SIMILAR PATTERNS OF AMINO ACIDS FOR 5E72_A_SAMA400_1

List of similar pattern of amino acids derived from ASSAM search

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

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1d6n PROTEIN
(HYPOXANTHINE-GUANIN
E
PHOSPHORIBOSYLTRANSF
ERASE)

(Homo sapiens) 		PF00156
(Pribosyltran) 		4 ASP A 193
GLY A  70
ASP A 134
ASP A 137
 None
PRP  A 312 (-3.1A)
PRP  A 312 ( 2.9A)
PPO  A 300 ( 3.9A)
 1.13A 5e72A-1d6nA:
undetectable		 5e72A-1d6nA:
23.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ggm GLYCINE--TRNA LIGASE

(Thermus
thermophilus) 		PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon) 		4 ASP A 315
GLY A 317
ASP A 313
ASP A 249
 None
 1.11A 5e72A-1ggmA:
undetectable		 5e72A-1ggmA:
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.
1hgx HYPOXANTHINE-GUANINE
-XANTHINE
PHOSPHORIBOSYLTRANSF
ERASE

(Tritrichomonas
suis) 		PF00156
(Pribosyltran) 		4 ASP A 163
GLY A  48
ASP A 103
ASP A 106
 None
None
5GP  A 600 (-2.8A)
5GP  A 600 (-4.2A)
 1.14A 5e72A-1hgxA:
2.2		 5e72A-1hgxA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kr5 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Homo sapiens) 		PF01135
(PCMT) 		4 ASP A  83
GLY A  87
ASP A 109
ASP A 141
 SAH  A 300 ( 4.8A)
SAH  A 300 (-3.6A)
SAH  A 300 (-2.9A)
SAH  A 300 (-3.7A)
 0.47A 5e72A-1kr5A:
10.9		 5e72A-1kr5A:
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.
1kyw CAFFEIC ACID
3-O-METHYLTRANSFERAS
E

(Medicago sativa) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		4 ASP A 206
GLY A 210
ASP A 231
ASP A 251
 None
 0.76A 5e72A-1kywA:
11.0		 5e72A-1kywA:
24.56
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.
1l3i PRECORRIN-6Y
METHYLTRANSFERASE/PU
TATIVE DECARBOXYLASE

(Methanothermobacter
thermautotrophicus) 		PF13847
(Methyltransf_31) 		4 ASP A  39
GLY A  43
ASP A  62
ASP A  90
 None
SAH  A 801 (-3.2A)
SAH  A 801 (-2.6A)
SAH  A 801 (-3.8A)
 0.57A 5e72A-1l3iA:
19.4		 5e72A-1l3iA:
21.69
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.
1mpx ALPHA-AMINO ACID
ESTER HYDROLASE

(Xanthomonas
citri) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		4 ASP A 514
GLY A 547
ASP A 512
ASP A 614
 None
 1.17A 5e72A-1mpxA:
undetectable		 5e72A-1mpxA:
20.51
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.
1ne2 HYPOTHETICAL PROTEIN
TA1320

(Thermoplasma
acidophilum) 		PF06325
(PrmA) 		4 ASP A  54
GLY A  58
ASP A  78
ASP A 100
 None
 0.63A 5e72A-1ne2A:
17.2		 5e72A-1ne2A:
21.08
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.
1nkv HYPOTHETICAL PROTEIN
YJHP

(Escherichia
coli) 		PF13847
(Methyltransf_31) 		4 ASP A  42
GLY A  46
ASP A  66
ASP A  94
 None
 0.55A 5e72A-1nkvA:
16.2		 5e72A-1nkvA:
22.35
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.
1nw5 MODIFICATION
METHYLASE RSRI

(Rhodobacter
sphaeroides) 		PF01555
(N6_N4_Mtase) 		4 ASP A 248
GLY A 252
ASP A 271
ASP A  46
 None
SAM  A 401 (-3.3A)
SAM  A 401 (-2.9A)
SAM  A 401 (-3.6A)
 0.33A 5e72A-1nw5A:
2.1		 5e72A-1nw5A:
21.60
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.
1o9g RRNA
METHYLTRANSFERASE

(Streptomyces
viridochromogenes) 		PF11599
(AviRa) 		4 ASP A  57
GLY A  61
ASP A  84
ASP A 153
 None
 0.73A 5e72A-1o9gA:
15.9		 5e72A-1o9gA:
25.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pgp 6-PHOSPHOGLUCONATE
DEHYDROGENASE

(Ovis aries) 		PF00393
(6PGD)
PF03446
(NAD_binding_2) 		4 ASP A  99
GLY A  77
ASP A  81
ASP A 114
 None
 1.16A 5e72A-1pgpA:
2.8		 5e72A-1pgpA:
22.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pzm HYPOXANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE

(Leishmania
tarentolae) 		PF00156
(Pribosyltran) 		4 ASP A 185
GLY A  67
ASP A 126
ASP A 129
 5GP  A 301 (-4.6A)
None
5GP  A 301 (-3.5A)
5GP  A 301 (-4.7A)
 1.17A 5e72A-1pzmA:
undetectable		 5e72A-1pzmA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ri3 MRNA CAPPING ENZYME

(Encephalitozoon
cuniculi) 		PF03291
(Pox_MCEL) 		4 ASP A  70
GLY A  74
ASP A  94
ASP A 122
 SAH  A 299 ( 4.9A)
SAH  A 299 (-3.5A)
SAH  A 299 (-2.9A)
SAH  A 299 (-3.2A)
 0.74A 5e72A-1ri3A:
15.3		 5e72A-1ri3A:
24.34
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.
1sp3 CYTOCHROME C,
PUTATIVE

(Shewanella
oneidensis) 		PF11783
(Cytochrome_cB)
PF13435
(Cytochrome_C554) 		4 ASP A 137
GLY A 106
ASP A 103
ASP A  97
 None
 1.17A 5e72A-1sp3A:
undetectable		 5e72A-1sp3A:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v9v KIAA0561 PROTEIN

(Homo sapiens) 		PF08926
(DUF1908) 		4 ASP A  79
GLY A  36
ASP A  35
ASP A  85
 None
 1.00A 5e72A-1v9vA:
undetectable		 5e72A-1v9vA:
15.65
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.
1ve3 HYPOTHETICAL PROTEIN
PH0226

(Pyrococcus
horikoshii) 		PF13649
(Methyltransf_25) 		4 ASP A  44
GLY A  48
ASP A  67
ASP A  93
 SAM  A 302 ( 4.8A)
SAM  A 302 (-3.6A)
SAM  A 302 (-2.8A)
SAM  A 302 (-3.4A)
 0.60A 5e72A-1ve3A:
17.2		 5e72A-1ve3A:
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.
1vl5 UNKNOWN CONSERVED
PROTEIN BH2331

(Bacillus
halodurans) 		PF08241
(Methyltransf_11) 		4 ASP A  48
GLY A  52
ASP A  71
ASP A  98
 None
 0.69A 5e72A-1vl5A:
18.1		 5e72A-1vl5A:
22.31
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.
1wzn SAM-DEPENDENT
METHYLTRANSFERASE

(Pyrococcus
horikoshii) 		PF13649
(Methyltransf_25) 		4 ASP A  47
GLY A  51
ASP A  70
ASP A  96
 SAH  A1001 ( 4.8A)
SAH  A1001 (-3.1A)
SAH  A1001 (-2.7A)
SAH  A1001 (-3.3A)
 0.60A 5e72A-1wznA:
15.8		 5e72A-1wznA:
26.87
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.
1xdz METHYLTRANSFERASE
GIDB

(Bacillus
subtilis) 		PF02527
(GidB) 		4 ASP A  75
GLY A  79
ASP A 100
ASP A 126
 None
 1.20A 5e72A-1xdzA:
14.4		 5e72A-1xdzA:
21.71
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.
1y8c S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE

(Clostridium
acetobutylicum) 		PF13649
(Methyltransf_25) 		4 ASP A  44
GLY A  48
ASP A  67
ASP A  93
 None
 0.65A 5e72A-1y8cA:
16.8		 5e72A-1y8cA:
21.49
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.
1yfz HYPOXANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE

(Caldanaerobacter
subterraneus) 		PF00156
(Pribosyltran) 		4 ASP A 161
GLY A  46
ASP A 102
ASP A 105
 MG  A1192 ( 2.6A)
IMP  A1210 (-3.2A)
MG  A1191 (-2.8A)
IMP  A1210 (-4.2A)
 1.14A 5e72A-1yfzA:
undetectable		 5e72A-1yfzA:
21.69
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.
2a14 INDOLETHYLAMINE
N-METHYLTRANSFERASE

(Homo sapiens) 		PF01234
(NNMT_PNMT_TEMT) 		4 ASP A  61
GLY A  65
ASP A  85
ASP A 142
 None
SAH  A4001 (-3.0A)
SAH  A4001 (-2.7A)
SAH  A4001 (-3.7A)
 0.71A 5e72A-2a14A:
13.4		 5e72A-2a14A:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b3t PROTEIN
METHYLTRANSFERASE
HEMK

(Escherichia
coli) 		PF13847
(Methyltransf_31) 		4 ASP A 115
GLY A 119
ASP A 140
ASP A 167
 None
SAH  A 300 (-3.5A)
SAH  A 300 (-3.1A)
SAH  A 300 (-3.0A)
 0.44A 5e72A-2b3tA:
17.9		 5e72A-2b3tA:
23.48
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.
2btv PROTEIN (VP3 CORE
PROTEIN)

(Bluetongue
virus) 		PF01700
(Orbi_VP3) 		4 ASP A 203
GLY A 195
ASP A 201
ASP A 262
 None
 1.14A 5e72A-2btvA:
undetectable		 5e72A-2btvA:
17.04
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.
2da9 SH3-DOMAIN KINASE
BINDING PROTEIN 1

(Mus musculus) 		PF14604
(SH3_9) 		4 ASP A  38
GLY A  43
ASP A  58
ASP A   8
 None
 1.21A 5e72A-2da9A:
undetectable		 5e72A-2da9A:
12.26
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.
2f8l HYPOTHETICAL PROTEIN
LMO1582

(Listeria
monocytogenes) 		PF02384
(N6_Mtase) 		4 ASP A 124
GLY A 128
ASP A 154
ASP A 180
 SAM  A 400 ( 4.8A)
SAM  A 400 (-3.3A)
SAM  A 400 (-2.7A)
SAM  A 400 (-3.4A)
 0.43A 5e72A-2f8lA:
15.9		 5e72A-2f8lA:
24.50
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.
2geb HYPOXANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE

(Caldanaerobacter
subterraneus) 		PF00156
(Pribosyltran) 		4 ASP A 161
GLY A  46
ASP A 102
ASP A 105
 None
None
CA  A 201 (-2.9A)
None
 0.97A 5e72A-2gebA:
undetectable		 5e72A-2gebA:
19.33
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.
2i62 NICOTINAMIDE
N-METHYLTRANSFERASE

(Mus musculus) 		PF01234
(NNMT_PNMT_TEMT) 		4 ASP A  62
GLY A  66
ASP A  86
ASP A 143
 None
SAH  A4001 (-3.2A)
SAH  A4001 (-2.9A)
SAH  A4001 (-4.0A)
 0.73A 5e72A-2i62A:
12.7		 5e72A-2i62A:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iip NICOTINAMIDE
N-METHYLTRANSFERASE

(Homo sapiens) 		PF01234
(NNMT_PNMT_TEMT) 		4 ASP A  61
GLY A  65
ASP A  85
ASP A 142
 None
SAH  A4001 (-3.0A)
SAH  A4001 (-2.6A)
SAH  A4001 (-3.7A)
 0.75A 5e72A-2iipA:
13.1		 5e72A-2iipA:
22.31
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.
2jjq UNCHARACTERIZED RNA
METHYLTRANSFERASE
PYRAB10780

(Pyrococcus
abyssi) 		PF05958
(tRNA_U5-meth_tr) 		4 ASP A 276
GLY A 280
ASP A 299
ASP A 326
 None
SAH  A1406 (-3.4A)
SAH  A1406 (-2.8A)
SAH  A1406 (-3.1A)
 0.73A 5e72A-2jjqA:
16.2		 5e72A-2jjqA:
24.56
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.
2jpo PHEROMONE-BINDING
PROTEIN

(Antheraea
polyphemus) 		PF01395
(PBP_GOBP) 		4 ASP A  75
GLY A  66
ASP A  63
ASP A 132
 None
 1.16A 5e72A-2jpoA:
undetectable		 5e72A-2jpoA:
18.29
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.
2okc TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF02384
(N6_Mtase)
PF12161
(HsdM_N) 		4 ASP A 176
GLY A 180
ASP A 214
ASP A 243
 SAM  A 500 ( 4.9A)
SAM  A 500 (-3.2A)
SAM  A 500 (-2.9A)
SAM  A 500 (-3.3A)
 0.32A 5e72A-2okcA:
15.0		 5e72A-2okcA:
23.25
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.
2qe6 UNCHARACTERIZED
PROTEIN TFU_2867

(Thermobifida
fusca) 		PF04672
(Methyltransf_19) 		4 ASP A  82
GLY A  86
ASP A 110
ASP A 135
 None
SAM  A 400 ( 3.2A)
SAM  A 400 (-2.7A)
SAM  A 400 (-3.4A)
 0.65A 5e72A-2qe6A:
10.8		 5e72A-2qe6A:
25.92
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.
2rhp THROMBOSPONDIN-2

(Homo sapiens) 		PF02412
(TSP_3)
PF05735
(TSP_C)
PF07645
(EGF_CA)
PF12947
(EGF_3) 		4 ASP A 754
GLY A 748
ASP A 743
ASP A 738
 CA  A  23 ( 2.3A)
None
CA  A  24 ( 3.3A)
None
 1.07A 5e72A-2rhpA:
undetectable		 5e72A-2rhpA:
17.41
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.
2zfu CEREBRAL PROTEIN 1

(Homo sapiens) 		PF05148
(Methyltransf_8) 		4 ASP A 314
GLY A 318
ASP A 334
ASP A 346
 SAH  A 900 ( 4.6A)
SAH  A 900 ( 3.7A)
SAH  A 900 (-2.7A)
SAH  A 900 (-3.6A)
 0.53A 5e72A-2zfuA:
10.9		 5e72A-2zfuA:
23.19
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.
3acc HYPOXANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE

(Thermus
thermophilus) 		PF00156
(Pribosyltran) 		4 ASP A 162
GLY A  47
ASP A 103
ASP A 106
 5GP  A 817 (-4.6A)
None
5GP  A 817 (-3.0A)
5GP  A 817 (-4.2A)
 1.16A 5e72A-3accA:
undetectable		 5e72A-3accA:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ay0 UNCHARACTERIZED
PROTEIN MJ0883

(Methanocaldococcus
jannaschii) 		PF02475
(Met_10) 		4 ASP A 201
GLY A 205
ASP A 223
ASP A 251
 None
ADN  A 401 ( 4.0A)
ADN  A 401 (-2.6A)
ADN  A 401 (-3.8A)
 0.46A 5e72A-3ay0A:
16.9		 5e72A-3ay0A:
23.47
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.
3b89 16S RRNA METHYLASE

(Escherichia
coli) 		PF07091
(FmrO) 		4 ASP A 109
GLY A 113
ASP A 131
ASP A 157
 None
5GP  A 500 ( 4.5A)
5GP  A 500 (-3.1A)
5GP  A 500 (-2.7A)
 0.93A 5e72A-3b89A:
11.7		 5e72A-3b89A:
20.96
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.
3cgg SAM-DEPENDENT
METHYLTRANSFERASE

(Corynebacterium
glutamicum) 		PF13649
(Methyltransf_25) 		4 ASP A  51
GLY A  55
ASP A  74
ASP A  96
 None
None
NHE  A 195 (-3.6A)
NHE  A 195 (-4.3A)
 1.07A 5e72A-3cggA:
16.2		 5e72A-3cggA:
21.14
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.
3d2l SAM-DEPENDENT
METHYLTRANSFERASE

(Exiguobacterium
sibiricum) 		PF13649
(Methyltransf_25) 		4 ASP A  38
GLY A  42
ASP A  60
ASP A  86
 None
 0.78A 5e72A-3d2lA:
17.0		 5e72A-3d2lA:
23.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dlc PUTATIVE
S-ADENOSYL-L-METHION
INE-DEPENDENT
METHYLTRANSFERASE

(Methanococcus
maripaludis) 		PF08241
(Methyltransf_11) 		4 ASP A  48
GLY A  52
ASP A  72
ASP A 100
 SAM  A 220 ( 4.9A)
SAM  A 220 (-3.2A)
SAM  A 220 (-2.9A)
SAM  A 220 (-3.2A)
 0.64A 5e72A-3dlcA:
14.0		 5e72A-3dlcA:
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.
3dli METHYLTRANSFERASE

(Archaeoglobus
fulgidus) 		PF13489
(Methyltransf_23) 		4 ASP A 288
GLY A 292
ASP A 311
ASP A 330
 None
 0.63A 5e72A-3dliA:
15.4		 5e72A-3dliA:
23.46
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.
3dtn PUTATIVE
METHYLTRANSFERASE
MM_2633

(Methanosarcina
mazei) 		PF13649
(Methyltransf_25) 		4 ASP A  48
GLY A  52
ASP A  73
ASP A  98
 None
 0.53A 5e72A-3dtnA:
15.5		 5e72A-3dtnA:
26.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eey PUTATIVE RRNA
METHYLASE

(Ruminiclostridium
thermocellum) 		PF06962
(rRNA_methylase) 		4 ASP A  26
GLY A  30
ASP A  52
ASP A  79
 SAM  A 300 ( 4.5A)
SAM  A 300 (-3.4A)
SAM  A 300 (-2.9A)
None
 0.96A 5e72A-3eeyA:
15.4		 5e72A-3eeyA:
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.
3egi TRIMETHYLGUANOSINE
SYNTHASE HOMOLOG

(Homo sapiens) 		PF09445
(Methyltransf_15) 		4 ASP A 696
GLY A 700
ASP A 719
ASP A 747
 None
ADP  A   3 (-3.5A)
ADP  A   3 (-2.9A)
ADP  A   3 (-3.4A)
 0.44A 5e72A-3egiA:
15.7		 5e72A-3egiA:
21.84
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.
3g20 TYPE II SECRETION
PROTEIN

(Escherichia
coli) 		PF08334
(T2SSG) 		4 ASP A  97
GLY A  95
ASP A  92
ASP A 125
 None
None
None
CA  A 201 (-3.3A)
 1.15A 5e72A-3g20A:
undetectable		 5e72A-3g20A:
17.47
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.
3gdh TRIMETHYLGUANOSINE
SYNTHASE HOMOLOG

(Homo sapiens) 		PF09445
(Methyltransf_15) 		4 ASP A 696
GLY A 700
ASP A 719
ASP A 747
 None
SAH  A 854 (-3.3A)
SAH  A 854 (-2.9A)
SAH  A 854 (-3.6A)
 0.43A 5e72A-3gdhA:
17.5		 5e72A-3gdhA:
22.49
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.
3go4 PROTEIN OF UNKNOWN
FUNCTION DUF574

(Streptomyces
avermitilis) 		PF04672
(Methyltransf_19) 		4 ASP A  83
GLY A  87
ASP A 111
ASP A 138
 SAH  A 277 ( 4.7A)
SAH  A 277 (-3.1A)
SAH  A 277 (-2.7A)
SAH  A 277 (-3.5A)
 0.63A 5e72A-3go4A:
10.7		 5e72A-3go4A:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gu3 METHYLTRANSFERASE

(Bacillus cereus) 		PF13847
(Methyltransf_31) 		4 ASP A  45
GLY A  49
ASP A  71
ASP A  97
 SAH  A 401 ( 4.5A)
SAH  A 401 (-3.3A)
SAH  A 401 (-2.7A)
SAH  A 401 (-3.3A)
 0.66A 5e72A-3gu3A:
14.1		 5e72A-3gu3A:
25.41
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.
3hkz DNA-DIRECTED RNA
POLYMERASE SUBUNIT B

(Sulfolobus
solfataricus) 		PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5) 		4 ASP B  33
GLY B 347
ASP B 348
ASP B 571
 None
 1.22A 5e72A-3hkzB:
undetectable		 5e72A-3hkzB:
16.23
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.
3i9f PUTATIVE TYPE 11
METHYLTRANSFERASE

(Sulfolobus
solfataricus) 		PF08241
(Methyltransf_11) 		4 ASP A  37
GLY A  41
ASP A  60
ASP A  81
 None
 0.81A 5e72A-3i9fA:
11.5		 5e72A-3i9fA:
20.40
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.
3lby PUTATIVE
UNCHARACTERIZED
PROTEIN SMU.1697C

(Streptococcus
mutans) 		PF06962
(rRNA_methylase) 		4 ASP A  25
GLY A  29
ASP A  48
ASP A  74
 None
SAH  A4630 (-3.6A)
SAH  A4630 (-2.9A)
None
 0.98A 5e72A-3lbyA:
15.3		 5e72A-3lbyA:
21.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lcv SISOMICIN-GENTAMICIN
RESISTANCE METHYLASE
SGM

(Micromonospora
zionensis) 		PF07091
(FmrO) 		4 ASP B 131
GLY B 135
ASP B 156
ASP B 182
 None
SAM  B 301 ( 4.1A)
SAM  B 301 (-2.9A)
SAM  B 301 (-3.1A)
 0.81A 5e72A-3lcvB:
9.5		 5e72A-3lcvB:
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.
3ldu PUTATIVE METHYLASE

(Clostridioides
difficile) 		PF01170
(UPF0020)
PF02926
(THUMP) 		4 ASP A 198
GLY A 202
ASP A 261
ASP A 289
 None
GTP  A 383 (-2.6A)
GTP  A 383 (-3.0A)
GTP  A 383 ( 3.8A)
 0.35A 5e72A-3lduA:
13.9		 5e72A-3lduA:
26.79
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.
3lsc TRIAZINE HYDROLASE

(Paenarthrobacter
aurescens) 		PF01979
(Amidohydro_1) 		4 ASP A  49
GLY A   6
ASP A  24
ASP A  41
 None
 1.05A 5e72A-3lscA:
undetectable		 5e72A-3lscA:
23.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mti RRNA METHYLASE

(Streptococcus
thermophilus) 		PF06962
(rRNA_methylase) 		4 ASP A  25
GLY A  29
ASP A  48
ASP A  74
 None
 1.02A 5e72A-3mtiA:
15.6		 5e72A-3mtiA:
23.41
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.
3oz7 PHOSPHOGLYCERATE
KINASE

(Plasmodium
falciparum) 		PF00162
(PGK) 		4 ASP A  97
GLY A 100
ASP A 152
ASP A 145
 None
 1.09A 5e72A-3oz7A:
3.7		 5e72A-3oz7A:
22.50
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.
3s1s RESTRICTION
ENDONUCLEASE BPUSI

(Bacillus
pumilus) 		PF02384
(N6_Mtase)
PF15516
(BpuSI_N) 		4 ASP A 327
GLY A 331
ASP A 355
ASP A 388
 None
SAH  A 900 (-3.2A)
SAH  A 900 (-2.8A)
SAH  A 900 (-4.1A)
 0.53A 5e72A-3s1sA:
13.0		 5e72A-3s1sA:
19.05
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.
3tma METHYLTRANSFERASE

(Thermus
thermophilus) 		PF01170
(UPF0020)
PF02926
(THUMP) 		4 ASP A 190
GLY A 194
ASP A 216
ASP A 243
 None
 0.53A 5e72A-3tmaA:
22.2		 5e72A-3tmaA:
29.14
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.
3v8v RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE L

(Escherichia
coli) 		PF01170
(UPF0020)
PF02926
(THUMP)
PF10672
(Methyltrans_SAM) 		4 ASP A 195
GLY A 199
ASP A 262
ASP A 290
 None
SAM  A 801 (-3.2A)
SAM  A 801 (-2.9A)
SAM  A 801 (-3.0A)
 0.47A 5e72A-3v8vA:
17.8		 5e72A-3v8vA:
19.55
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.
3zbf PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ROS

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 ASP A2079
GLY A2104
ASP A2102
ASP A2033
 None
None
None
VGH  A3000 (-4.5A)
 1.06A 5e72A-3zbfA:
undetectable		 5e72A-3zbfA:
21.24
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.
4fgi TSI1

(Pseudomonas
aeruginosa) 		no annotation 4 ASP B  78
GLY B  76
ASP B  72
ASP B 117
 None
 1.21A 5e72A-4fgiB:
undetectable		 5e72A-4fgiB:
19.16
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.
4fnm E3 ALPHA-ESTERASE-7
CARBOXYLESTERASE

(Lucilia cuprina) 		PF00135
(COesterase) 		4 ASP A 473
GLY A 468
ASP A 449
ASP A 452
 None
 1.01A 5e72A-4fnmA:
undetectable		 5e72A-4fnmA:
22.46
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.
4fod ALK TYROSINE KINASE
RECEPTOR

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 ASP A1249
GLY A1272
ASP A1270
ASP A1203
 None
None
0UV  A1501 ( 4.2A)
0UV  A1501 ( 4.6A)
 1.01A 5e72A-4fodA:
undetectable		 5e72A-4fodA:
24.16
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.
4ine PROTEIN PMT-2

(Caenorhabditis
elegans) 		PF08241
(Methyltransf_11) 		4 ASP A 230
GLY A 234
ASP A 254
ASP A 281
 SAH  A 501 ( 4.8A)
SAH  A 501 (-3.6A)
SAH  A 501 (-2.6A)
SAH  A 501 (-3.5A)
 0.57A 5e72A-4ineA:
14.3		 5e72A-4ineA:
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.
4iv8 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
knowlesi) 		PF08241
(Methyltransf_11) 		4 ASP A  59
GLY A  63
ASP A  83
ASP A 108
 SAM  A 301 ( 4.9A)
SAM  A 301 ( 3.9A)
SAM  A 301 (-2.7A)
SAM  A 301 (-3.5A)
 0.67A 5e72A-4iv8A:
14.2		 5e72A-4iv8A:
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.
4krg PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE
1

(Haemonchus
contortus) 		PF08241
(Methyltransf_11) 		4 ASP A  57
GLY A  61
ASP A  80
ASP A 105
 None
SAH  A 502 (-3.4A)
SAH  A 502 (-2.5A)
SAH  A 502 (-3.0A)
 0.74A 5e72A-4krgA:
13.7		 5e72A-4krgA:
21.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kri PHOSPHOLETHANOLAMINE
N-METHYLTRANSFERASE
2

(Haemonchus
contortus) 		PF08241
(Methyltransf_11) 		4 ASP A 226
GLY A 230
ASP A 250
ASP A 277
 SAH  A 701 ( 4.6A)
SAH  A 701 (-3.5A)
SAH  A 701 (-2.7A)
SAH  A 701 (-3.4A)
 0.52A 5e72A-4kriA:
14.6		 5e72A-4kriA:
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.
4m73 METHYLTRANSFERASE
MPPJ

(Streptomyces
hygroscopicus) 		PF13649
(Methyltransf_25) 		4 ASP A 164
GLY A 168
ASP A 189
ASP A 217
 SAH  A 401 ( 4.6A)
SAH  A 401 (-3.5A)
SAH  A 401 (-2.7A)
SAH  A 401 ( 3.7A)
 0.48A 5e72A-4m73A:
13.5		 5e72A-4m73A:
23.12
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.
4mwz PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
vivax) 		PF13649
(Methyltransf_25) 		4 ASP A  58
GLY A  62
ASP A  82
ASP A 107
 SAM  A 301 ( 4.6A)
SAM  A 301 ( 3.8A)
SAM  A 301 (-2.8A)
SAM  A 301 (-3.5A)
 0.65A 5e72A-4mwzA:
14.7		 5e72A-4mwzA:
24.86
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.
4nec PUTATIVE
SAM-DEPENDENT
METHYLTRANSFERASE

(Streptomyces
lasaliensis) 		PF13649
(Methyltransf_25) 		4 ASP A  45
GLY A  49
ASP A  68
ASP A  94
 SAH  A 401 ( 4.7A)
SAH  A 401 (-3.6A)
SAH  A 401 (-2.8A)
SAH  A 401 ( 3.6A)
 0.71A 5e72A-4necA:
14.6		 5e72A-4necA:
23.51
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.
4pfq HYPOXANTHINE
PHOSPHORIBOSYLTRANSF
ERASE

(Brachybacterium
faecium) 		PF00156
(Pribosyltran) 		4 ASP A 186
GLY A  71
ASP A 127
ASP A 130
 None
None
MG  A 400 (-2.6A)
None
 1.00A 5e72A-4pfqA:
undetectable		 5e72A-4pfqA:
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.
4qdk MAGNESIUM-PROTOPORPH
YRIN
O-METHYLTRANSFERASE

(Synechocystis
sp. PCC 6803) 		PF07109
(Mg-por_mtran_C) 		4 ASP A  68
GLY A  72
ASP A  91
ASP A 120
 None
SAH  A 301 (-3.6A)
SAH  A 301 (-2.8A)
SAH  A 301 (-3.8A)
 0.54A 5e72A-4qdkA:
16.0		 5e72A-4qdkA:
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.
4qvg SIBL

(Streptosporangium
sibiricum) 		PF00891
(Methyltransf_2)
PF16864
(Dimerisation2) 		4 ASP A 176
GLY A 180
ASP A 201
ASP A 228
 None
 1.05A 5e72A-4qvgA:
15.0		 5e72A-4qvgA:
27.50
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.
4qyi HYPOXANTHINE
PHOSPHORIBOSYLTRANSF
ERASE

(Bacillus
anthracis) 		PF00156
(Pribosyltran) 		4 ASP A 158
GLY A  43
ASP A  99
ASP A 102
 PO4  A 202 (-4.3A)
PO4  A 202 (-3.6A)
MG  A 201 (-2.5A)
PO4  A 203 (-3.7A)
 0.96A 5e72A-4qyiA:
undetectable		 5e72A-4qyiA:
20.63
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.
4r6w PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE

(Plasmodium
falciparum) 		PF13649
(Methyltransf_25) 		4 ASP A  61
GLY A  65
ASP A  85
ASP A 110
 SAH  A 302 ( 4.6A)
SAH  A 302 (-3.6A)
SAH  A 302 (-2.6A)
SAH  A 302 (-3.6A)
 0.57A 5e72A-4r6wA:
14.0		 5e72A-4r6wA:
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.
4rg8 EXONUCLEASE I

(Methylocaldum
szegediense) 		PF00929
(RNase_T)
PF08411
(Exonuc_X-T_C) 		4 ASP A 397
GLY A 367
ASP A 366
ASP A 358
 None
 1.18A 5e72A-4rg8A:
undetectable		 5e72A-4rg8A:
22.61
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.
4rhy HYPOXANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE

(Mycobacterium
tuberculosis) 		PF00156
(Pribosyltran) 		4 ASP A 182
GLY A  67
ASP A 123
ASP A 126
 ASP  A 182 ( 0.5A)
GLY  A  67 (-0.0A)
ASP  A 123 (-0.6A)
ASP  A 126 (-0.5A)
 1.15A 5e72A-4rhyA:
undetectable		 5e72A-4rhyA:
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.
4y1t PERFORIN-1

(Mus musculus) 		PF00168
(C2) 		4 ASP A 435
GLY A 428
ASP A 491
ASP A 489
 CA  A 603 ( 2.3A)
CA  A 604 (-4.5A)
CA  A 602 ( 2.7A)
None
 1.14A 5e72A-4y1tA:
undetectable		 5e72A-4y1tA:
20.63
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.
4yv2 SPERMIDINE SYNTHASE,
PUTATIVE

(Trypanosoma
cruzi) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		4 ASP A 168
GLY A  97
ASP A 118
ASP A 149
 S4M  A 301 (-3.1A)
S4M  A 301 ( 4.5A)
S4M  A 301 (-3.0A)
S4M  A 301 (-3.9A)
 1.17A 5e72A-4yv2A:
12.3		 5e72A-4yv2A:
22.40
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.
5bp7 SAM-DEPENDENT
METHYLTRANSFERASE

(Geobacter
sulfurreducens) 		PF13847
(Methyltransf_31) 		4 ASP A  43
GLY A  47
ASP A  67
ASP A  95
 SAH  A 301 ( 4.5A)
SAH  A 301 (-3.5A)
SAH  A 301 (-2.8A)
SAH  A 301 (-3.3A)
 0.51A 5e72A-5bp7A:
13.7		 5e72A-5bp7A:
22.95
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.
5cm2 TRNA
METHYLTRANSFERASE

(Yarrowia
lipolytica) 		PF08241
(Methyltransf_11) 		4 ASP Z  62
GLY Z  66
ASP Z  83
ASP Z 105
 None
 0.49A 5e72A-5cm2Z:
14.5		 5e72A-5cm2Z:
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.
5dm4 METHYLTRANSFERASE
DOMAIN FAMILY

(Bacillus
pumilus) 		PF13489
(Methyltransf_23) 		4 ASP A  65
GLY A  69
ASP A  90
ASP A 112
 SAH  A 300 ( 4.4A)
SAH  A 300 ( 3.7A)
SAH  A 300 (-2.8A)
SAH  A 300 (-2.9A)
 0.70A 5e72A-5dm4A:
11.1		 5e72A-5dm4A:
20.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5e72 N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE

(Thermococcus
kodakarensis) 		PF01170
(UPF0020)
PF02926
(THUMP) 		4 ASP A 185
GLY A 189
ASP A 208
ASP A 235
 SAM  A 400 (-2.8A)
SAM  A 400 (-3.3A)
SAM  A 400 (-2.8A)
SAM  A 400 (-3.4A)
 0.01A 5e72A-5e72A:
54.0		 5e72A-5e72A:
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.
5epe SAM-DEPENDENT
METHYLTRANSFERASE

(Thiobacillus
denitrificans) 		PF13847
(Methyltransf_31) 		4 ASP A  42
GLY A  46
ASP A  66
ASP A  94
 SAH  A 301 ( 4.5A)
SAH  A 301 (-3.4A)
SAH  A 301 (-2.8A)
SAH  A 301 (-3.5A)
 0.49A 5e72A-5epeA:
12.8		 5e72A-5epeA:
22.35
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.
5h02 GLYCINE SARCOSINE
N-METHYLTRANSFERASE

(Methanohalophilus
portucalensis) 		PF13649
(Methyltransf_25) 		4 ASP A  65
GLY A  69
ASP A  88
ASP A 114
 None
SAH  A 301 (-3.3A)
SAH  A 301 (-2.8A)
SAH  A 301 (-3.7A)
 0.71A 5e72A-5h02A:
18.1		 5e72A-5h02A:
22.90
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.
5ipf HYPOXANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE (HGPRT)

(Schistosoma
mansoni) 		PF00156
(Pribosyltran) 		4 ASP A 200
GLY A  76
ASP A 141
ASP A 144
 None
None
IMP  A1300 (-2.4A)
IMP  A1300 (-4.3A)
 1.10A 5e72A-5ipfA:
undetectable		 5e72A-5ipfA:
21.65
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.
5k51 HYPOXANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE

(Trypanosoma
brucei) 		PF00156
(Pribosyltran) 		4 ASP A 173
GLY A  55
ASP A 114
ASP A 117
 None
None
None
6QD  A 301 (-4.3A)
 1.16A 5e72A-5k51A:
undetectable		 5e72A-5k51A:
22.66
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.
5m58 C-METHYLTRANSFERASE
COUO

(Streptomyces
rishiriensis) 		PF13649
(Methyltransf_25) 		4 ASP A  45
GLY A  49
ASP A  70
ASP A  96
 SAH  A 301 ( 4.8A)
SAH  A 301 (-3.3A)
SAH  A 301 (-2.8A)
SAH  A 301 (-3.5A)
 0.38A 5e72A-5m58A:
14.8		 5e72A-5m58A:
25.55
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.
5mgz 8-DEMETHYLNOVOBIOCIC
ACID
C(8)-METHYLTRANSFERA
SE

(Streptomyces
niveus) 		PF13649
(Methyltransf_25) 		4 ASP A  45
GLY A  49
ASP A  70
ASP A  96
 SAH  A 301 ( 4.8A)
SAH  A 301 (-3.4A)
SAH  A 301 (-2.8A)
SAH  A 301 (-3.5A)
 0.38A 5e72A-5mgzA:
14.6		 5e72A-5mgzA:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mqz PUTATIVE
BRANCHED-CHAIN-AMINO
-ACID
AMINOTRANSFERASE

(Archaeoglobus
fulgidus) 		no annotation 4 ASP A  22
GLY A  30
ASP A  29
ASP A 102
 None
 0.97A 5e72A-5mqzA:
undetectable		 5e72A-5mqzA:
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.
5u4t PUTATIVE GENTAMICIN
METHYLTRANSFERASE

(Micromonospora
echinospora) 		no annotation 4 ASP A 129
GLY A 133
ASP A 152
ASP A 179
 SAH  A 414 ( 3.7A)
SAH  A 414 (-2.8A)
SAH  A 414 (-2.1A)
SAH  A 414 (-2.9A)
 0.74A 5e72A-5u4tA:
13.0		 5e72A-5u4tA:
24.22
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.
5w7k OXAG

(Penicillium
oxalicum) 		no annotation 4 ASP A  52
GLY A  56
ASP A  82
ASP A 109
 None
SAH  A 301 (-3.4A)
SAH  A 301 (-2.7A)
SAH  A 301 (-3.6A)
 0.69A 5e72A-5w7kA:
16.9		 5e72A-5w7kA:
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.
5wp4 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE
1

(Arabidopsis
thaliana) 		no annotation 4 ASP A 288
GLY A 292
ASP A 312
ASP A 338
 SAH  A 703 ( 4.6A)
SAH  A 703 ( 3.7A)
SAH  A 703 (-2.6A)
SAH  A 703 (-3.3A)
 0.57A 5e72A-5wp4A:
14.6		 5e72A-5wp4A:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wp5 PHOSPHOMETHYLETHANOL
AMINE
N-METHYLTRANSFERASE
2

(Arabidopsis
thaliana) 		no annotation 4 ASP A 288
GLY A 292
ASP A 312
ASP A 338
 SAH  A 501 ( 4.4A)
SAH  A 501 (-3.6A)
SAH  A 501 (-2.8A)
SAH  A 501 (-3.4A)
 0.51A 5e72A-5wp5A:
14.8		 5e72A-5wp5A:
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.
5yac TRNA
(GUANINE(37)-N1)-MET
HYLTRANSFERASE TRM5B

(Pyrococcus
abyssi) 		PF02475
(Met_10) 		4 ASP A 188
GLY A 192
ASP A 211
ASP A 238
 None
 0.47A 5e72A-5yacA:
17.2		 5e72A-5yacA:
22.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b3b APRA
METHYLTRANSFERASE 1

(Moorea
bouillonii) 		no annotation 4 ASP A 278
GLY A 282
ASP A 315
ASP A 339
 SAM  A 701 ( 4.6A)
SAM  A 701 (-3.3A)
SAM  A 701 (-2.8A)
SAM  A 701 (-3.2A)
 0.48A 5e72A-6b3bA:
11.2		 5e72A-6b3bA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6bo7 HYPOXANTHINE
PHOSPHORIBOSYLTRANSF
ERASE

(Plasmodium
vivax) 		no annotation 4 ASP A 204
GLY A  78
ASP A 145
ASP A 148
 MG  A 302 ( 2.5A)
YPG  A 303 (-3.8A)
MG  A 301 (-3.3A)
YPG  A 303 (-4.2A)
 1.18A 5e72A-6bo7A:
2.1		 5e72A-6bo7A:
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.
6f5z 24-STEROL
C-METHYLTRANSFERASE

(Haloferax
volcanii) 		no annotation 4 ASP A  44
GLY A  48
ASP A  69
ASP A  93
 None
SAH  A 301 ( 3.7A)
SAH  A 301 (-2.7A)
SAH  A 301 (-3.8A)
 0.57A 5e72A-6f5zA:
15.4		 5e72A-6f5zA:
undetectable