SIMILAR PATTERNS OF AMINO ACIDS FOR 1JG4_A_SAMA500

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.
1akp APOKEDARCIDIN

(actinomycete
ATCC 53650) 		PF00960
(Neocarzinostat) 		5 VAL A  98
GLY A 100
GLY A  60
ALA A  23
VAL A   5
 None
 1.11A 1jg4A-1akpA:
undetectable		 1jg4A-1akpA:
17.84
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.
1avb ARCELIN-1

(Phaseolus
vulgaris) 		PF00139
(Lectin_legB) 		5 THR A  23
VAL A  24
SER A  25
GLY A 151
VAL A  35
 None
 1.12A 1jg4A-1avbA:
undetectable		 1jg4A-1avbA:
21.51
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.
1d8z HU ANTIGEN C

(Mus musculus) 		PF00076
(RRM_1) 		5 GLN A  43
GLY A  42
GLY A  48
THR A  16
LEU A  11
 None
 1.07A 1jg4A-1d8zA:
undetectable		 1jg4A-1d8zA:
17.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dl5 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Thermotoga
maritima) 		PF01135
(PCMT) 		6 THR A  57
SER A  59
GLY A  85
ASN A  89
GLY A 135
THR A 151
 SAH  A 699 (-4.9A)
SAH  A 699 ( 3.9A)
SAH  A 699 (-3.5A)
SAH  A 699 (-4.9A)
SAH  A 699 (-3.5A)
SAH  A 699 (-3.2A)
 0.62A 1jg4A-1dl5A:
28.4		 1jg4A-1dl5A:
27.98
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.
1gz6 ESTRADIOL 17
BETA-DEHYDROGENASE 4

(Rattus
norvegicus) 		PF00106
(adh_short) 		5 THR A 131
SER A 127
GLY A  79
THR A  15
VAL A  96
 None
 1.13A 1jg4A-1gz6A:
5.1		 1jg4A-1gz6A:
22.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jg3 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Pyrococcus
furiosus) 		PF01135
(PCMT) 		6 GLN A  72
THR A  73
VAL A  74
GLY A 101
TRP A 104
GLY A 147
 ADN  A 500 (-3.7A)
NA  A 402 ( 3.9A)
None
ADN  A 500 (-3.4A)
None
None
 1.06A 1jg4A-1jg3A:
41.2		 1jg4A-1jg3A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jg3 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Pyrococcus
furiosus) 		PF01135
(PCMT) 		12 GLN A  72
THR A  73
VAL A  74
SER A  75
GLY A 101
TRP A 104
ASN A 105
GLY A 149
THR A 165
ALA A 166
VAL A 219
LEU A 221
 ADN  A 500 (-3.7A)
NA  A 402 ( 3.9A)
None
NA  A 402 ( 4.2A)
ADN  A 500 (-3.4A)
None
None
ADN  A 500 (-3.3A)
ADN  A 500 (-4.5A)
ADN  A 500 ( 4.0A)
None
ADN  A 500 (-4.2A)
 0.44A 1jg4A-1jg3A:
41.2		 1jg4A-1jg3A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1kr5 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Homo sapiens) 		PF01135
(PCMT) 		7 THR A  57
SER A  59
GLY A  87
GLY A 142
ALA A 159
VAL A 213
LEU A 215
 None
SAH  A 300 (-3.7A)
SAH  A 300 (-3.6A)
SAH  A 300 (-3.5A)
SAH  A 300 ( 3.8A)
SAH  A 300 ( 4.8A)
SAH  A 300 (-4.4A)
 0.43A 1jg4A-1kr5A:
31.7		 1jg4A-1kr5A:
35.66
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.
1l2q MONOMETHYLAMINE
METHYLTRANSFERASE

(Methanosarcina
barkeri) 		PF05369
(MtmB) 		5 THR A 275
GLY A  74
THR A 281
ALA A 280
LEU A  70
 None
 1.05A 1jg4A-1l2qA:
undetectable		 1jg4A-1l2qA:
20.26
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.
1ldn L-LACTATE
DEHYDROGENASE

(Geobacillus
stearothermophilus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 THR A 147
ASN A 113
GLY A  32
THR A 137
ALA A 136
 None
NAD  A 352 ( 4.6A)
None
NAD  A 352 (-3.7A)
NAD  A 352 (-4.3A)
 1.13A 1jg4A-1ldnA:
2.6		 1jg4A-1ldnA:
21.52
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.
1pek PROTEINASE K

(Parengyodontium
album) 		PF00082
(Peptidase_S8) 		5 SER E 130
GLY E 232
GLY E   9
ALA E 226
VAL E 180
 None
 1.04A 1jg4A-1pekE:
undetectable		 1jg4A-1pekE:
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.
1pyf IOLS PROTEIN

(Bacillus
subtilis) 		PF00248
(Aldo_ket_red) 		5 THR A  20
GLY A 153
THR A  83
ALA A  82
LEU A 121
 None
 1.11A 1jg4A-1pyfA:
undetectable		 1jg4A-1pyfA:
23.77
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.
1pz1 GENERAL STRESS
PROTEIN 69

(Bacillus
subtilis) 		PF00248
(Aldo_ket_red) 		5 THR A  20
GLY A 153
THR A  83
ALA A  82
LEU A 121
 None
 1.07A 1jg4A-1pz1A:
undetectable		 1jg4A-1pz1A:
21.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qzu HYPOTHETICAL PROTEIN
MDS018

(Homo sapiens) 		PF02441
(Flavoprotein) 		5 VAL A  28
SER A  27
ALA A 101
VAL A  24
LEU A  99
 FMN  A 801 (-4.6A)
FMN  A 801 (-2.7A)
None
None
None
 0.98A 1jg4A-1qzuA:
undetectable		 1jg4A-1qzuA:
23.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1r18 PROTEIN-L-ISOASPARTA
TE(D-ASPARTATE)-O-ME
THYLTRANSFERASE

(Drosophila
melanogaster) 		PF01135
(PCMT) 		5 THR A  58
SER A  60
GLY A  88
GLY A 148
ALA A 165
 None
SAH  A 300 ( 4.1A)
SAH  A 300 (-3.2A)
SAH  A 300 (-3.6A)
SAH  A 300 (-3.6A)
 0.47A 1jg4A-1r18A:
28.0		 1jg4A-1r18A:
36.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tuo PUTATIVE
PHOSPHOMANNOMUTASE

(Thermus
thermophilus) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		6 SER A 334
GLY A 314
GLY A 418
ALA A 292
VAL A 293
LEU A 429
 None
 1.43A 1jg4A-1tuoA:
undetectable		 1jg4A-1tuoA:
19.04
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.
1vbg PYRUVATE,ORTHOPHOSPH
ATE DIKINASE

(Zea mays) 		PF00391
(PEP-utilizers)
PF01326
(PPDK_N)
PF02896
(PEP-utilizers_C) 		5 THR A 328
VAL A 329
SER A 254
GLY A  82
VAL A 246
 None
 1.08A 1jg4A-1vbgA:
undetectable		 1jg4A-1vbgA:
14.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w8o BACTERIAL SIALIDASE

(Micromonospora
viridifaciens) 		PF00754
(F5_F8_type_C)
PF10633
(NPCBM_assoc)
PF13088
(BNR_2) 		6 VAL A 359
ASN A 492
GLY A 452
THR A 485
ALA A 484
LEU A 442
 None
 1.44A 1jg4A-1w8oA:
undetectable		 1jg4A-1w8oA:
16.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wz8 ENOYL-COA HYDRATASE

(Thermus
thermophilus) 		PF00378
(ECH_1) 		5 VAL A 153
GLY A 149
GLY A  70
ALA A 121
VAL A  97
 None
 1.01A 1jg4A-1wz8A:
undetectable		 1jg4A-1wz8A:
24.21
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.
1wz8 ENOYL-COA HYDRATASE

(Thermus
thermophilus) 		PF00378
(ECH_1) 		5 VAL A 153
GLY A 149
GLY A  71
ALA A 121
VAL A  97
 None
None
MPD  A3003 ( 4.1A)
None
None
 1.00A 1jg4A-1wz8A:
undetectable		 1jg4A-1wz8A:
24.21
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.
1xez HEMOLYSIN

(Vibrio cholerae) 		PF07968
(Leukocidin)
PF12563
(Hemolysin_N)
PF16458
(Beta-prism_lec) 		5 THR A 447
VAL A 448
SER A 398
GLY A  79
ALA A  72
 None
 1.09A 1jg4A-1xezA:
undetectable		 1jg4A-1xezA:
15.99
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.
1yni SUCCINYLARGININE
DIHYDROLASE

(Escherichia
coli) 		PF04996
(AstB) 		5 THR A 128
VAL A 129
GLY A 175
GLY A 197
ALA A 217
 None
 0.87A 1jg4A-1yniA:
undetectable		 1jg4A-1yniA:
18.00
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.
1yni SUCCINYLARGININE
DIHYDROLASE

(Escherichia
coli) 		PF04996
(AstB) 		5 THR A 128
VAL A 129
GLY A 197
ALA A 217
VAL A 221
 None
 1.04A 1jg4A-1yniA:
undetectable		 1jg4A-1yniA:
18.00
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.
2ap1 PUTATIVE REGULATOR
PROTEIN

(Salmonella
enterica) 		PF00480
(ROK) 		5 VAL A 139
GLY A 127
ASN A 107
GLY A 156
VAL A 244
 None
 1.07A 1jg4A-2ap1A:
undetectable		 1jg4A-2ap1A:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bp1 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2

(Homo sapiens) 		PF00248
(Aldo_ket_red) 		5 THR A  45
GLY A 170
THR A 105
ALA A 104
LEU A 138
 None
 1.12A 1jg4A-2bp1A:
undetectable		 1jg4A-2bp1A:
19.56
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.
2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2

(Mus musculus) 		PF00248
(Aldo_ket_red) 		5 THR A  12
GLY A 137
THR A  72
ALA A  71
LEU A 105
 None
 1.11A 1jg4A-2c91A:
undetectable		 1jg4A-2c91A:
20.23
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.
2cp2 CLIP-115

(Homo sapiens) 		PF01302
(CAP_GLY) 		5 VAL A  52
GLY A  50
ASN A  60
GLY A  12
VAL A  27
 None
 1.05A 1jg4A-2cp2A:
undetectable		 1jg4A-2cp2A:
14.73
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.
2e9y CARBAMATE KINASE

(Aeropyrum
pernix) 		PF00696
(AA_kinase) 		5 VAL A 210
GLY A  60
THR A  82
ALA A  81
LEU A  62
 None
 1.09A 1jg4A-2e9yA:
3.7		 1jg4A-2e9yA:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2g5c PREPHENATE
DEHYDROGENASE

(Aquifex
aeolicus) 		PF02153
(PDH) 		5 VAL A  36
SER A  98
GLY A  60
GLY A  75
ALA A  46
 None
 1.09A 1jg4A-2g5cA:
3.7		 1jg4A-2g5cA:
24.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hg4 6-DEOXYERYTHRONOLIDE
B SYNTHASE

(Saccharopolyspora
erythraea) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF08990
(Docking)
PF16197
(KAsynt_C_assoc) 		5 VAL A 368
SER A 367
GLY A 373
GLY A 243
THR A 336
 None
 1.08A 1jg4A-2hg4A:
undetectable		 1jg4A-2hg4A:
12.16
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.
2ki8 TUNGSTEN
FORMYLMETHANOFURAN
DEHYDROGENASE,
SUBUNIT D (FWDD-2)

(Archaeoglobus
fulgidus) 		PF01568
(Molydop_binding) 		5 VAL A  83
ASN A  53
GLY A  31
ALA A 104
VAL A 107
 None
 0.99A 1jg4A-2ki8A:
undetectable		 1jg4A-2ki8A:
25.00
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.
2nyf NOSTOC PUNCTIFORME
PHENYLALANINE
AMMONIA LYASE

(Nostoc
punctiforme) 		PF00221
(Lyase_aromatic) 		5 THR A 334
GLY A 329
GLY A 380
ALA A 239
VAL A 236
 None
 1.12A 1jg4A-2nyfA:
undetectable		 1jg4A-2nyfA:
17.23
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.
2or7 T-CELL
IMMUNOGLOBULIN AND
MUCIN
DOMAIN-CONTAINING
PROTEIN 2

(Mus musculus) 		PF07686
(V-set) 		5 VAL A  83
GLY A  86
GLY A  34
VAL A  15
LEU A  76
 None
 1.01A 1jg4A-2or7A:
undetectable		 1jg4A-2or7A:
20.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2pbf PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE
BETA-ASPARTATE
METHYLTRANSFERASE

(Plasmodium
falciparum) 		PF01135
(PCMT) 		6 THR A  60
SER A  62
GLY A  90
ALA A 170
VAL A 222
LEU A 224
 None
SAH  A 301 (-3.4A)
SAH  A 301 (-3.4A)
SAH  A 301 ( 3.8A)
SAH  A 301 (-4.5A)
SAH  A 301 (-4.3A)
 0.47A 1jg4A-2pbfA:
28.5		 1jg4A-2pbfA:
32.66
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.
2qhp FRUCTOKINASE

(Bacteroides
thetaiotaomicron) 		PF00294
(PfkB) 		5 VAL A 117
GLY A 243
THR A 249
ALA A 250
VAL A  33
 None
 0.97A 1jg4A-2qhpA:
2.3		 1jg4A-2qhpA:
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.
2r66 GLYCOSYL
TRANSFERASE, GROUP 1

(Halothermothrix
orenii) 		PF00534
(Glycos_transf_1)
PF00862
(Sucrose_synth) 		5 VAL A  42
SER A  43
GLY A 135
ALA A  11
VAL A  10
 None
 1.14A 1jg4A-2r66A:
undetectable		 1jg4A-2r66A:
18.86
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.
2weu TRYPTOPHAN
5-HALOGENASE

(Streptomyces
rugosporus) 		PF04820
(Trp_halogenase) 		5 TRP A 336
GLY A  11
THR A  17
ALA A  18
VAL A  31
 None
 1.12A 1jg4A-2weuA:
undetectable		 1jg4A-2weuA:
17.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2yxe PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Methanocaldococcus
jannaschii) 		PF01135
(PCMT) 		7 GLN A  58
THR A  59
SER A  61
GLY A 137
ALA A 154
VAL A 205
LEU A 207
 None
 1.01A 1jg4A-2yxeA:
35.3		 1jg4A-2yxeA:
50.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2yxe PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Methanocaldococcus
jannaschii) 		PF01135
(PCMT) 		8 THR A  59
SER A  61
GLY A  87
GLY A 137
THR A 153
ALA A 154
VAL A 205
LEU A 207
 None
 0.66A 1jg4A-2yxeA:
35.3		 1jg4A-2yxeA:
50.21
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.
2z2z TK-SUBTILISIN
PRECURSOR

(Thermococcus
kodakarensis) 		PF00082
(Peptidase_S8) 		5 SER A 232
GLY A 332
GLY A  89
ALA A 326
VAL A 282
 None
 1.06A 1jg4A-2z2zA:
2.0		 1jg4A-2z2zA:
19.12
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.
3beu TRYPSIN

(Streptomyces
griseus) 		PF00089
(Trypsin) 		5 GLY A  69
GLY A  44
THR A  67
ALA A  66
VAL A  83
 None
 1.06A 1jg4A-3beuA:
undetectable		 1jg4A-3beuA:
20.15
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.
3d43 SPHERICASE

(Lysinibacillus
sphaericus) 		PF00082
(Peptidase_S8) 		5 SER A 137
GLY A 258
GLY A   9
ALA A 252
VAL A 189
 None
 1.05A 1jg4A-3d43A:
undetectable		 1jg4A-3d43A:
21.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3es5 PUTATIVE CAPSID
PROTEIN

(Penicillium
stoloniferum
virus F) 		no annotation 5 GLN A 356
VAL A 358
GLY A 354
GLY A 168
VAL A  73
 None
 1.10A 1jg4A-3es5A:
undetectable		 1jg4A-3es5A:
20.71
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.
3f7m ALKALINE SERINE
PROTEASE VER112

(Lecanicillium
psalliotae) 		PF00082
(Peptidase_S8) 		5 SER A 234
GLY A 336
GLY A 113
ALA A 330
VAL A 284
 None
 1.08A 1jg4A-3f7mA:
undetectable		 1jg4A-3f7mA:
20.34
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.
3gcw PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF00082
(Peptidase_S8) 		5 GLN A 387
THR A 385
GLY A 365
GLY A 240
ALA A 390
 None
 1.11A 1jg4A-3gcwA:
undetectable		 1jg4A-3gcwA:
16.29
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.
3ggg PREPHENATE
DEHYDROGENASE

(Aquifex
aeolicus) 		no annotation 5 VAL D  36
SER D  98
GLY D  60
GLY D  75
ALA D  46
 None
 1.08A 1jg4A-3gggD:
3.1		 1jg4A-3gggD:
24.44
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.
3i3l ALKYLHALIDASE CMLS

(Streptomyces
venezuelae) 		PF04820
(Trp_halogenase) 		5 THR A 154
VAL A 153
SER A 152
GLY A 168
THR A 132
 None
None
None
FAD  A 600 ( 4.7A)
None
 1.10A 1jg4A-3i3lA:
2.7		 1jg4A-3i3lA:
15.77
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.
3iuk UNCHARACTERIZED
PROTEIN

(Paenarthrobacter
aurescens) 		PF05960
(DUF885) 		5 GLY A 547
ASN A 545
GLY A 390
THR A 397
ALA A 396
 None
 0.98A 1jg4A-3iukA:
undetectable		 1jg4A-3iukA:
16.25
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.
3k7u ANTIBODY

(Lama glama) 		PF07686
(V-set) 		5 GLN A 101
GLY A 102
GLY A  35
THR A 106
ALA A 107
 None
 1.07A 1jg4A-3k7uA:
undetectable		 1jg4A-3k7uA:
20.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3lbf PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Escherichia
coli) 		PF01135
(PCMT) 		9 GLN A  56
THR A  57
SER A  59
GLY A  85
GLY A 132
THR A 148
ALA A 149
VAL A 200
LEU A 202
 SAH  A 300 (-3.8A)
None
None
SAH  A 300 (-3.4A)
SAH  A 300 (-3.6A)
SAH  A 300 (-3.3A)
SAH  A 300 ( 3.7A)
None
SAH  A 300 (-4.2A)
 0.58A 1jg4A-3lbfA:
33.2		 1jg4A-3lbfA:
36.56
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.
3lv4 GLYCOSIDE HYDROLASE
YXIA

(Bacillus
licheniformis) 		PF04616
(Glyco_hydro_43)
PF16369
(GH43_C) 		5 GLY A 196
ASN A 172
GLY A 214
VAL A 189
LEU A 200
 None
 0.91A 1jg4A-3lv4A:
undetectable		 1jg4A-3lv4A:
20.83
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.
3mem PUTATIVE SIGNAL
TRANSDUCTION PROTEIN

(Marinobacter
hydrocarbonoclasticus) 		PF04073
(tRNA_edit)
PF08668
(HDOD) 		5 THR A 355
SER A 344
GLY A 317
GLY A 311
LEU A 396
 None
 1.06A 1jg4A-3memA:
undetectable		 1jg4A-3memA:
18.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mwg IRON-REGULATED ABC
TRANSPORTER
SIDEROPHORE-BINDING
PROTEIN SIRA

(Staphylococcus
aureus) 		PF01497
(Peripla_BP_2) 		5 GLN A  61
GLY A  62
THR A  58
ALA A  77
VAL A  78
 None
 0.99A 1jg4A-3mwgA:
undetectable		 1jg4A-3mwgA:
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.
3n2t PUTATIVE
OXIDOREDUCTASE

(Gluconobacter
oxydans) 		PF00248
(Aldo_ket_red) 		5 THR A  22
GLY A 158
THR A  83
ALA A  82
LEU A 126
 None
 1.11A 1jg4A-3n2tA:
undetectable		 1jg4A-3n2tA:
20.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qp9 TYPE I POLYKETIDE
SYNTHASE PIKAII

(Streptomyces
venezuelae) 		PF08659
(KR) 		5 VAL A 418
SER A 417
GLY A 392
THR A 398
ALA A 399
 None
 1.10A 1jg4A-3qp9A:
3.1		 1jg4A-3qp9A:
18.44
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.
3u4y UNCHARACTERIZED
PROTEIN

(Desulfotomaculum
acetoxidans) 		PF10282
(Lactonase) 		5 VAL A  11
GLY A 315
ASN A 313
GLY A 100
VAL A  53
 None
 1.12A 1jg4A-3u4yA:
undetectable		 1jg4A-3u4yA:
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.
3ww8 PIZZA3 PROTEIN

(-) 		PF08450
(SGL) 		5 VAL A  60
GLY A 101
ASN A  16
GLY A 116
VAL A  78
 None
None
None
SO4  A 201 (-3.1A)
None
 1.14A 1jg4A-3ww8A:
undetectable		 1jg4A-3ww8A:
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.
3wwa PIZZA7H PROTEIN

(-) 		PF01436
(NHL)
PF08450
(SGL) 		5 VAL A 102
GLY A 143
ASN A  58
GLY A 158
VAL A 120
 None
 1.03A 1jg4A-3wwaA:
undetectable		 1jg4A-3wwaA:
18.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wwa PIZZA7H PROTEIN

(-) 		PF01436
(NHL)
PF08450
(SGL) 		5 VAL A 228
GLY A  17
ASN A 184
GLY A  32
VAL A 246
 None
 1.13A 1jg4A-3wwaA:
undetectable		 1jg4A-3wwaA:
18.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a73 L-LACTATE
DEHYDROGENASE

(Thermus
thermophilus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 VAL A 148
ASN A 116
GLY A  33
THR A 139
ALA A 138
 None
 1.13A 1jg4A-4a73A:
3.6		 1jg4A-4a73A:
20.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4amc GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		5 ASN A1543
GLY A1603
THR A1525
ALA A1524
VAL A1523
 None
 1.12A 1jg4A-4amcA:
undetectable		 1jg4A-4amcA:
13.54
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.
4axs CARBAMATE KINASE

(Mycoplasma
penetrans) 		PF00696
(AA_kinase) 		5 THR A 229
GLY A 187
ALA A   7
VAL A 227
LEU A 213
 SO4  A1312 (-3.4A)
None
None
None
None
 1.13A 1jg4A-4axsA:
3.0		 1jg4A-4axsA:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b8w GDP-L-FUCOSE
SYNTHASE

(Homo sapiens) 		PF01370
(Epimerase) 		5 THR A  13
VAL A  12
TRP A  38
ALA A 101
VAL A  97
 None
 1.11A 1jg4A-4b8wA:
undetectable		 1jg4A-4b8wA:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cot EXTRACELLULAR
ENDO-ALPHA-(1->5)-L-
ARABINANASE 2

(Bacillus
subtilis) 		PF04616
(Glyco_hydro_43)
PF16369
(GH43_C) 		5 GLY A 192
ASN A 168
GLY A 210
VAL A 185
LEU A 196
 None
 0.90A 1jg4A-4cotA:
undetectable		 1jg4A-4cotA:
19.49
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.
4dz3 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Burkholderia
pseudomallei) 		PF00254
(FKBP_C) 		5 GLY A  77
GLY A  69
ALA A  23
VAL A 113
LEU A  57
 None
 1.12A 1jg4A-4dz3A:
undetectable		 1jg4A-4dz3A:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ftw PHOSPHOLIPASE/CARBOX
YLESTERASE

(Rhodobacter
sphaeroides) 		PF02230
(Abhydrolase_2) 		5 VAL A 242
GLY A 240
GLY A 184
VAL A 257
LEU A 262
 None
 1.07A 1jg4A-4ftwA:
undetectable		 1jg4A-4ftwA:
21.77
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.
4g3n DNA GYRASE SUBUNIT A

(Mycobacterium
tuberculosis) 		PF03989
(DNA_gyraseA_C) 		5 THR A 627
VAL A 660
GLY A 647
ALA A 650
VAL A 651
 None
 1.13A 1jg4A-4g3nA:
undetectable		 1jg4A-4g3nA:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hsu LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1B

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM)
PF07496
(zf-CW) 		5 GLY A 776
ASN A 562
GLY A 655
ALA A 796
LEU A 629
 None
 1.10A 1jg4A-4hsuA:
undetectable		 1jg4A-4hsuA:
15.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k0e HEAVY METAL CATION
TRICOMPONENT EFFLUX
PUMP ZNEA(CZCA-LIKE)

(Cupriavidus
metallidurans) 		PF00873
(ACR_tran) 		5 GLN A 281
VAL A 594
GLY A 272
THR A 611
ALA A 612
 None
 1.07A 1jg4A-4k0eA:
undetectable		 1jg4A-4k0eA:
12.00
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.
4kc8 GLYCOSIDE HYDROLASE,
FAMILY 43

(Thermotoga
petrophila) 		PF04616
(Glyco_hydro_43)
PF16369
(GH43_C) 		5 GLY A 191
ASN A 167
GLY A 209
VAL A 184
LEU A 195
 None
 0.94A 1jg4A-4kc8A:
undetectable		 1jg4A-4kc8A:
19.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4l7v PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Vibrio cholerae) 		PF01135
(PCMT) 		6 GLY A  85
GLY A 132
THR A 148
ALA A 149
VAL A 200
LEU A 202
 SAH  A 301 (-3.5A)
SAH  A 301 (-3.4A)
SAH  A 301 (-3.4A)
SAH  A 301 ( 4.1A)
None
SAH  A 301 (-4.3A)
 0.38A 1jg4A-4l7vA:
28.0		 1jg4A-4l7vA:
36.21
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.
4ldp NDP-FOROSAMYLTRANSFE
RASE

(Saccharopolyspora
spinosa) 		PF06722
(DUF1205) 		5 ASN A 230
GLY A 332
THR A 339
ALA A 340
VAL A 345
 None
 1.06A 1jg4A-4ldpA:
2.9		 1jg4A-4ldpA:
19.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ln1 L-LACTATE
DEHYDROGENASE 1

(Bacillus cereus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 THR A 129
ASN A  98
GLY A  12
THR A 122
ALA A 121
 None
 1.12A 1jg4A-4ln1A:
4.1		 1jg4A-4ln1A:
22.45
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.
4nef AQUAPORIN-2

(Homo sapiens) 		PF00230
(MIP) 		5 VAL A  90
GLY A  51
THR A  20
ALA A  19
LEU A  55
 None
 1.08A 1jg4A-4nefA:
undetectable		 1jg4A-4nefA:
22.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4o29 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Pyrobaculum
aerophilum) 		PF01135
(PCMT) 		8 THR A  54
SER A  56
GLY A  82
GLY A 133
THR A 149
ALA A 150
VAL A 202
LEU A 204
 None
SAH  A 500 (-3.1A)
SAH  A 500 (-3.3A)
SAH  A 500 (-3.2A)
SAH  A 500 (-3.3A)
SAH  A 500 ( 4.5A)
None
SAH  A 500 (-4.3A)
 0.48A 1jg4A-4o29A:
33.2		 1jg4A-4o29A:
47.56
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.
4pfb C4-DICARBOXYLATE-BIN
DING PROTEIN

(Fusobacterium
nucleatum) 		PF03480
(DctP) 		5 VAL A  44
GLY A  89
THR A  31
VAL A  29
LEU A  86
 None
 1.03A 1jg4A-4pfbA:
undetectable		 1jg4A-4pfbA:
22.10
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.
4qa8 PUTATIVE LIPOPROTEIN
LPRF

(Mycobacterium
bovis) 		PF07161
(LppX_LprAFG) 		6 THR A 134
VAL A 141
SER A 142
GLY A 104
THR A 131
ALA A 146
 PJZ  A 301 ( 4.4A)
None
None
None
None
None
 1.38A 1jg4A-4qa8A:
undetectable		 1jg4A-4qa8A:
23.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qme AMINOPEPTIDASE N

(Neisseria
meningitidis) 		PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C) 		5 THR A 211
ASN A 265
GLY A 286
ALA A 222
VAL A 219
 None
 1.11A 1jg4A-4qmeA:
undetectable		 1jg4A-4qmeA:
13.51
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.
4qme AMINOPEPTIDASE N

(Neisseria
meningitidis) 		PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C) 		5 VAL A 249
ASN A 265
GLY A 286
ALA A 222
VAL A 219
 None
 0.94A 1jg4A-4qmeA:
undetectable		 1jg4A-4qmeA:
13.51
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.
4qyr AT-LESS POLYKETIDE
SYNTHASE

(Streptomyces
platensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 VAL A2661
SER A2662
GLY A2737
ASN A2739
GLY A2900
 None
 0.88A 1jg4A-4qyrA:
undetectable		 1jg4A-4qyrA:
17.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4weo PUTATIVE
ACETOIN(DIACETYL)
REDUCTASE

(Burkholderia
cenocepacia) 		PF00106
(adh_short) 		5 VAL A  75
GLY A 122
GLY A  93
THR A  13
VAL A  63
 None
 1.12A 1jg4A-4weoA:
4.5		 1jg4A-4weoA:
23.26
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.
4zg5 5'-NUCLEOTIDASE SURE

(Brucella
abortus) 		no annotation 5 GLN D  39
GLY D 105
GLY D  15
THR D   6
ALA D  34
 None
 1.12A 1jg4A-4zg5D:
undetectable		 1jg4A-4zg5D:
25.09
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.
4zlg PUTATIVE B-GLYCAN
PHOSPHORYLASE

(Saccharophagus
degradans) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		5 GLN A 332
THR A 694
ASN A 340
GLY A 308
VAL A 697
 None
SO4  A 805 (-3.7A)
None
None
None
 0.96A 1jg4A-4zlgA:
undetectable		 1jg4A-4zlgA:
14.77
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.
4zrs ESTERASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 THR A 225
VAL A 226
SER A 227
GLY A 182
GLY A  75
 None
None
None
SEB  A 151 ( 3.7A)
SEB  A 151 ( 3.8A)
 1.04A 1jg4A-4zrsA:
undetectable		 1jg4A-4zrsA:
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.
5but KTR SYSTEM POTASSIUM
UPTAKE PROTEIN B

(Bacillus
subtilis) 		PF02386
(TrkH) 		5 THR I  61
VAL I 391
GLY I 177
GLY I  69
ALA I  64
 None
K  I 501 (-4.9A)
K  I 501 ( 4.3A)
None
None
 1.02A 1jg4A-5butI:
undetectable		 1jg4A-5butI:
18.72
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.
5e3c DIPEPTIDYL PEPTIDASE
3

(Homo sapiens) 		PF03571
(Peptidase_M49) 		5 SER A  38
GLY A 330
ALA A 333
VAL A 378
LEU A 376
 None
 1.05A 1jg4A-5e3cA:
undetectable		 1jg4A-5e3cA:
15.01
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.
5g3p FORMAMIDASE

(Bacillus cereus) 		PF00795
(CN_hydrolase) 		5 GLN A  35
THR A  63
SER A 102
GLY A  65
GLY A 221
 None
 1.09A 1jg4A-5g3pA:
undetectable		 1jg4A-5g3pA:
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.
5gvh ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[FMN]

(Thermotoga
maritima) 		PF03060
(NMO) 		5 SER A 199
GLY A 193
GLY A  44
ALA A  31
VAL A  34
 None
FMN  A 402 (-3.4A)
None
None
None
 1.12A 1jg4A-5gvhA:
undetectable		 1jg4A-5gvhA:
22.36
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.
5jta NEUTRAL TREHALASE

(Saccharomyces
cerevisiae) 		no annotation 5 GLY A 308
ASN A 348
GLY A 300
ALA A 297
LEU A 197
 None
 1.11A 1jg4A-5jtaA:
undetectable		 1jg4A-5jtaA:
15.58
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.
5l2r FUMARATE HYDRATASE

(Leishmania
major) 		PF05681
(Fumerase)
PF05683
(Fumerase_C) 		5 GLN A 316
GLY A 314
GLY A  97
ALA A 115
VAL A 114
 None
 1.12A 1jg4A-5l2rA:
undetectable		 1jg4A-5l2rA:
17.99
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.
5lq8 PUTATIVE PHOSPHONATE
BINDING PROTEIN FOR
ABC TRANSPORTER

(Prochlorococcus
marinus) 		no annotation 5 GLN A  74
THR A  75
SER A  78
GLY A 267
LEU A  66
 None
 1.14A 1jg4A-5lq8A:
undetectable		 1jg4A-5lq8A:
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.
5n6m APOLIPOPROTEIN
N-ACYLTRANSFERASE

(Pseudomonas
aeruginosa) 		PF00795
(CN_hydrolase) 		5 VAL A 404
SER A 405
GLY A 450
ALA A 423
VAL A 385
 None
 1.00A 1jg4A-5n6mA:
undetectable		 1jg4A-5n6mA:
18.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5thm ESTERASE-6

(Drosophila
melanogaster) 		PF00135
(COesterase) 		5 THR A  86
VAL A  87
SER A  88
GLY A 109
ALA A 115
 None
None
None
7BZ  A 601 (-3.0A)
None
 1.09A 1jg4A-5thmA:
undetectable		 1jg4A-5thmA:
17.79
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.
5v8t UBIQUITIN-LIKE
PROTEIN
SMT3,PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Saccharomyces
cerevisiae;
Burkholderia
pseudomallei) 		no annotation 5 GLY A  77
GLY A  69
ALA A  23
VAL A 113
LEU A  57
 None
 1.12A 1jg4A-5v8tA:
undetectable		 1jg4A-5v8tA:
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.
5xeq NEUROLIGIN-2

(Homo sapiens) 		PF00135
(COesterase) 		5 VAL A 507
GLY A 509
GLY A  64
ALA A 202
VAL A 209
 None
 1.12A 1jg4A-5xeqA:
undetectable		 1jg4A-5xeqA:
16.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xez GLUCAGON
RECEPTOR,ENDOLYSIN,G
LUCAGON RECEPTOR

(Homo sapiens;
Escherichia
virus T4) 		PF00002
(7tm_2)
PF00959
(Phage_lysozyme)
PF02793
(HRM) 		5 GLY A 359
GLY A 246
ALA A 314
VAL A 311
LEU A 243
 None
 1.11A 1jg4A-5xezA:
undetectable		 1jg4A-5xezA:
16.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yem CATALASE

(Mycothermus
thermophilus) 		no annotation 5 VAL A 263
GLY A 266
GLY A 128
THR A 132
ALA A 133
 None
 1.13A 1jg4A-5yemA:
2.4		 1jg4A-5yemA:
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.
6c7s PUTATIVE RIFAMPIN
MONOOXYGENASE

(Nocardia
farcinica) 		no annotation 5 GLY A 292
ASN A 298
ALA A 327
VAL A 330
LEU A 262
 None
 1.02A 1jg4A-6c7sA:
2.7		 1jg4A-6c7sA:
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.
6fhw GLUCOAMYLASE P

(Amorphotheca
resinae) 		no annotation 5 SER A 484
GLY A 196
GLY A 228
ALA A 245
VAL A 248
 None
 1.09A 1jg4A-6fhwA:
undetectable		 1jg4A-6fhwA:
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.
6g2j NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
5

(Mus musculus) 		no annotation 5 GLN L 309
THR L 306
GLY L 311
THR L 288
ALA L 289
 None
 1.13A 1jg4A-6g2jL:
undetectable		 1jg4A-6g2jL:
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.
1ad3 ALDEHYDE
DEHYDROGENASE (CLASS
3)

(Rattus
norvegicus) 		PF00171
(Aldedh) 		4 GLU A 140
GLY A 167
ILE A   3
LEU A 175
 NAD  A 600 (-2.5A)
None
None
None
 0.91A 1jg4A-1ad3A:
5.2		 1jg4A-1ad3A:
20.26
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.
1dl5 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Thermotoga
maritima) 		PF01135
(PCMT) 		4 GLU A  81
GLY A  83
GLU A 107
ASP A 134
 SAH  A 699 (-3.4A)
SAH  A 699 (-3.2A)
SAH  A 699 (-2.9A)
SAH  A 699 (-3.5A)
 0.32A 1jg4A-1dl5A:
28.4		 1jg4A-1dl5A:
27.98
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.
1f8r L-AMINO ACID OXIDASE

(Calloselasma
rhodostoma) 		PF01593
(Amino_oxidase) 		4 GLY A  87
ARG A  71
ILE A 430
ASP A 423
 FAD  A 527 (-3.9A)
FAD  A 527 (-4.0A)
FAD  A 527 (-4.7A)
None
 0.79A 1jg4A-1f8rA:
2.7		 1jg4A-1f8rA:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1i9g HYPOTHETICAL PROTEIN
RV2118C

(Mycobacterium
tuberculosis) 		PF08704
(GCD14)
PF14801
(GCD14_N) 		4 GLU A 105
GLY A 107
GLU A 131
ASP A 161
 None
SAM  A 301 (-2.7A)
SAM  A 301 (-2.6A)
SAM  A 301 (-3.4A)
 0.47A 1jg4A-1i9gA:
13.5		 1jg4A-1i9gA:
23.10
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.
1ig0 THIAMIN
PYROPHOSPHOKINASE

(Saccharomyces
cerevisiae) 		PF04263
(TPK_catalytic)
PF04265
(TPK_B1_binding) 		4 GLY A 191
ILE A  43
LEU A 189
ASP A 126
 None
 0.93A 1jg4A-1ig0A:
undetectable		 1jg4A-1ig0A:
21.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jg3 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Pyrococcus
furiosus) 		PF01135
(PCMT) 		8 GLU A  97
GLY A  99
SER A 102
GLU A 121
ARG A 122
ILE A 123
LEU A 126
ASP A 148
 None
ADN  A 500 (-3.2A)
None
ADN  A 500 (-2.9A)
None
ADN  A 500 (-4.6A)
ADN  A 500 (-4.2A)
ADN  A 500 (-3.7A)
 0.15A 1jg4A-1jg3A:
41.2		 1jg4A-1jg3A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1kr5 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Homo sapiens) 		PF01135
(PCMT) 		5 GLY A  85
SER A  88
ILE A 111
LEU A 114
ASP A 141
 SAH  A 300 (-3.5A)
SAH  A 300 (-2.6A)
SAH  A 300 ( 4.9A)
SAH  A 300 (-4.7A)
SAH  A 300 (-3.7A)
 0.42A 1jg4A-1kr5A:
31.7		 1jg4A-1kr5A:
35.66
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.
1kzh PHOSPHOFRUCTOKINASE

(Borreliella
burgdorferi) 		PF00365
(PFK) 		4 GLY A 109
SER A 143
ILE A 173
LEU A  79
 None
 0.90A 1jg4A-1kzhA:
undetectable		 1jg4A-1kzhA:
18.35
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.
1nsv GALACTOSE MUTAROTASE

(Lactococcus
lactis) 		PF01263
(Aldose_epim) 		4 GLU A 222
GLY A 187
SER A 266
LEU A 175
 None
 0.74A 1jg4A-1nsvA:
undetectable		 1jg4A-1nsvA:
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.
1o54 SAM-DEPENDENT
O-METHYLTRANSFERASE

(Thermotoga
maritima) 		PF08704
(GCD14) 		4 GLY A 108
SER A 111
GLU A 132
ASP A 160
 None
CL  A 266 ( 4.4A)
None
None
 0.75A 1jg4A-1o54A:
13.4		 1jg4A-1o54A:
24.83
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.
1oru YUAD PROTEIN

(Bacillus
subtilis) 		no annotation 4 GLY A 124
SER A 110
ILE A 163
LEU A 121
 None
 0.91A 1jg4A-1oruA:
undetectable		 1jg4A-1oruA:
24.69
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.
1qs0 2-OXOISOVALERATE
DEHYDROGENASE
BETA-SUBUNIT

(Pseudomonas
putida) 		PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 GLY B 229
SER B 134
LEU B 173
ASP B 155
 None
 0.93A 1jg4A-1qs0B:
undetectable		 1jg4A-1qs0B:
22.58
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.
1qyr HIGH LEVEL
KASUGAMYCIN
RESISTANCE PROTEIN

(Escherichia
coli) 		PF00398
(RrnaAD) 		5 GLU A  43
GLY A  45
GLU A  66
LEU A  71
ASP A  91
 None
 0.62A 1jg4A-1qyrA:
9.4		 1jg4A-1qyrA:
20.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1r18 PROTEIN-L-ISOASPARTA
TE(D-ASPARTATE)-O-ME
THYLTRANSFERASE

(Drosophila
melanogaster) 		PF01135
(PCMT) 		5 GLY A  86
SER A  89
GLU A 115
LEU A 120
ASP A 147
 SAH  A 300 (-3.4A)
SAH  A 300 (-2.5A)
SAH  A 300 (-2.9A)
SAH  A 300 (-4.7A)
SAH  A 300 (-3.6A)
 0.23A 1jg4A-1r18A:
28.0		 1jg4A-1r18A:
36.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sp0 CYTOCHROME C OXIDASE
ASSEMBLY PROTEIN
CTAG

(Sinorhizobium
meliloti) 		PF04442
(CtaG_Cox11) 		4 GLY A  61
ARG A  59
LEU A  29
ASP A  57
 None
 0.79A 1jg4A-1sp0A:
undetectable		 1jg4A-1sp0A:
19.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sr8 COBALAMIN
BIOSYNTHESIS PROTEIN
(CBID)

(Archaeoglobus
fulgidus) 		PF01888
(CbiD) 		4 GLY A  94
ARG A  40
ILE A  31
LEU A  38
 None
 0.73A 1jg4A-1sr8A:
undetectable		 1jg4A-1sr8A:
24.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1vbf 231AA LONG
HYPOTHETICAL
PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF01135
(PCMT) 		4 GLU A  76
GLY A  78
GLU A  99
ASP A 124
 None
 0.31A 1jg4A-1vbfA:
27.8		 1jg4A-1vbfA:
31.78
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.
1wx4 TYROSINASE

(Streptomyces
castaneoglobisporus) 		PF00264
(Tyrosinase) 		4 GLY A 199
SER A 206
ILE A 129
ASP A 112
 None
PER  A 409 ( 4.1A)
None
None
 0.92A 1jg4A-1wx4A:
undetectable		 1jg4A-1wx4A:
22.79
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.
1yb2 HYPOTHETICAL PROTEIN
TA0852

(Thermoplasma
acidophilum) 		PF08704
(GCD14) 		5 GLU A  96
GLY A  98
SER A 101
GLU A 122
ASP A 150
 None
 0.96A 1jg4A-1yb2A:
10.1		 1jg4A-1yb2A:
24.31
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.
1zkd DUF185

(Rhodopseudomonas
palustris) 		PF02636
(Methyltransf_28) 		4 GLU A  86
GLY A  88
GLU A 118
LEU A 123
 None
 0.59A 1jg4A-1zkdA:
7.2		 1jg4A-1zkdA:
22.14
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.
1zq9 PROBABLE
DIMETHYLADENOSINE
TRANSFERASE

(Homo sapiens) 		PF00398
(RrnaAD) 		4 GLU A  62
GLY A  64
GLU A  85
LEU A  90
 None
SAM  A4000 (-3.1A)
SAM  A4000 (-2.8A)
SAM  A4000 (-4.8A)
 0.50A 1jg4A-1zq9A:
9.9		 1jg4A-1zq9A:
19.93
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.
1zq9 PROBABLE
DIMETHYLADENOSINE
TRANSFERASE

(Homo sapiens) 		PF00398
(RrnaAD) 		4 GLY A  64
GLU A  85
LEU A  90
ASP A 113
 SAM  A4000 (-3.1A)
SAM  A4000 (-2.8A)
SAM  A4000 (-4.8A)
SAM  A4000 (-3.8A)
 0.48A 1jg4A-1zq9A:
9.9		 1jg4A-1zq9A:
19.93
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.
2b25 HYPOTHETICAL PROTEIN

(Homo sapiens) 		PF08704
(GCD14) 		4 GLU A 109
GLY A 111
GLU A 135
ASP A 173
 None
SAM  A 601 (-2.9A)
SAM  A 601 (-2.9A)
SAM  A 601 (-3.4A)
 0.60A 1jg4A-2b25A:
12.9		 1jg4A-2b25A:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bzn GMP REDUCTASE 2

(Homo sapiens) 		PF00478
(IMPDH) 		4 GLY A  47
ILE A  50
LEU A  72
ASP A 237
 None
 0.84A 1jg4A-2bznA:
undetectable		 1jg4A-2bznA:
24.13
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.
2fca TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Bacillus
subtilis) 		PF02390
(Methyltransf_4) 		4 GLU A  44
GLY A  46
GLU A  69
ASP A  96
 None
K  A 250 (-3.9A)
None
None
 0.79A 1jg4A-2fcaA:
7.1		 1jg4A-2fcaA:
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.
2gnp TRANSCRIPTIONAL
REGULATOR

(Streptococcus
pneumoniae) 		PF04198
(Sugar-bind) 		4 SER A  76
GLU A  65
ILE A  79
ASP A  58
 None
 0.93A 1jg4A-2gnpA:
undetectable		 1jg4A-2gnpA:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gpy O-METHYLTRANSFERASE

(Bacillus
halodurans) 		PF01596
(Methyltransf_3) 		4 GLU A  60
GLY A  62
GLU A  85
ASP A 113
 None
None
None
ZN  A 306 ( 4.7A)
 0.54A 1jg4A-2gpyA:
11.9		 1jg4A-2gpyA:
25.28
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.
2gz3 ASPARTATE
BETA-SEMIALDEHYDE
DEHYDROGENASE

(Streptococcus
pneumoniae) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		4 GLY A 316
ARG A 148
ILE A 150
ASP A 147
 None
 0.73A 1jg4A-2gz3A:
undetectable		 1jg4A-2gz3A:
24.15
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.
2inv INSULIN
FRUCTOTRANSFERASE

(Bacillus sp.
snu-7) 		no annotation 4 GLY A 286
ILE A 259
LEU A 283
ASP A 239
 None
 0.89A 1jg4A-2invA:
undetectable		 1jg4A-2invA:
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.
2l2g IGF2R DOMAIN 11

(Monodelphis
domestica) 		PF00878
(CIMR) 		4 GLY A1580
SER A1595
ILE A1626
LEU A1606
 None
 0.75A 1jg4A-2l2gA:
undetectable		 1jg4A-2l2gA:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2m6p UNCHARACTERIZED
PROTEIN MB2076

(Mycobacterium
bovis) 		PF13397
(RbpA) 		4 GLY A  62
ARG A  33
ILE A  65
LEU A  64
 None
 0.92A 1jg4A-2m6pA:
undetectable		 1jg4A-2m6pA:
13.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2pbf PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE
BETA-ASPARTATE
METHYLTRANSFERASE

(Plasmodium
falciparum) 		PF01135
(PCMT) 		5 GLY A  88
SER A  91
GLU A 116
ARG A 117
LEU A 121
 SAH  A 301 (-3.1A)
SAH  A 301 (-2.8A)
SAH  A 301 (-2.8A)
None
SAH  A 301 ( 4.1A)
 0.19A 1jg4A-2pbfA:
28.5		 1jg4A-2pbfA:
32.66
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.
2qy6 UPF0209 PROTEIN YFCK

(Escherichia
coli) 		PF05430
(Methyltransf_30) 		4 GLU A  84
GLY A  86
GLU A 121
ASP A 176
 None
 0.54A 1jg4A-2qy6A:
6.8		 1jg4A-2qy6A:
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.
2vdu TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE-ASSOCI
ATED WD REPEAT
PROTEIN TRM82

(Saccharomyces
cerevisiae) 		no annotation 4 GLU B 426
SER B 418
ILE B  23
LEU B 420
 None
 0.75A 1jg4A-2vduB:
undetectable		 1jg4A-2vduB:
18.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xlr FLAVIN-CONTAINING
MONOOXYGENASE

(Methylophaga
aminisulfidivorans) 		PF00743
(FMO-like) 		4 SER A 231
ILE A 273
LEU A 206
ASP A 193
 None
 0.71A 1jg4A-2xlrA:
undetectable		 1jg4A-2xlrA:
20.69
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.
2yvl HYPOTHETICAL PROTEIN

(Aquifex
aeolicus) 		PF08704
(GCD14) 		4 GLU A  97
GLY A  99
GLU A 120
ASP A 148
 None
SAM  A 601 (-3.2A)
SAM  A 601 (-2.7A)
SAM  A 601 (-3.1A)
 0.62A 1jg4A-2yvlA:
12.8		 1jg4A-2yvlA:
26.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2yxe PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Methanocaldococcus
jannaschii) 		PF01135
(PCMT) 		7 GLU A  83
GLY A  85
GLU A 109
ARG A 110
ILE A 111
LEU A 114
ASP A 136
 None
 0.41A 1jg4A-2yxeA:
35.3		 1jg4A-2yxeA:
50.21
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.
2zz8 LIPL32 PROTEIN

(Leptospira
interrogans) 		PF12103
(Lipl32) 		4 GLY A  75
SER A 210
ILE A 116
ASP A 148
 None
 0.91A 1jg4A-2zz8A:
undetectable		 1jg4A-2zz8A:
24.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bh1 UPF0371 PROTEIN
DIP2346

(Corynebacterium
diphtheriae) 		PF08903
(DUF1846) 		4 GLY A 107
ARG A 104
LEU A 109
ASP A 101
 None
 0.93A 1jg4A-3bh1A:
undetectable		 1jg4A-3bh1A:
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.
3dn7 CYCLIC NUCLEOTIDE
BINDING REGULATORY
PROTEIN

(Cytophaga
hutchinsonii) 		PF00027
(cNMP_binding) 		4 GLU A 112
ARG A 117
ILE A 118
LEU A 121
 None
 0.81A 1jg4A-3dn7A:
undetectable		 1jg4A-3dn7A:
22.00
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.
3dxx TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Escherichia
coli) 		PF02390
(Methyltransf_4) 		4 GLU A  69
GLY A  71
GLU A  94
ASP A 121
 None
 0.60A 1jg4A-3dxxA:
7.6		 1jg4A-3dxxA:
22.45
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.
3edm SHORT CHAIN
DEHYDROGENASE

(Agrobacterium
fabrum) 		PF13561
(adh_short_C2) 		4 GLU A 214
GLY A 244
SER A 249
LEU A 247
 None
 0.92A 1jg4A-3edmA:
5.4		 1jg4A-3edmA:
24.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fma PROTEIN SMY2

(Saccharomyces
cerevisiae) 		PF02213
(GYF) 		4 GLY A  29
SER A  17
ILE A  51
ASP A  22
 None
 0.92A 1jg4A-3fmaA:
undetectable		 1jg4A-3fmaA:
13.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fut DIMETHYLADENOSINE
TRANSFERASE

(Thermus
thermophilus) 		PF00398
(RrnaAD) 		5 GLU A  52
GLY A  54
GLU A  75
LEU A  80
ASP A  99
 None
 0.65A 1jg4A-3futA:
9.5		 1jg4A-3futA:
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.
3fyd PROBABLE
DIMETHYLADENOSINE
TRANSFERASE

(Methanocaldococcus
jannaschii) 		PF00398
(RrnaAD) 		5 GLU A  36
GLY A  38
GLU A  59
LEU A  64
ASP A  84
 None
 0.58A 1jg4A-3fydA:
11.1		 1jg4A-3fydA:
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.
3gjy SPERMIDINE SYNTHASE

(Corynebacterium
glutamicum) 		no annotation 4 GLY A  94
GLU A 117
LEU A 122
ASP A 144
 None
FMT  A 315 (-3.6A)
FMT  A 315 (-4.0A)
None
 0.61A 1jg4A-3gjyA:
8.8		 1jg4A-3gjyA:
22.16
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.
3gry DIMETHYLADENOSINE
TRANSFERASE

(Methanocaldococcus
jannaschii) 		PF00398
(RrnaAD) 		5 GLU A  36
GLY A  38
GLU A  59
LEU A  64
ASP A  84
 SAM  A 300 (-4.4A)
SAM  A 300 (-3.3A)
SAM  A 300 (-2.8A)
SAM  A 300 (-4.8A)
SAM  A 300 (-3.7A)
 0.58A 1jg4A-3gryA:
10.5		 1jg4A-3gryA:
23.72
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.
3hn6 GLUCOSAMINE-6-PHOSPH
ATE DEAMINASE

(Borreliella
burgdorferi) 		PF01182
(Glucosamine_iso) 		4 GLY A 109
SER A 112
ILE A 159
ASP A  72
 None
 0.84A 1jg4A-3hn6A:
undetectable		 1jg4A-3hn6A:
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.
3hyv SULFIDE-QUINONE
REDUCTASE

(Aquifex
aeolicus) 		PF07992
(Pyr_redox_2) 		4 GLY A 396
ARG A  22
ILE A  71
LEU A  66
 None
 0.91A 1jg4A-3hyvA:
2.1		 1jg4A-3hyvA:
20.95
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.
3jb4 VP0
VP3

(Parechovirus B;
Parechovirus B) 		PF00073
(Rhv)
PF00073
(Rhv) 		4 GLU C  79
SER B 173
ILE C 225
ASP C 105
 None
 0.84A 1jg4A-3jb4C:
undetectable		 1jg4A-3jb4C:
20.80
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.
3kfu GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT A

(Thermus
thermophilus) 		PF01425
(Amidase) 		4 GLU E 322
GLY E 325
GLU E 328
ASP E 310
 None
 0.92A 1jg4A-3kfuE:
undetectable		 1jg4A-3kfuE:
19.87
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.
3kl4 SIGNAL RECOGNITION
54 KDA PROTEIN

(Sulfolobus
solfataricus) 		PF00448
(SRP54)
PF02881
(SRP54_N)
PF02978
(SRP_SPB) 		4 GLU A   3
GLY A   1
ILE A  35
ASP A  29
 None
 0.77A 1jg4A-3kl4A:
undetectable		 1jg4A-3kl4A:
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.
3la4 UREASE

(Canavalia
ensiformis) 		PF00449
(Urease_alpha)
PF00547
(Urease_gamma)
PF00699
(Urease_beta)
PF01979
(Amidohydro_1) 		4 GLY A 488
ILE A 508
LEU A 478
ASP A 513
 None
 0.94A 1jg4A-3la4A:
undetectable		 1jg4A-3la4A:
15.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3lbf PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Escherichia
coli) 		PF01135
(PCMT) 		8 GLU A  81
GLY A  83
SER A  86
GLU A 104
ARG A 105
ILE A 106
LEU A 109
ASP A 131
 SAH  A 300 ( 4.7A)
SAH  A 300 (-3.4A)
SAH  A 300 (-2.5A)
SAH  A 300 (-2.9A)
None
SAH  A 300 (-4.3A)
SAH  A 300 (-4.8A)
SAH  A 300 (-3.7A)
 0.35A 1jg4A-3lbfA:
33.2		 1jg4A-3lbfA:
36.56
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.
3lga SAM-DEPENDENT
METHYLTRANSFERASE

(Pyrococcus
abyssi) 		PF08704
(GCD14)
PF14801
(GCD14_N) 		4 GLU A  99
GLY A 101
GLU A 125
ASP A 153
 SAH  A 301 ( 4.7A)
SAH  A 301 (-3.1A)
SAH  A 301 (-2.8A)
SAH  A 301 (-3.1A)
 0.77A 1jg4A-3lgaA:
14.1		 1jg4A-3lgaA:
25.00
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.
3ntv MW1564 PROTEIN

(Staphylococcus
aureus) 		PF01596
(Methyltransf_3) 		4 GLU A  77
GLY A  79
GLU A 102
ARG A 103
 SO4  A 233 (-4.0A)
None
None
None
 0.72A 1jg4A-3ntvA:
11.5		 1jg4A-3ntvA:
26.34
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.
3ps9 TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC

(Escherichia
coli) 		PF01266
(DAO)
PF05430
(Methyltransf_30) 		4 GLU A  64
GLY A  66
GLU A 101
ASP A 156
 SAM  A 670 (-4.0A)
SAM  A 670 (-3.5A)
SAM  A 670 (-2.6A)
SAM  A 670 (-3.5A)
 0.50A 1jg4A-3ps9A:
5.8		 1jg4A-3ps9A:
14.35
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.
3pvc TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC

(Yersinia pestis) 		PF01266
(DAO)
PF05430
(Methyltransf_30) 		4 GLU A  64
GLY A  66
GLU A 101
ASP A 156
 None
 0.78A 1jg4A-3pvcA:
6.5		 1jg4A-3pvcA:
15.27
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.
3tqi GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG]

(Coxiella
burnetii) 		PF00117
(GATase)
PF00958
(GMP_synt_C)
PF02540
(NAD_synthase) 		4 GLY A  88
ILE A  55
LEU A  83
ASP A  14
 None
 0.92A 1jg4A-3tqiA:
2.4		 1jg4A-3tqiA:
18.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tqs RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A

(Coxiella
burnetii) 		PF00398
(RrnaAD) 		4 GLU A  38
GLY A  40
GLU A  61
LEU A  66
 None
 0.62A 1jg4A-3tqsA:
9.7		 1jg4A-3tqsA:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ulk KETOL-ACID
REDUCTOISOMERASE

(Escherichia
coli) 		PF01450
(IlvC)
PF07991
(IlvN) 		4 GLU A 393
SER A 216
GLU A 221
LEU A 218
 GLU  A 393 (-0.6A)
SER  A 216 ( 0.0A)
GLU  A 221 (-0.6A)
LEU  A 218 ( 0.6A)
 0.86A 1jg4A-3ulkA:
3.6		 1jg4A-3ulkA:
19.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3uzu RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A

(Burkholderia
pseudomallei) 		PF00398
(RrnaAD) 		4 GLU A  44
GLY A  46
GLU A  71
LEU A  76
 None
 0.53A 1jg4A-3uzuA:
8.9		 1jg4A-3uzuA:
19.27
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.
3uzu RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A

(Burkholderia
pseudomallei) 		PF00398
(RrnaAD) 		4 GLU A  44
GLY A  46
LEU A  76
ASP A  94
 None
 0.66A 1jg4A-3uzuA:
8.9		 1jg4A-3uzuA:
19.27
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.
3wgk CELL DIVISION
PROTEIN FTSZ

(Staphylococcus
aureus) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		4 SER A 103
ARG A  29
LEU A 190
ASP A  32
 None
None
GDP  A 400 (-4.9A)
None
 0.86A 1jg4A-3wgkA:
2.4		 1jg4A-3wgkA:
19.44
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.
3x3y PHENYLETHYLAMINE
OXIDASE

(Arthrobacter
globiformis) 		PF01179
(Cu_amine_oxid)
PF02728
(Cu_amine_oxidN3) 		4 GLU A 614
GLY A 615
LEU A 506
ASP A 444
 None
 0.85A 1jg4A-3x3yA:
undetectable		 1jg4A-3x3yA:
16.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cnk L-AMINO ACID OXIDASE

(Streptococcus
cristatus) 		PF03486
(HI0933_like) 		4 GLY A 126
ILE A   8
LEU A  31
ASP A   5
 None
 0.87A 1jg4A-4cnkA:
2.3		 1jg4A-4cnkA:
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.
4e3z PUTATIVE
OXIDOREDUCTASE
PROTEIN

(Rhizobium etli) 		PF13561
(adh_short_C2) 		4 GLY A 190
ARG A 188
ILE A 149
LEU A 150
 None
 0.86A 1jg4A-4e3zA:
4.3		 1jg4A-4e3zA:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4etm LOW MOLECULAR WEIGHT
PROTEIN-TYROSINE-PHO
SPHATASE YFKJ

(Bacillus
subtilis) 		PF01451
(LMWPc) 		4 SER A  39
ILE A  85
LEU A   5
ASP A 113
 K  A 203 (-3.5A)
None
None
None
 0.90A 1jg4A-4etmA:
undetectable		 1jg4A-4etmA:
22.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fd6 ARYLALKYLAMINE
N-ACETYLTRANSFERASE
2

(Aedes aegypti) 		PF00583
(Acetyltransf_1) 		4 GLY A  82
ILE A 135
LEU A  80
ASP A 170
 None
 0.93A 1jg4A-4fd6A:
undetectable		 1jg4A-4fd6A:
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.
4gc5 DIMETHYLADENOSINE
TRANSFERASE 1,
MITOCHONDRIAL

(Mus musculus) 		PF00398
(RrnaAD) 		4 GLU A  61
GLY A  63
GLU A  85
ASP A 111
 None
ACT  A 402 (-3.4A)
ACT  A 402 (-2.9A)
None
 0.53A 1jg4A-4gc5A:
9.2		 1jg4A-4gc5A:
22.16
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.
4h0p ACETATE KINASE

(Cryptococcus
neoformans) 		PF00871
(Acetate_kinase) 		4 GLY A 104
ILE A 111
LEU A 156
ASP A 108
 None
 0.92A 1jg4A-4h0pA:
undetectable		 1jg4A-4h0pA:
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.
4j2k TRYPSIN INHIBITOR

(Enterolobium
contortisiliquum) 		PF00197
(Kunitz_legume) 		4 GLU A 112
SER A  91
ILE A 106
LEU A  93
 None
 0.90A 1jg4A-4j2kA:
undetectable		 1jg4A-4j2kA:
24.58
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.
4koq SINGLE-STRANDED
DNA-BINDING PROTEIN
WHY3, CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF08536
(Whirly) 		4 GLU A 120
GLY A 121
ARG A 103
LEU A 123
 None
 0.74A 1jg4A-4koqA:
undetectable		 1jg4A-4koqA:
22.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4l7v PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Vibrio cholerae) 		PF01135
(PCMT) 		8 GLU A  81
GLY A  83
SER A  86
GLU A 104
ARG A 105
ILE A 106
LEU A 109
ASP A 131
 SAH  A 301 ( 4.6A)
SAH  A 301 (-3.3A)
SAH  A 301 (-2.6A)
SAH  A 301 (-2.7A)
ACT  A 303 ( 2.4A)
SAH  A 301 (-4.3A)
SAH  A 301 (-4.6A)
SAH  A 301 (-4.0A)
 0.43A 1jg4A-4l7vA:
28.0		 1jg4A-4l7vA:
36.21
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.
4m38 PROTEIN ARGININE
N-METHYLTRANSFERASE
7

(Trypanosoma
brucei) 		PF06325
(PrmA) 		5 GLU A 101
GLY A 103
SER A 106
GLU A 125
LEU A 130
 SAH  A 401 (-3.9A)
SAH  A 401 (-3.0A)
SAH  A 401 (-3.3A)
SAH  A 401 (-3.1A)
SAH  A 401 (-4.5A)
 0.24A 1jg4A-4m38A:
10.6		 1jg4A-4m38A:
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.
4mgu STRUCTURAL PROTEIN
VP2

(Orthopteran
ambidensovirus
1) 		PF02336
(Denso_VP4) 		4 SER A  99
ILE A 323
LEU A 255
ASP A  81
 None
 0.80A 1jg4A-4mguA:
undetectable		 1jg4A-4mguA:
19.71
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.
4nru RNA DEPENDENT RNA
POLYMERASE

(Norwalk virus) 		PF00680
(RdRP_1) 		4 GLY A 190
SER A 119
ILE A 160
ASP A 278
 None
 0.84A 1jg4A-4nruA:
undetectable		 1jg4A-4nruA:
19.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4o29 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Pyrobaculum
aerophilum) 		PF01135
(PCMT) 		6 GLU A  78
GLY A  80
SER A  83
GLU A 104
LEU A 109
ASP A 132
 SAH  A 500 (-4.3A)
SAH  A 500 (-3.1A)
SAH  A 500 (-2.9A)
SAH  A 500 (-2.8A)
SAH  A 500 (-3.8A)
SAH  A 500 (-4.0A)
 0.40A 1jg4A-4o29A:
33.2		 1jg4A-4o29A:
47.56
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.
4q3i OSSERK2 D128N

(Oryza sativa) 		PF08263
(LRRNT_2)
PF11921
(DUF3439) 		4 GLU A 174
SER A 126
ILE A 169
LEU A 148
 None
 0.93A 1jg4A-4q3iA:
undetectable		 1jg4A-4q3iA:
21.40
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.
4qi4 CELLOBIOSE
DEHYDROGENASE

(Crassicarpon
hotsonii) 		PF00732
(GMC_oxred_N)
PF00734
(CBM_1)
PF05199
(GMC_oxred_C) 		4 SER A 485
ARG A 445
ILE A 494
LEU A 489
 None
 0.84A 1jg4A-4qi4A:
2.6		 1jg4A-4qi4A:
16.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qi6 CELLOBIOSE
DEHYDROGENASE

(Crassicarpon
hotsonii) 		PF00732
(GMC_oxred_N)
PF00734
(CBM_1)
PF05199
(GMC_oxred_C)
PF16010
(CDH-cyt) 		4 SER A 485
ARG A 445
ILE A 494
LEU A 489
 None
 0.88A 1jg4A-4qi6A:
undetectable		 1jg4A-4qi6A:
14.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qi7 CELLOBIOSE
DEHYDROGENASE

(Neurospora
crassa) 		PF00732
(GMC_oxred_N)
PF00734
(CBM_1)
PF05199
(GMC_oxred_C)
PF16010
(CDH-cyt) 		4 SER A 485
ARG A 445
ILE A 494
LEU A 489
 None
 0.76A 1jg4A-4qi7A:
undetectable		 1jg4A-4qi7A:
14.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4v19 MITORIBOSOMAL
PROTEIN BL28M,
MRPL28

(Sus scrofa) 		PF00830
(Ribosomal_L28) 		4 GLU 1  83
GLY 1  81
ILE 1 135
LEU 1 132
 None
 0.84A 1jg4A-4v191:
undetectable		 1jg4A-4v191:
22.55
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.
5bxy RNA
METHYLTRANSFERASE

(Salinibacter
ruber) 		PF13847
(Methyltransf_31) 		4 GLY A  31
GLU A  53
LEU A  58
ASP A  81
 SAH  A 201 (-3.4A)
SAH  A 201 (-2.8A)
SAH  A 201 (-4.4A)
SAH  A 201 (-3.6A)
 0.32A 1jg4A-5bxyA:
12.0		 1jg4A-5bxyA:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ccx TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
CATALYTIC SUBUNIT
TRMT61A

(Homo sapiens) 		PF08704
(GCD14) 		4 GLU A 109
GLY A 111
GLU A 135
ASP A 163
 None
SAH  A 301 (-3.2A)
SAH  A 301 (-2.2A)
SAH  A 301 (-2.7A)
 0.48A 1jg4A-5ccxA:
14.0		 1jg4A-5ccxA:
22.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5eku ARGININE
N-METHYLTRANSFERASE,
PUTATIVE

(Trypanosoma
brucei) 		PF06325
(PrmA) 		5 GLU A 101
GLY A 103
SER A 106
GLU A 125
LEU A 130
 SAH  A 401 (-3.9A)
SAH  A 401 (-3.0A)
SAH  A 401 (-2.7A)
SAH  A 401 (-2.8A)
SAH  A 401 (-4.2A)
 0.32A 1jg4A-5ekuA:
10.0		 1jg4A-5ekuA:
20.25
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.
5erg TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
CATALYTIC SUBUNIT
TRM61

(Saccharomyces
cerevisiae) 		PF08704
(GCD14) 		5 GLU B 116
GLY B 118
SER B 121
GLU B 139
ASP B 168
 None
SAM  B 401 (-3.4A)
SAM  B 401 (-3.1A)
SAM  B 401 (-2.9A)
SAM  B 401 (-3.5A)
 1.03A 1jg4A-5ergB:
11.5		 1jg4A-5ergB:
21.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gyz LUCIFERIN
4-MONOOXYGENASE

(Photinus
pyralis) 		PF00501
(AMP-binding) 		4 GLY A 324
SER A 293
ILE A 312
ASP A 357
 None
 0.84A 1jg4A-5gyzA:
undetectable		 1jg4A-5gyzA:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5omm CAPSID PROTEIN

(Norwalk virus) 		PF08435
(Calici_coat_C) 		4 GLY A 453
SER A 401
ILE A 446
LEU A 399
 None
 0.92A 1jg4A-5ommA:
undetectable		 1jg4A-5ommA:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5t38 EVDMO1

(Micromonospora
carbonacea) 		PF13847
(Methyltransf_31) 		4 GLU A  60
GLY A  62
GLU A  84
ASP A 111
 None
SAH  A 301 (-3.4A)
SAH  A 301 (-1.8A)
SAH  A 301 (-2.9A)
 0.76A 1jg4A-5t38A:
9.5		 1jg4A-5t38A:
23.64
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.
5tcp LIPOPROTEIN PRGK

(Salmonella
enterica) 		PF01514
(YscJ_FliF) 		4 GLY 0  26
ILE 0  58
LEU 0  24
ASP 0  50
 None
 0.92A 1jg4A-5tcp0:
undetectable		 1jg4A-5tcp0:
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.
5tj3 ALKALINE PHOSPHATASE
PAFA

(Elizabethkingia
meningoseptica) 		PF01663
(Phosphodiest) 		4 GLY A  53
ARG A 327
LEU A 323
ASP A 331
 None
 0.86A 1jg4A-5tj3A:
undetectable		 1jg4A-5tj3A:
18.51
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.
5ts5 AMINE OXIDASE

(Bothrops atrox) 		PF01593
(Amino_oxidase) 		4 GLY A  87
ARG A  71
ILE A 430
ASP A 423
 FAD  A 501 (-3.9A)
FAD  A 501 (-3.9A)
FAD  A 501 (-4.6A)
None
 0.85A 1jg4A-5ts5A:
3.7		 1jg4A-5ts5A:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ukp DH522.1 FAB FRAGMENT
HEAVY CHAIN

(Macaca mulatta) 		no annotation 4 GLY H  55
SER H  70
ILE H  29
ASP H  32
 None
 0.89A 1jg4A-5ukpH:
undetectable		 1jg4A-5ukpH:
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.
5x5h CYSTATHIONINE
BETA-LYASES/CYSTATHI
ONINE
GAMMA-SYNTHASES

(Corynebacterium
glutamicum) 		PF01053
(Cys_Met_Meta_PP) 		4 GLY A 304
SER A 307
ILE A 268
ASP A 263
 None
 0.92A 1jg4A-5x5hA:
undetectable		 1jg4A-5x5hA:
22.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5x7s GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE

(Paenibacillus
sp. 598K) 		PF01055
(Glyco_hydro_31)
PF16338
(DUF4968)
PF16990
(CBM_35)
PF17137
(DUF5110) 		5 GLU A 319
GLY A 318
GLU A 324
ILE A 359
ASP A 390
 MG  A1604 ( 4.3A)
None
None
None
None
 1.38A 1jg4A-5x7sA:
undetectable		 1jg4A-5x7sA:
10.41
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.
5zw4 PUTATIVE
O-METHYLTRANSFERASE
YRRM

(Bacillus
subtilis) 		no annotation 4 GLU A  60
GLY A  62
GLU A  85
ASP A 113
 SAM  A 302 (-3.9A)
SAM  A 302 (-3.4A)
SAM  A 302 (-2.7A)
SAM  A 302 (-3.3A)
 0.35A 1jg4A-5zw4A:
12.6		 1jg4A-5zw4A:
28.52
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.
6bk7 ELONGATION FACTOR G

(Enterococcus
faecalis) 		no annotation 4 GLY A 243
ARG A 245
ILE A 249
ASP A 276
 None
 0.84A 1jg4A-6bk7A:
undetectable		 1jg4A-6bk7A:
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.
6bog RNA
POLYMERASE-ASSOCIATE
D PROTEIN RAPA

(Escherichia
coli) 		no annotation 4 GLU A 375
GLY A 374
LEU A 370
ASP A 381
 None
 0.81A 1jg4A-6bogA:
undetectable		 1jg4A-6bogA:
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.
6cyz HOMOSERINE KINASE

(Mycobacteroides
abscessus) 		no annotation 4 GLU A  59
GLY A  56
SER A  97
ILE A  94
 None
None
ANP  A 401 (-2.8A)
None
 0.86A 1jg4A-6cyzA:
undetectable		 1jg4A-6cyzA:
undetectable