SIMILAR PATTERNS OF AMINO ACIDS FOR 3FHJ_A_TRPA1001

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1d2r PROTEIN
(TRYPTOPHANYL TRNA
SYNTHETASE)

(Geobacillus
stearothermophilus) 		PF00579
(tRNA-synt_1b) 		10 GLY A   7
GLN A   9
VAL A  40
HIS A  43
MET A 129
ASP A 132
ILE A 133
VAL A 141
VAL A 143
GLN A 147
 None
 0.51A 3fhjA-1d2rA:
42.1		 3fhjA-1d2rA:
98.77
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.
1dms DMSO REDUCTASE

(Rhodobacter
capsulatus) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		5 GLY A 699
VAL A 663
ILE A 713
VAL A 689
VAL A 761
 None
 1.17A 3fhjA-1dmsA:
undetectable		 3fhjA-1dmsA:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1eu1 DIMETHYL SULFOXIDE
REDUCTASE

(Rhodobacter
sphaeroides) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		5 GLY A 699
VAL A 663
ILE A 713
VAL A 689
VAL A 761
 None
 1.18A 3fhjA-1eu1A:
undetectable		 3fhjA-1eu1A:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fsu N-ACETYLGALACTOSAMIN
E-4-SULFATASE

(Homo sapiens) 		PF00884
(Sulfatase) 		5 GLY A 308
GLN A 304
ILE A  67
VAL A 270
VAL A 241
 None
 1.33A 3fhjA-1fsuA:
undetectable		 3fhjA-1fsuA:
19.88
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.
1i7o 4-HYDROXYPHENYLACETA
TE DEGRADATION
BIFUNCTIONAL
ISOMERASE/DECARBOXYL
ASE

(Escherichia
coli) 		PF01557
(FAA_hydrolase) 		5 VAL A 372
HIS A 347
ILE A 343
VAL A 415
VAL A 412
 None
 1.27A 3fhjA-1i7oA:
undetectable		 3fhjA-1i7oA:
23.49
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.
1i7q TRPG

(Serratia
marcescens) 		PF00117
(GATase) 		5 GLY B 138
GLN B  89
HIS B 134
VAL B 148
VAL B 159
 None
GLU  B1401 (-3.1A)
None
None
None
 1.34A 3fhjA-1i7qB:
2.3		 3fhjA-1i7qB:
20.30
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.
1j1u TYROSYL-TRNA
SYNTHETASE

(Methanocaldococcus
jannaschii) 		PF00579
(tRNA-synt_1b) 		5 GLY A  34
HIS A  70
ASP A 158
ILE A 159
GLN A 173
 TYR  A 401 (-3.4A)
TYR  A 401 (-3.5A)
TYR  A 401 (-3.5A)
None
TYR  A 401 (-3.0A)
 0.84A 3fhjA-1j1uA:
19.1		 3fhjA-1j1uA:
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.
1ljy MGP-40

(Capra hircus) 		PF00704
(Glyco_hydro_18) 		5 GLN A 293
VAL A 295
HIS A 197
ASP A 308
ILE A 237
 None
 1.31A 3fhjA-1ljyA:
undetectable		 3fhjA-1ljyA:
22.60
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.
1ltd FLAVOCYTOCHROME B2

(Saccharomyces
cerevisiae) 		PF00173
(Cyt-b5)
PF01070
(FMN_dh) 		5 GLY A 410
HIS A 158
ILE A 385
VAL A 408
VAL A 429
 FMN  A 570 (-3.5A)
None
None
None
None
 1.12A 3fhjA-1ltdA:
undetectable		 3fhjA-1ltdA:
22.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mzv ADENINE
PHOSPHORIBOSYLTRANSF
ERASE

(Leishmania
tarentolae) 		PF00156
(Pribosyltran) 		5 GLY A 158
GLN A 160
ILE A 136
VAL A 142
VAL A 169
 None
 1.15A 3fhjA-1mzvA:
undetectable		 3fhjA-1mzvA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qcd ADENINE
PHOSPHORIBOSYLTRANSF
ERASE

(Leishmania
donovani) 		PF00156
(Pribosyltran) 		5 GLY A 158
GLN A 160
ILE A 136
VAL A 142
VAL A 169
 None
 1.22A 3fhjA-1qcdA:
undetectable		 3fhjA-1qcdA:
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.
1qcw FLAVOCYTOCHROME B2

(Saccharomyces
cerevisiae) 		PF01070
(FMN_dh) 		5 GLY A 410
HIS A 158
ILE A 385
VAL A 408
VAL A 429
 FNS  A 570 (-3.5A)
None
None
None
None
 1.15A 3fhjA-1qcwA:
undetectable		 3fhjA-1qcwA:
23.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uc4 DIOL DEHYDRASE BETA
SUBUNIT

(Klebsiella
oxytoca) 		PF02288
(Dehydratase_MU) 		5 GLY B 131
GLN B 133
VAL B 113
ILE B 168
VAL B  91
 None
CNC  B2601 ( 4.7A)
CNC  B2601 (-4.9A)
None
None
 1.23A 3fhjA-1uc4B:
undetectable		 3fhjA-1uc4B:
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.
1us2 ENDO-BETA-1,4-XYLANA
SE

(Cellvibrio
japonicus) 		PF00331
(Glyco_hydro_10)
PF03426
(CBM_15) 		5 GLY A 219
GLN A 217
ILE A 232
VAL A 235
VAL A  97
 None
XYP  A1611 (-3.2A)
None
None
None
 1.31A 3fhjA-1us2A:
undetectable		 3fhjA-1us2A:
20.60
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.
1v0m ENDO-1,4-BETA-XYLANA
SE A

(Streptomyces
lividans) 		PF00331
(Glyco_hydro_10) 		5 GLN A  89
MET A 105
ILE A 109
VAL A 125
VAL A 126
 None
 1.16A 3fhjA-1v0mA:
undetectable		 3fhjA-1v0mA:
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.
1v6u ENDO-1,4-BETA-D-XYLA
NASE

(Streptomyces
olivaceoviridis) 		PF00331
(Glyco_hydro_10)
PF00652
(Ricin_B_lectin) 		5 GLN A  89
MET A 105
ILE A 109
VAL A 125
VAL A 126
 None
 1.18A 3fhjA-1v6uA:
undetectable		 3fhjA-1v6uA:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vkz PHOSPHORIBOSYLAMINE-
-GLYCINE LIGASE

(Thermotoga
maritima) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		5 GLY A 221
VAL A 320
HIS A 365
ASP A 318
VAL A 202
 None
 1.31A 3fhjA-1vkzA:
2.2		 3fhjA-1vkzA:
21.62
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.
1vlc 3-ISOPROPYLMALATE
DEHYDROGENASE

(Thermotoga
maritima) 		PF00180
(Iso_dh) 		5 GLY A 343
GLN A 341
ILE A 289
VAL A 316
VAL A 319
 None
 1.01A 3fhjA-1vlcA:
undetectable		 3fhjA-1vlcA:
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.
1vp8 HYPOTHETICAL PROTEIN
AF0103

(Archaeoglobus
fulgidus) 		PF02887
(PK_C) 		5 GLY A 142
HIS A 169
ILE A 144
VAL A  58
VAL A  90
 None
 1.29A 3fhjA-1vp8A:
undetectable		 3fhjA-1vp8A:
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.
1vp8 HYPOTHETICAL PROTEIN
AF0103

(Archaeoglobus
fulgidus) 		PF02887
(PK_C) 		5 GLY A 142
HIS A 169
ILE A 144
VAL A  90
GLN A  92
 None
 1.18A 3fhjA-1vp8A:
undetectable		 3fhjA-1vp8A:
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.
1xfg GLUCOSAMINE--FRUCTOS
E-6-PHOSPHATE
AMINOTRANSFERASE
[ISOMERIZING]

(Escherichia
coli) 		PF13522
(GATase_6) 		5 GLY A  68
VAL A  12
ILE A 189
VAL A 159
VAL A  96
 None
 1.00A 3fhjA-1xfgA:
undetectable		 3fhjA-1xfgA:
24.07
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.
1yb2 HYPOTHETICAL PROTEIN
TA0852

(Thermoplasma
acidophilum) 		PF08704
(GCD14) 		5 GLN A 158
MET A 180
ILE A 177
VAL A  97
VAL A 121
 None
 1.26A 3fhjA-1yb2A:
2.0		 3fhjA-1yb2A:
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.
2cyb TYROSYL-TRNA
SYNTHETASE

(Archaeoglobus
fulgidus) 		PF00579
(tRNA-synt_1b) 		5 GLY A  38
HIS A  74
ASP A 165
ILE A 166
GLN A 180
 None
 0.74A 3fhjA-2cybA:
20.5		 3fhjA-2cybA:
24.80
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.
2cyc TYROSYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF00579
(tRNA-synt_1b) 		5 GLY A  39
HIS A  76
ASP A 175
ILE A 176
GLN A 190
 TYR  A 701 (-3.4A)
TYR  A 701 (-3.7A)
TYR  A 701 (-3.4A)
None
TYR  A 701 (-3.3A)
 1.01A 3fhjA-2cycA:
19.2		 3fhjA-2cycA:
25.06
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.
2e32 F-BOX ONLY PROTEIN 2

(Mus musculus) 		PF00646
(F-box)
PF04300
(FBA) 		5 VAL A 288
HIS A 272
ASP A 209
ILE A 254
VAL A 243
 None
 1.19A 3fhjA-2e32A:
undetectable		 3fhjA-2e32A:
24.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2el7 TRYPTOPHANYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00579
(tRNA-synt_1b) 		5 GLY A   7
GLN A   9
VAL A  42
ILE A 137
VAL A 147
 None
 0.97A 3fhjA-2el7A:
32.1		 3fhjA-2el7A:
41.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2el7 TRYPTOPHANYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00579
(tRNA-synt_1b) 		5 GLY A   7
GLN A   9
VAL A  42
VAL A 147
GLN A 151
 None
 1.07A 3fhjA-2el7A:
32.1		 3fhjA-2el7A:
41.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2el7 TRYPTOPHANYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00579
(tRNA-synt_1b) 		5 GLY A   7
VAL A  42
HIS A  45
VAL A 147
GLN A 151
 None
 1.36A 3fhjA-2el7A:
32.1		 3fhjA-2el7A:
41.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2el7 TRYPTOPHANYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00579
(tRNA-synt_1b) 		5 GLY A   7
VAL A  42
ILE A 137
VAL A 145
VAL A 147
 None
 0.60A 3fhjA-2el7A:
32.1		 3fhjA-2el7A:
41.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2el7 TRYPTOPHANYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00579
(tRNA-synt_1b) 		5 GLY A   7
VAL A  42
VAL A 145
VAL A 147
GLN A 151
 None
 0.93A 3fhjA-2el7A:
32.1		 3fhjA-2el7A:
41.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2el7 TRYPTOPHANYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00579
(tRNA-synt_1b) 		5 VAL A  42
ASP A 136
ILE A 137
VAL A 145
VAL A 147
 None
 0.82A 3fhjA-2el7A:
32.1		 3fhjA-2el7A:
41.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2g36 TRYPTOPHANYL-TRNA
SYNTHETASE

(Thermotoga
maritima) 		PF00579
(tRNA-synt_1b) 		7 GLY A   6
HIS A  43
ASP A 136
ILE A 137
VAL A 145
VAL A 147
GLN A 151
 TRP  A 401 (-4.1A)
TRP  A 401 (-3.9A)
TRP  A 401 (-3.8A)
TRP  A 401 (-4.9A)
TRP  A 401 (-4.7A)
None
TRP  A 401 (-3.5A)
 0.61A 3fhjA-2g36A:
32.7		 3fhjA-2g36A:
37.99
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.
2iik 3-KETOACYL-COA
THIOLASE,
PEROXISOMAL

(Homo sapiens) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 GLY A 126
GLN A 128
ILE A 286
VAL A 388
VAL A 406
 None
 1.33A 3fhjA-2iikA:
undetectable		 3fhjA-2iikA:
23.63
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.
2ipf (3(17)ALPHA-HYDROXYS
TEROID
DEHYDROGENASE)

(Mus musculus) 		PF00248
(Aldo_ket_red) 		5 GLY A  20
ILE A  16
VAL A 266
VAL A 214
GLN A 190
 None
None
None
None
NAP  A   1 (-3.8A)
 1.13A 3fhjA-2ipfA:
undetectable		 3fhjA-2ipfA:
22.91
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.
2j23 THIOREDOXIN

(Malassezia
sympodialis) 		PF00085
(Thioredoxin) 		5 VAL A  89
ASP A  87
ILE A  86
VAL A  20
VAL A  52
 None
 1.21A 3fhjA-2j23A:
undetectable		 3fhjA-2j23A:
16.92
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.
2j6h GLUCOSAMINE-FRUCTOSE
-6-PHOSPHATE
AMINOTRANSFERASE

(Escherichia
coli) 		PF01380
(SIS)
PF13522
(GATase_6) 		5 GLY A  68
VAL A  12
ILE A 189
VAL A 159
VAL A  96
 None
 1.06A 3fhjA-2j6hA:
undetectable		 3fhjA-2j6hA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2prf PROFILIN IA

(Acanthamoeba
sp.) 		PF00235
(Profilin) 		5 GLY A 107
GLN A 105
ILE A  87
VAL A 113
VAL A 112
 None
 1.31A 3fhjA-2prfA:
undetectable		 3fhjA-2prfA:
19.63
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.
2vn1 70 KDA
PEPTIDYLPROLYL
ISOMERASE

(Plasmodium
falciparum) 		PF00254
(FKBP_C) 		5 VAL A  74
ASP A  79
ILE A  80
VAL A  18
VAL A  93
 FK5  A 501 (-3.5A)
None
None
None
None
 1.07A 3fhjA-2vn1A:
undetectable		 3fhjA-2vn1A:
22.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xqy ENVELOPE
GLYCOPROTEIN H

(Suid
alphaherpesvirus
1) 		PF02489
(Herpes_glycop_H)
PF17488
(Herpes_glycoH_C) 		5 GLY A 274
VAL A 163
ILE A 186
VAL A 237
VAL A 279
 None
 1.27A 3fhjA-2xqyA:
undetectable		 3fhjA-2xqyA:
19.83
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.
2xzo REGULATOR OF
NONSENSE TRANSCRIPTS
1

(Homo sapiens) 		PF04851
(ResIII)
PF13086
(AAA_11)
PF13087
(AAA_12) 		5 GLY A 661
GLN A 665
ASP A 636
ILE A 635
GLN A 640
 None
ALF  A1005 (-3.0A)
MG  A1006 ( 4.0A)
None
None
 1.36A 3fhjA-2xzoA:
undetectable		 3fhjA-2xzoA:
19.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2yy5 TRYPTOPHANYL-TRNA
SYNTHETASE

(Mycoplasma
pneumoniae) 		PF00579
(tRNA-synt_1b) 		9 GLY A   8
GLN A  10
HIS A  44
MET A 137
ASP A 140
ILE A 141
VAL A 149
VAL A 151
GLN A 155
 WSA  A1350 (-3.7A)
WSA  A1350 (-3.6A)
WSA  A1350 (-3.5A)
WSA  A1350 (-3.9A)
WSA  A1350 (-4.1A)
WSA  A1350 ( 4.9A)
None
WSA  A1350 ( 3.7A)
SO4  A1363 ( 3.2A)
 0.52A 3fhjA-2yy5A:
35.6		 3fhjA-2yy5A:
40.29
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.
3a05 TRYPTOPHANYL-TRNA
SYNTHETASE

(Aeropyrum
pernix) 		PF00579
(tRNA-synt_1b) 		6 GLY A  76
ASP A 195
ILE A 196
VAL A 212
VAL A 214
GLN A 218
 TRP  A 377 (-3.6A)
TRP  A 377 (-3.6A)
None
None
None
None
 1.16A 3fhjA-3a05A:
2.6		 3fhjA-3a05A:
25.36
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.
3b0b CENTROMERE PROTEIN S
CENTROMERE PROTEIN X

(Gallus gallus;
Gallus gallus) 		no annotation
PF09415
(CENP-X) 		5 GLN C  56
VAL B  37
ILE B  47
VAL C  68
VAL C  71
 None
 1.21A 3fhjA-3b0bC:
undetectable		 3fhjA-3b0bC:
14.38
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.
3edm SHORT CHAIN
DEHYDROGENASE

(Agrobacterium
fabrum) 		PF13561
(adh_short_C2) 		5 GLY A  15
ASP A  17
ILE A  18
VAL A  91
VAL A  11
 None
 1.15A 3fhjA-3edmA:
undetectable		 3fhjA-3edmA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fbk REGULATOR OF
G-PROTEIN SIGNALING
3

(Homo sapiens) 		PF00168
(C2) 		5 GLY A  55
GLN A  36
ILE A  52
VAL A  70
VAL A 118
 None
 1.32A 3fhjA-3fbkA:
undetectable		 3fhjA-3fbkA:
19.76
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.
3h0g DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1

(Schizosaccharomyces
pombe) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		5 GLY A1068
HIS A1373
VAL A 856
VAL A 862
GLN A 871
 None
 1.03A 3fhjA-3h0gA:
undetectable		 3fhjA-3h0gA:
12.60
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.
3hm7 ALLANTOINASE

(Bacillus
halodurans) 		PF01979
(Amidohydro_1) 		5 GLY A 257
ILE A 252
VAL A 262
VAL A 260
GLN A 232
 None
 1.13A 3fhjA-3hm7A:
undetectable		 3fhjA-3hm7A:
20.49
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.
3loq UNIVERSAL STRESS
PROTEIN

(Archaeoglobus
fulgidus) 		PF00582
(Usp) 		5 GLY A 124
VAL A 241
ASP A 128
ILE A  94
VAL A 133
 None
 1.35A 3fhjA-3loqA:
2.4		 3fhjA-3loqA:
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.
3lpe PUTATIVE
TRANSCRIPTION
ANTITERMINATION
PROTEIN NUSG

(Methanocaldococcus
jannaschii) 		PF03439
(Spt5-NGN) 		5 GLN A  11
MET A  60
ILE A  57
VAL A   5
VAL A  43
 None
 1.23A 3fhjA-3lpeA:
undetectable		 3fhjA-3lpeA:
15.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3m5w TRYPTOPHANYL-TRNA
SYNTHETASE

(Campylobacter
jejuni) 		PF00579
(tRNA-synt_1b) 		8 GLY A   6
HIS A  42
MET A 128
ASP A 131
ILE A 132
VAL A 140
VAL A 142
GLN A 146
 None
 0.57A 3fhjA-3m5wA:
32.8		 3fhjA-3m5wA:
39.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3n9i TRYPTOPHANYL-TRNA
SYNTHETASE

(Yersinia pestis) 		PF00579
(tRNA-synt_1b) 		5 GLN A  23
MET A 144
ILE A 148
VAL A 158
GLN A 162
 None
GOL  A1001 (-3.9A)
None
None
None
 0.93A 3fhjA-3n9iA:
39.0		 3fhjA-3n9iA:
54.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3n9i TRYPTOPHANYL-TRNA
SYNTHETASE

(Yersinia pestis) 		PF00579
(tRNA-synt_1b) 		9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
MET A 144
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
GOL  A1001 (-3.9A)
None
None
None
 0.41A 3fhjA-3n9iA:
39.0		 3fhjA-3n9iA:
54.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3n9i TRYPTOPHANYL-TRNA
SYNTHETASE

(Yersinia pestis) 		PF00579
(tRNA-synt_1b) 		5 GLY A  21
VAL A  54
HIS A  57
MET A 144
VAL A 156
 GOL  A1001 (-3.6A)
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
 1.22A 3fhjA-3n9iA:
39.0		 3fhjA-3n9iA:
54.62
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.
3pa7 70 KDA
PEPTIDYLPROLYL
ISOMERASE, PUTATIVE

(Plasmodium
vivax) 		PF00254
(FKBP_C) 		5 VAL A  73
ASP A  78
ILE A  79
VAL A  17
VAL A  92
 None
 0.99A 3fhjA-3pa7A:
undetectable		 3fhjA-3pa7A:
17.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ppc 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE

(Candida
albicans) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		5 GLY A  54
GLN A  51
ASP A  56
VAL A 370
GLN A  50
 None
 1.23A 3fhjA-3ppcA:
undetectable		 3fhjA-3ppcA:
18.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3prh TRYPTOPHANYL-TRNA
SYNTHETASE

(Bacillus
subtilis) 		PF00579
(tRNA-synt_1b) 		9 GLY A   8
GLN A  10
VAL A  41
HIS A  44
MET A 130
ASP A 133
ILE A 134
VAL A 142
GLN A 148
 None
 0.52A 3fhjA-3prhA:
40.3		 3fhjA-3prhA:
69.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3prh TRYPTOPHANYL-TRNA
SYNTHETASE

(Bacillus
subtilis) 		PF00579
(tRNA-synt_1b) 		6 GLY A   8
VAL A  41
HIS A  44
MET A 130
ASP A 133
VAL A 142
 None
 1.06A 3fhjA-3prhA:
40.3		 3fhjA-3prhA:
69.34
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.
3qi6 CYSTATHIONINE
GAMMA-SYNTHASE METB
(CGS)

(Mycobacterium
ulcerans) 		PF01053
(Cys_Met_Meta_PP) 		5 VAL A 298
ASP A 165
ILE A 169
VAL A 153
VAL A 182
 None
 1.31A 3fhjA-3qi6A:
undetectable		 3fhjA-3qi6A:
22.25
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.
3suc PRENECK APPENDAGE
PROTEIN

(Bacillus virus
phi29) 		PF11962
(Peptidase_G2)
PF12708
(Pectate_lyase_3) 		5 GLY A 469
GLN A 437
ILE A 489
VAL A 496
VAL A 472
 None
 1.04A 3fhjA-3sucA:
undetectable		 3fhjA-3sucA:
17.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3sz3 TRYPTOPHANYL-TRNA
SYNTHETASE

(Vibrio cholerae) 		PF00579
(tRNA-synt_1b) 		6 GLN A  11
VAL A  42
MET A 132
ASP A 135
ILE A 136
VAL A 146
 TRP  A 401 (-3.2A)
TRP  A 401 (-4.7A)
TRP  A 401 (-4.0A)
TRP  A 401 (-4.0A)
None
None
 0.91A 3fhjA-3sz3A:
38.3		 3fhjA-3sz3A:
52.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3sz3 TRYPTOPHANYL-TRNA
SYNTHETASE

(Vibrio cholerae) 		PF00579
(tRNA-synt_1b) 		7 GLY A   9
VAL A  42
MET A 132
ASP A 135
ILE A 136
VAL A 144
VAL A 146
 TRP  A 401 (-3.8A)
TRP  A 401 (-4.7A)
TRP  A 401 (-4.0A)
TRP  A 401 (-4.0A)
None
TRP  A 401 (-4.9A)
None
 0.54A 3fhjA-3sz3A:
38.3		 3fhjA-3sz3A:
52.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3sz3 TRYPTOPHANYL-TRNA
SYNTHETASE

(Vibrio cholerae) 		PF00579
(tRNA-synt_1b) 		7 VAL A  42
MET A 132
ASP A 135
ILE A 136
VAL A 144
VAL A 146
GLN A 150
 TRP  A 401 (-4.7A)
TRP  A 401 (-4.0A)
TRP  A 401 (-4.0A)
None
TRP  A 401 (-4.9A)
None
TRP  A 401 (-3.8A)
 1.04A 3fhjA-3sz3A:
38.3		 3fhjA-3sz3A:
52.37
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.
3sze SERINE PROTEASE ESPP

(Escherichia
coli) 		PF02395
(Peptidase_S6) 		5 GLY A 431
VAL A 167
ILE A 446
VAL A 455
VAL A 435
 None
 1.05A 3fhjA-3szeA:
undetectable		 3fhjA-3szeA:
14.52
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.
3t1i DOUBLE-STRAND BREAK
REPAIR PROTEIN
MRE11A

(Homo sapiens) 		PF00149
(Metallophos)
PF04152
(Mre11_DNA_bind) 		5 GLY A 267
GLN A 265
ASP A  20
ILE A  21
VAL A 284
 None
None
MN  A 412 (-3.1A)
None
None
 1.36A 3fhjA-3t1iA:
undetectable		 3fhjA-3t1iA:
22.08
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.
3u0f BETA-KETOACYL
SYNTHASE

(Brucella
abortus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLN A 406
ASP A 291
ILE A 290
VAL A 401
VAL A 256
 None
 0.92A 3fhjA-3u0fA:
undetectable		 3fhjA-3u0fA:
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.
3vex O-CARBAMOYLTRANSFERA
SE TOBZ

(Streptoalloteichus
tenebrarius) 		PF02543
(Carbam_trans_N)
PF16861
(Carbam_trans_C) 		5 GLY A 309
HIS A 114
ASP A 338
ILE A 339
VAL A 335
 CA0  A 602 ( 4.0A)
FE2  A 601 ( 3.4A)
CA0  A 602 ( 2.8A)
None
None
 1.20A 3fhjA-3vexA:
undetectable		 3fhjA-3vexA:
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.
3we7 PUTATIVE
UNCHARACTERIZED
PROTEIN PH0499

(Pyrococcus
horikoshii) 		PF02585
(PIG-L) 		5 VAL A 204
MET A  52
ILE A  56
VAL A  66
VAL A  38
 None
 1.08A 3fhjA-3we7A:
3.0		 3fhjA-3we7A:
22.29
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.
3wl4 UNCHARACTERIZED
PROTEIN

(Pyrococcus
furiosus) 		PF02585
(PIG-L) 		5 VAL A 199
MET A  48
ILE A  52
VAL A  62
VAL A  34
 None
 1.09A 3fhjA-3wl4A:
4.6		 3fhjA-3wl4A:
23.30
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.
3wvl 10 KDA CHAPERONIN

(Escherichia
coli) 		PF00166
(Cpn10) 		5 VAL O  73
ASP O  90
ILE O  91
VAL O  65
VAL O  40
 None
 1.30A 3fhjA-3wvlO:
undetectable		 3fhjA-3wvlO:
16.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zyv AOX3

(Mus musculus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		5 GLY A1265
GLN A1045
ASP A1196
VAL A1159
VAL A1012
 MTE  A3003 ( 4.2A)
MTE  A3003 (-4.1A)
None
None
None
 1.35A 3fhjA-3zyvA:
undetectable		 3fhjA-3zyvA:
13.11
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.
4ay1 CHITINASE-3-LIKE
PROTEIN 2

(Homo sapiens) 		PF00704
(Glyco_hydro_18) 		5 GLN A 322
VAL A 324
HIS A 226
ASP A 337
ILE A 266
 None
 1.29A 3fhjA-4ay1A:
undetectable		 3fhjA-4ay1A:
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.
4b5m PUTATIVE
EXODEOXYRIBONUCLEASE

(Neisseria
meningitidis) 		PF03372
(Exo_endo_phos) 		5 ASP A  30
ILE A  31
VAL A 105
VAL A 145
GLN A 223
 None
 1.19A 3fhjA-4b5mA:
undetectable		 3fhjA-4b5mA:
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.
4buj ANTIVIRAL HELICASE
SKI2

(Saccharomyces
cerevisiae) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF08148
(DSHCT) 		5 GLY A 762
GLN A 759
ILE A 510
VAL A 775
VAL A 736
 None
 1.36A 3fhjA-4bujA:
undetectable		 3fhjA-4bujA:
16.33
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.
4cnk L-AMINO ACID OXIDASE

(Streptococcus
cristatus) 		PF03486
(HI0933_like) 		5 GLY A 174
ASP A 178
ILE A 179
VAL A 160
VAL A 363
 None
None
GOL  A1401 (-3.9A)
None
None
 1.19A 3fhjA-4cnkA:
undetectable		 3fhjA-4cnkA:
23.67
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.
4ew6 D-GALACTOSE-1-DEHYDR
OGENASE PROTEIN

(Rhizobium etli) 		PF01408
(GFO_IDH_MocA) 		5 GLY A 165
GLN A 160
ASP A 168
ILE A 171
VAL A 291
 None
 1.31A 3fhjA-4ew6A:
undetectable		 3fhjA-4ew6A:
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.
4gis ENOLASE

(Vibrio harveyi) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLY A 355
VAL A 123
HIS A 335
ILE A 353
GLN A 145
 None
 1.24A 3fhjA-4gisA:
undetectable		 3fhjA-4gisA:
21.73
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.
4h3s GLUTAMINE-TRNA
LIGASE

(Saccharomyces
cerevisiae) 		PF00749
(tRNA-synt_1c)
PF03950
(tRNA-synt_1c_C)
PF04557
(tRNA_synt_1c_R2) 		5 GLN A 637
ASP A 620
ILE A 616
VAL A 579
VAL A 666
 None
 1.20A 3fhjA-4h3sA:
6.2		 3fhjA-4h3sA:
16.08
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.
4hxy PLM1

(Streptomyces
sp. HK803) 		PF08659
(KR) 		5 VAL A 243
MET A 253
ILE A 257
VAL A 267
VAL A 270
 None
 1.26A 3fhjA-4hxyA:
undetectable		 3fhjA-4hxyA:
21.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jip GTN REDUCTASE

(Agrobacterium
tumefaciens) 		PF00724
(Oxidored_FMN) 		5 GLY A  62
GLN A  60
ASP A 159
ILE A 156
VAL A 117
 None
 1.15A 3fhjA-4jipA:
undetectable		 3fhjA-4jipA:
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.
4kru AUTOLYTIC LYSOZYME

(Clostridium
phage phiSM101) 		PF01183
(Glyco_hydro_25) 		5 GLY A 190
MET A 193
ASP A 192
ILE A  12
VAL A 187
 None
None
NDG  A 501 (-4.0A)
None
None
 1.36A 3fhjA-4kruA:
undetectable		 3fhjA-4kruA:
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.
4l3a INTERNALIN K

(Listeria
monocytogenes) 		no annotation 5 VAL A 377
ASP A 385
ILE A 386
VAL A 431
VAL A 414
 None
 1.20A 3fhjA-4l3aA:
undetectable		 3fhjA-4l3aA:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oko RAPID ENCYSTMENT
PHENOTYPE PROTEIN 34
KDA

(Francisella
tularensis) 		PF00246
(Peptidase_M14) 		5 GLY A  83
VAL A  85
HIS A 171
ASP A 169
ILE A 168
 None
None
ZN  A 401 (-3.1A)
None
None
 1.34A 3fhjA-4okoA:
undetectable		 3fhjA-4okoA:
21.29
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.
4qiw DNA-DIRECTED RNA
POLYMERASE
DNA-DIRECTED RNA
POLYMERASE SUBUNIT
A''

(Thermococcus
kodakarensis;
Thermococcus
kodakarensis) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4)
PF04998
(RNA_pol_Rpb1_5) 		5 GLY C  65
HIS C 304
VAL A 854
VAL A 860
GLN A 869
 None
 1.11A 3fhjA-4qiwC:
undetectable		 3fhjA-4qiwC:
24.28
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.
4qiw DNA-DIRECTED RNA
POLYMERASE
DNA-DIRECTED RNA
POLYMERASE SUBUNIT
A''

(Thermococcus
kodakarensis;
Thermococcus
kodakarensis) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4)
PF04998
(RNA_pol_Rpb1_5) 		5 HIS C 304
ILE C  58
VAL A 854
VAL A 860
GLN A 869
 None
 1.23A 3fhjA-4qiwC:
undetectable		 3fhjA-4qiwC:
24.28
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.
4r72 ABC-TYPE FE3+
TRANSPORT SYSTEM,
PERIPLASMIC
COMPONENT

(Actinobacillus
pleuropneumoniae) 		PF13343
(SBP_bac_6) 		5 GLN A  83
ASP A 250
VAL A 233
VAL A 102
GLN A 258
 None
 1.25A 3fhjA-4r72A:
undetectable		 3fhjA-4r72A:
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.
4xox 3-OXOACYL-ACP
SYNTHASE

(Vibrio cholerae) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLN A 402
ASP A 290
ILE A 289
VAL A 397
VAL A 256
 None
 0.94A 3fhjA-4xoxA:
undetectable		 3fhjA-4xoxA:
23.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dan 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE

(Thermotoga
maritima) 		PF00248
(Aldo_ket_red) 		5 GLY A  17
ILE A  13
VAL A 240
VAL A 196
GLN A 169
 None
None
None
None
NAP  A 301 (-3.8A)
 1.18A 3fhjA-5danA:
undetectable		 3fhjA-5danA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dly PLANTAZOLICIN
METHYLTRANSFERASE
BAML

(Bacillus
velezensis) 		PF13847
(Methyltransf_31) 		5 GLY A  89
ASP A  66
ILE A  67
VAL A 121
GLN A 125
 None
SAH  A 301 ( 4.7A)
None
None
None
 1.37A 3fhjA-5dlyA:
undetectable		 3fhjA-5dlyA:
21.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00579
(tRNA-synt_1b) 		9 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.60A 3fhjA-5ekdA:
36.2		 3fhjA-5ekdA:
40.62
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.
5ey5 LBCA-B

(synthetic
construct) 		PF00291
(PALP) 		5 GLY B 278
GLN B  11
VAL B  13
ILE B 167
VAL B 189
 None
 1.20A 3fhjA-5ey5B:
undetectable		 3fhjA-5ey5B:
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.
5iy9 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1

(Homo sapiens) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		5 GLY A1088
HIS A1397
VAL A 873
VAL A 879
GLN A 888
 None
 1.03A 3fhjA-5iy9A:
undetectable		 3fhjA-5iy9A:
10.43
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.
5o9i TRANSCRIPTION
INITIATION FACTOR
IIB,TRANSCRIPTION
INITIATION FACTOR
IIB

(Methanocaldococcus
vulcanius) 		no annotation 5 VAL A   2
HIS A  93
ASP A 170
VAL A  65
VAL A  51
 None
 1.38A 3fhjA-5o9iA:
undetectable		 3fhjA-5o9iA:
19.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5tev TRYPTOPHAN--TRNA
LIGASE

(Neisseria
gonorrhoeae) 		PF00579
(tRNA-synt_1b) 		7 GLY A   9
HIS A  47
MET A 142
ASP A 145
ILE A 146
VAL A 154
VAL A 156
 None
 0.41A 3fhjA-5tevA:
32.7		 3fhjA-5tevA:
33.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5tev TRYPTOPHAN--TRNA
LIGASE

(Neisseria
gonorrhoeae) 		PF00579
(tRNA-synt_1b) 		5 GLY A   9
ILE A 146
VAL A 154
VAL A 156
GLN A 160
 None
 1.08A 3fhjA-5tevA:
32.7		 3fhjA-5tevA:
33.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5v0i TRYPTOPHAN--TRNA
LIGASE

(Escherichia
coli) 		PF00579
(tRNA-synt_1b) 		10 GLY A   9
GLN A  11
VAL A  42
HIS A  45
MET A 132
ASP A 135
ILE A 136
VAL A 144
VAL A 146
GLN A 150
 TRP  A 402 (-3.7A)
TRP  A 402 (-4.2A)
TRP  A 402 (-4.7A)
TRP  A 402 (-3.6A)
TRP  A 402 (-3.5A)
TRP  A 402 (-3.9A)
None
None
None
TRP  A 402 (-3.1A)
 0.45A 3fhjA-5v0iA:
40.0		 3fhjA-5v0iA:
56.89
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.
5x2o TASTE RECEPTOR, TYPE
1, MEMBER 3

(Oryzias latipes) 		PF01094
(ANF_receptor) 		5 GLY B 225
GLN B 227
VAL B 272
VAL B 214
GLN B 243
 None
 1.29A 3fhjA-5x2oB:
undetectable		 3fhjA-5x2oB:
20.91
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.
5xyi GUANINE
NUCLEOTIDE-BINDING
PROTEIN BETA
SUBUNIT, PUTATIVE

(Trichomonas
vaginalis) 		no annotation 5 GLY g 127
VAL g 125
HIS g 121
ILE g 138
VAL g 184
 None
 1.35A 3fhjA-5xyig:
undetectable		 3fhjA-5xyig:
22.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6dfu TRYPTOPHAN--TRNA
LIGASE

(Haemophilus
influenzae) 		no annotation 10 GLY A   9
GLN A  11
VAL A  42
HIS A  45
MET A 132
ASP A 135
ILE A 136
VAL A 144
VAL A 146
GLN A 150
 TRP  A 501 (-3.5A)
TRP  A 501 (-4.2A)
TRP  A 501 ( 4.6A)
TRP  A 501 (-4.0A)
TRP  A 501 (-3.5A)
TRP  A 501 (-3.9A)
None
None
None
TRP  A 501 (-3.3A)
 0.78A 3fhjA-6dfuA:
40.2		 3fhjA-6dfuA:
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.
6emk SERINE/THREONINE-PRO
TEIN KINASE TOR2

(Saccharomyces
cerevisiae) 		no annotation 5 GLN A2106
ASP A2296
ILE A2295
VAL A2179
VAL A2124
 None
 1.07A 3fhjA-6emkA:
undetectable		 3fhjA-6emkA:
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.
6fht BACTERIOPHYTOCHROME,
ADENYLATE CYCLASE

(Synechocystis
sp. PCC 6803;
Deinococcus
radiodurans) 		no annotation 5 GLY A 616
GLN A 620
MET A 576
ILE A 580
VAL A 597
 None
 1.33A 3fhjA-6fhtA:
undetectable		 3fhjA-6fhtA:
undetectable