 		4 LYS A 560
ILE A 556
ILE A 586
TYR A 573
 None
 1.13A 3eteD-4ktpA:
undetectable
3eteF-4ktpA:
undetectable		 3eteD-4ktpA:
21.72
3eteF-4ktpA:
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.
4l87 SERINE--TRNA LIGASE,
CYTOPLASMIC

(Homo sapiens) 		PF00587
(tRNA-synt_2b)
PF02403
(Seryl_tRNA_N) 		4 MET A 229
ILE A 269
ILE A 276
TYR A 224
 None
 1.05A 3eteD-4l87A:
undetectable
3eteF-4l87A:
undetectable		 3eteD-4l87A:
21.35
3eteF-4l87A:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mb7 ENDONUCLEASE 8-LIKE
L720

(Acanthamoeba
polyphaga
mimivirus) 		PF06831
(H2TH) 		4 MET A  70
ILE A   7
LYS A  13
TYR A  53
 None
None
SO4  A 302 (-2.9A)
None
 0.90A 3eteD-4mb7A:
undetectable
3eteF-4mb7A:
undetectable		 3eteD-4mb7A:
21.28
3eteF-4mb7A:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4olo BMC DOMAIN PROTEIN

(Clostridiales
bacterium
1_7_47FAA) 		PF00936
(BMC) 		4 ILE A  76
LYS A  33
ILE A   5
TYR A   3
 None
 0.98A 3eteD-4oloA:
undetectable
3eteF-4oloA:
undetectable		 3eteD-4oloA:
12.58
3eteF-4oloA:
12.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p7h MYOSIN-7,GREEN
FLUORESCENT PROTEIN

(Aequorea
victoria;
Homo sapiens) 		PF00063
(Myosin_head)
PF01353
(GFP)
PF02736
(Myosin_N) 		4 ILE A 356
HIS A 358
ILE A 313
TYR A 283
 None
 0.98A 3eteD-4p7hA:
undetectable
3eteF-4p7hA:
undetectable		 3eteD-4p7hA:
19.14
3eteF-4p7hA:
19.14
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.
4qlx NITROREDUCTASE
FAMILY PROTEIN

(Lactobacillus
plantarum) 		PF00881
(Nitroreductase) 		4 MET A 175
ILE A 170
ILE A  88
TYR A  79
 None
 1.07A 3eteD-4qlxA:
undetectable
3eteF-4qlxA:
undetectable		 3eteD-4qlxA:
18.84
3eteF-4qlxA:
18.84
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.
4qts CRISPR TYPE
III-ASSOCIATED RAMP
PROTEIN CSM3

(Methanocaldococcus
jannaschii) 		PF03787
(RAMPs) 		4 ILE C  41
HIS C  23
ILE C  48
TYR C 112
 None
 1.15A 3eteD-4qtsC:
undetectable
3eteF-4qtsC:
undetectable		 3eteD-4qtsC:
19.84
3eteF-4qtsC:
19.84
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.
4ttp DEPHOSPHO-COA KINASE

(Legionella
pneumophila) 		PF01121
(CoaE) 		4 MET A   7
ILE A 107
LYS A 100
ILE A 102
 None
 1.13A 3eteD-4ttpA:
undetectable
3eteF-4ttpA:
undetectable		 3eteD-4ttpA:
16.56
3eteF-4ttpA:
16.56
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.
4zcf RESTRICTION
ENDONUCLEASE
ECOP15I,
MODIFICATION SUBUNIT

(Escherichia
coli) 		PF01555
(N6_N4_Mtase) 		4 MET A 356
ILE A 333
HIS A 335
ILE A 374
 None
 1.14A 3eteD-4zcfA:
undetectable
3eteF-4zcfA:
undetectable		 3eteD-4zcfA:
21.50
3eteF-4zcfA:
21.50
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.
5a5u EUKARYOTIC
TRANSLATION
INITIATION FACTOR 3
SUBUNIT I

(Oryctolagus
cuniculus) 		PF00400
(WD40) 		4 LYS I 280
ILE I 286
ILE I 253
TYR I 234
 None
 1.13A 3eteD-5a5uI:
undetectable
3eteF-5a5uI:
undetectable		 3eteD-5a5uI:
22.20
3eteF-5a5uI:
22.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo sapiens) 		PF00117
(GATase)
PF00988
(CPSase_sm_chain)
PF02142
(MGS)
PF02786
(CPSase_L_D2)
PF02787
(CPSase_L_D3) 		4 HIS A  63
LYS A 157
ILE A 126
TYR A  80
 None
 1.01A 3eteD-5dotA:
undetectable
3eteF-5dotA:
undetectable		 3eteD-5dotA:
16.67
3eteF-5dotA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e31 PENICILLIN BINDING
PROTEIN 2 PRIME

(Enterococcus
faecium) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
PF05223
(MecA_N) 		4 MET A 516
ILE A 548
ILE A 545
TYR A 418
 None
 1.05A 3eteD-5e31A:
undetectable
3eteF-5e31A:
undetectable		 3eteD-5e31A:
21.95
3eteF-5e31A:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h42 UNCHARACTERIZED
PROTEIN

(Lachnoclostridium
phytofermentans) 		PF17167
(Glyco_hydro_36) 		4 ILE A 654
HIS A 659
ILE A 652
TYR A 698
 None
 1.03A 3eteD-5h42A:
undetectable
3eteF-5h42A:
undetectable		 3eteD-5h42A:
19.43
3eteF-5h42A:
19.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ig3 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE II
SUBUNIT ALPHA

(Homo sapiens) 		PF08332
(CaMKII_AD) 		4 ILE A 464
HIS A 456
ILE A 350
TYR A 431
 None
 0.81A 3eteD-5ig3A:
undetectable
3eteF-5ig3A:
undetectable		 3eteD-5ig3A:
15.95
3eteF-5ig3A:
15.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j1b CELL WALL ASSEMBLY
REGULATOR SMI1

(Saccharomyces
cerevisiae) 		PF09346
(SMI1_KNR4) 		4 ILE A 238
HIS A 248
ILE A 264
TYR A 261
 None
 1.16A 3eteD-5j1bA:
undetectable
3eteF-5j1bA:
undetectable		 3eteD-5j1bA:
20.65
3eteF-5j1bA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jcf MELANOMA
DIFFERENTIATION
ASSOCIATED PROTEIN-5

(Gallus gallus) 		PF00271
(Helicase_C)
PF04851
(ResIII)
PF11648
(RIG-I_C-RD) 		4 ILE A 433
HIS A 339
ILE A 476
TYR A 446
 None
 1.09A 3eteD-5jcfA:
undetectable
3eteF-5jcfA:
undetectable		 3eteD-5jcfA:
21.36
3eteF-5jcfA:
21.36
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.
5law E3 UBIQUITIN-PROTEIN
LIGASE MDM2

(Homo sapiens) 		PF02201
(SWIB) 		4 ILE A  19
LYS A  94
ILE A  99
TYR A 104
 None
6SJ  A 201 ( 2.7A)
6SJ  A 201 (-3.5A)
None
 0.83A 3eteD-5lawA:
undetectable
3eteF-5lawA:
undetectable		 3eteD-5lawA:
13.16
3eteF-5lawA:
13.16
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.
5mg5 2,4-DIACETYLPHLOROGL
UCINOL BIOSYNTHESIS
PROTEIN PHLC

(Pseudomonas
protegens) 		no annotation 4 ILE C  76
HIS C  44
ILE C 109
TYR C 107
 None
 1.13A 3eteD-5mg5C:
undetectable
3eteF-5mg5C:
undetectable		 3eteD-5mg5C:
10.85
3eteF-5mg5C:
10.85
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.
5n05 AUXILIARY ACTIVITY 9

(Lentinus
similis) 		PF03443
(Glyco_hydro_61) 		4 ILE A 144
HIS A  78
ILE A  82
TYR A  85
 None
CU  A 301 ( 3.2A)
None
None
 1.12A 3eteD-5n05A:
undetectable
3eteF-5n05A:
undetectable		 3eteD-5n05A:
18.04
3eteF-5n05A:
18.04
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.
5nth PUTATIVE
AMINOPEPTIDASE

(Leishmania
major) 		PF00883
(Peptidase_M17) 		4 ILE A 251
HIS A 276
ILE A 264
TYR A 401
 None
 1.17A 3eteD-5nthA:
2.4
3eteF-5nthA:
1.6		 3eteD-5nthA:
23.57
3eteF-5nthA:
23.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tr1 CHLORIDE CHANNEL
PROTEIN

(Bos taurus) 		PF00654
(Voltage_CLC) 		4 ILE A 123
HIS A 171
ILE A 129
TYR A 531
 None
 1.06A 3eteD-5tr1A:
undetectable
3eteF-5tr1A:
undetectable		 3eteD-5tr1A:
21.47
3eteF-5tr1A:
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.
5uyg PERIPLASMIC CHELATED
IRON-BINDING PROTEIN
YFEA

(Yersinia pestis) 		PF01297
(ZnuA) 		4 ILE A 151
LYS A 158
ILE A 156
TYR A 294
 None
 1.08A 3eteD-5uygA:
undetectable
3eteF-5uygA:
undetectable		 3eteD-5uygA:
20.78
3eteF-5uygA:
20.78
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.
5vfk UNCHARACTERIZED
PROTEIN

(Sulfolobus
solfataricus) 		no annotation 4 ILE A  24
LYS A  31
ILE A  44
TYR A 115
 None
 1.14A 3eteD-5vfkA:
undetectable
3eteF-5vfkA:
undetectable		 3eteD-5vfkA:
8.79
3eteF-5vfkA:
8.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vwn TRIOSEPHOSPHATE
ISOMERASE

(Trichomonas
vaginalis) 		no annotation 4 ILE A 186
LYS A 181
ILE A 201
TYR A 118
 None
 1.18A 3eteD-5vwnA:
undetectable
3eteF-5vwnA:
undetectable		 3eteD-5vwnA:
10.61
3eteF-5vwnA:
10.61
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.
5za2 BETA-LACTAMASE

(Escherichia
coli) 		no annotation 4 MET A 337
ILE A 335
HIS A 353
ILE A  15
 None
 0.97A 3eteD-5za2A:
undetectable
3eteF-5za2A:
undetectable		 3eteD-5za2A:
11.33
3eteF-5za2A:
11.33
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.
5zcs TARGET OF RAPAMYCIN
COMPLEX SUBUNIT LST8

(Homo sapiens) 		no annotation 4 MET C 185
ILE C 144
HIS C 153
ILE C 173
 None
 1.03A 3eteD-5zcsC:
undetectable
3eteF-5zcsC:
undetectable		 3eteD-5zcsC:
12.09
3eteF-5zcsC:
12.09
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.
5ze4 DIHYDROXY-ACID
DEHYDRATASE,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		no annotation 4 MET A 159
ILE A 147
HIS A 293
ILE A 117
 None
 0.96A 3eteD-5ze4A:
2.7
3eteF-5ze4A:
3.4		 3eteD-5ze4A:
undetectable
3eteF-5ze4A:
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.
6blj SERINE-TRNA LIGASE

(Naegleria
fowleri) 		no annotation 4 MET A 242
ILE A 273
ILE A 280
TYR A 237
 None
 1.11A 3eteD-6bljA:
undetectable
3eteF-6bljA:
undetectable		 3eteD-6bljA:
10.23
3eteF-6bljA:
10.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c0f RIBOSOME PRODUCTION
FACTOR 1

(Saccharomyces
cerevisiae) 		no annotation 4 LYS I 133
ILE I 274
HIS I 164
ILE I 140
 None
 1.12A 3eteD-6c0fI:
undetectable
3eteF-6c0fI:
undetectable		 3eteD-6c0fI:
8.54
3eteF-6c0fI:
8.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cgm RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE

(Bacillus
subtilis) 		no annotation 4 MET A 420
LYS A 423
ILE A 425
ILE A 552
 None
 0.94A 3eteD-6cgmA:
undetectable
3eteF-6cgmA:
undetectable		 3eteD-6cgmA:
10.06
3eteF-6cgmA:
10.06
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.
6cu5 PROTEIN ARGININE
N-METHYLTRANSFERASE

(Naegleria
fowleri) 		no annotation 4 ILE A  56
HIS A  18
ILE A  84
TYR A  90
 None
SAH  A 401 (-4.1A)
None
None
 0.95A 3eteD-6cu5A:
3.8
3eteF-6cu5A:
undetectable		 3eteD-6cu5A:
8.84
3eteF-6cu5A:
8.84
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.
6cu5 PROTEIN ARGININE
N-METHYLTRANSFERASE

(Naegleria
fowleri) 		no annotation 4 LYS A  63
ILE A  35
ILE A  56
TYR A  90
 None
 1.14A 3eteD-6cu5A:
3.8
3eteF-6cu5A:
undetectable		 3eteD-6cu5A:
8.84
3eteF-6cu5A:
8.84
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.
6fsa -

(-) 		no annotation 4 ILE A 356
HIS A 358
ILE A 313
TYR A 283
 None
 1.09A 3eteD-6fsaA:
undetectable
3eteF-6fsaA:
undetectable		 3eteD-6fsaA:
undetectable
3eteF-6fsaA:
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.
6gne -

(-) 		no annotation 4 ILE A  30
HIS A  29
ILE A 185
TYR A 175
 None
 1.14A 3eteD-6gneA:
2.8
3eteF-6gneA:
2.8		 3eteD-6gneA:
undetectable
3eteF-6gneA:
undetectable