SIMILAR PATTERNS OF AMINO ACIDS FOR 3FI0_E_TRPE1001

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.
1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A

(Corynebacterium
sp.) 		PF00248
(Aldo_ket_red) 		4 GLY A  18
ILE A  14
VAL A 228
GLN A 161
 None
None
None
NDP  A 300 (-3.3A)
 0.87A 3fi0E-1a80A:
undetectable		 3fi0E-1a80A:
26.61
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.
1c3l SUBTILISIN-CARLSBERG

(Bacillus
licheniformis) 		PF00082
(Peptidase_S8) 		4 GLY A 229
ILE A  11
VAL A 270
GLN A  17
 None
 0.87A 3fi0E-1c3lA:
undetectable		 3fi0E-1c3lA:
21.47
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) 		7 GLY A   7
VAL A  40
HIS A  43
ASP A 132
ILE A 133
VAL A 141
GLN A 147
 None
 0.42A 3fi0E-1d2rA:
39.9		 3fi0E-1d2rA:
98.77
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) 		4 GLY A   7
VAL A  40
HIS A  43
VAL A 143
 None
 0.84A 3fi0E-1d2rA:
39.9		 3fi0E-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.
1j1u TYROSYL-TRNA
SYNTHETASE

(Methanocaldococcus
jannaschii) 		PF00579
(tRNA-synt_1b) 		4 GLY A  34
HIS A  70
ASP A 158
ILE A 159
 TYR  A 401 (-3.4A)
TYR  A 401 (-3.5A)
TYR  A 401 (-3.5A)
None
 0.60A 3fi0E-1j1uA:
17.1		 3fi0E-1j1uA:
24.93
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.
1j1u TYROSYL-TRNA
SYNTHETASE

(Methanocaldococcus
jannaschii) 		PF00579
(tRNA-synt_1b) 		4 HIS A  70
ASP A 158
ILE A 159
GLN A 173
 TYR  A 401 (-3.5A)
TYR  A 401 (-3.5A)
None
TYR  A 401 (-3.0A)
 0.42A 3fi0E-1j1uA:
17.1		 3fi0E-1j1uA:
24.93
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.
1nbw GLYCEROL DEHYDRATASE
REACTIVASE ALPHA
SUBUNIT

(Klebsiella
pneumoniae) 		PF08841
(DDR) 		4 GLY A 351
ILE A  98
VAL A 187
GLN A 192
 None
 0.86A 3fi0E-1nbwA:
undetectable		 3fi0E-1nbwA:
19.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ntg TYROSYL-TRNA
SYNTHETASE

(Homo sapiens) 		PF01588
(tRNA_bind) 		4 GLY A 106
ASP A  35
ILE A  34
VAL A  64
 None
 0.81A 3fi0E-1ntgA:
undetectable		 3fi0E-1ntgA:
19.94
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		4 GLY A1042
ILE A1056
VAL A1048
GLN A 501
 None
 0.86A 3fi0E-1ofeA:
undetectable		 3fi0E-1ofeA:
13.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pxy FIMBRIN-LIKE PROTEIN

(Arabidopsis
thaliana) 		PF00307
(CH) 		4 GLY A 406
VAL A 213
ILE A 402
VAL A 427
 None
 0.84A 3fi0E-1pxyA:
undetectable		 3fi0E-1pxyA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1q5m PROSTAGLANDIN-E2
9-REDUCTASE

(Oryctolagus
cuniculus) 		PF00248
(Aldo_ket_red) 		4 GLY A  20
ILE A  16
VAL A 266
GLN A 190
 None
None
None
NDP  A1003 (-3.7A)
 0.68A 3fi0E-1q5mA:
undetectable		 3fi0E-1q5mA:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rp0 THIAZOLE
BIOSYNTHETIC ENZYME

(Arabidopsis
thaliana) 		PF01946
(Thi4) 		4 GLY A 257
VAL A  91
VAL A 226
GLN A 264
 None
 0.82A 3fi0E-1rp0A:
undetectable		 3fi0E-1rp0A:
21.87
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.
1wp5 TOPOISOMERASE IV

(Geobacillus
stearothermophilus) 		PF03989
(DNA_gyraseA_C) 		4 GLY A 251
ILE A 261
VAL A 210
GLN A 200
 None
 0.84A 3fi0E-1wp5A:
undetectable		 3fi0E-1wp5A:
23.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2a4m TRYPTOPHANYL-TRNA
SYNTHETASE II

(Deinococcus
radiodurans) 		PF00579
(tRNA-synt_1b) 		4 ASP A 157
ILE A 158
VAL A 166
GLN A 172
 None
 0.69A 3fi0E-2a4mA:
31.6		 3fi0E-2a4mA:
31.67
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.
2az3 NUCLEOSIDE
DIPHOSPHATE KINASE

(Halobacterium
salinarum) 		PF00334
(NDK) 		4 GLY A  20
ASP A  24
ILE A  25
VAL A  12
 None
 0.75A 3fi0E-2az3A:
undetectable		 3fi0E-2az3A:
20.99
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.
2cya TYROSYL-TRNA
SYNTHETASE

(Aeropyrum
pernix) 		PF00579
(tRNA-synt_1b) 		4 GLY A  41
HIS A  77
ASP A 172
ILE A 173
 None
 0.45A 3fi0E-2cyaA:
19.7		 3fi0E-2cyaA:
25.77
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.
2cyb TYROSYL-TRNA
SYNTHETASE

(Archaeoglobus
fulgidus) 		PF00579
(tRNA-synt_1b) 		4 GLY A  38
HIS A  74
ASP A 165
ILE A 166
 None
 0.56A 3fi0E-2cybA:
19.4		 3fi0E-2cybA:
24.66
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.
2cyb TYROSYL-TRNA
SYNTHETASE

(Archaeoglobus
fulgidus) 		PF00579
(tRNA-synt_1b) 		4 HIS A  74
ASP A 165
ILE A 166
GLN A 180
 None
 0.46A 3fi0E-2cybA:
19.4		 3fi0E-2cybA:
24.66
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.
2cyc TYROSYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF00579
(tRNA-synt_1b) 		4 GLY A  39
HIS A  76
ASP A 175
ILE A 176
 TYR  A 701 (-3.4A)
TYR  A 701 (-3.7A)
TYR  A 701 (-3.4A)
None
 0.87A 3fi0E-2cycA:
18.1		 3fi0E-2cycA:
25.18
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) 		4 GLY A   7
VAL A  42
ILE A 137
VAL A 145
 None
 0.54A 3fi0E-2el7A:
31.3		 3fi0E-2el7A:
40.86
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) 		4 GLY A   7
VAL A  42
VAL A 145
GLN A 151
 None
 0.85A 3fi0E-2el7A:
31.3		 3fi0E-2el7A:
40.86
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) 		4 VAL A  42
ASP A 136
ILE A 137
VAL A 145
 None
 0.79A 3fi0E-2el7A:
31.3		 3fi0E-2el7A:
40.86
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) 		6 GLY A   6
HIS A  43
ASP A 136
ILE A 137
VAL A 145
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)
TRP  A 401 (-3.5A)
 0.59A 3fi0E-2g36A:
31.9		 3fi0E-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.
2gk1 BETA-HEXOSAMINIDASE
SUBUNIT BETA CHAIN B

(Homo sapiens) 		no annotation 4 GLY M 171
ASP M 196
ILE M 194
GLN M 177
 None
 0.88A 3fi0E-2gk1M:
undetectable		 3fi0E-2gk1M:
20.66
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.
2hwk HELICASE NSP2

(Venezuelan
equine
encephalitis
virus) 		PF01707
(Peptidase_C9) 		4 GLY A 525
VAL A 602
ILE A 597
VAL A 582
 None
 0.78A 3fi0E-2hwkA:
undetectable		 3fi0E-2hwkA:
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.
2ipf (3(17)ALPHA-HYDROXYS
TEROID
DEHYDROGENASE)

(Mus musculus) 		PF00248
(Aldo_ket_red) 		4 GLY A  20
ILE A  16
VAL A 266
GLN A 190
 None
None
None
NAP  A   1 (-3.8A)
 0.60A 3fi0E-2ipfA:
undetectable		 3fi0E-2ipfA:
23.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vdc GLUTAMATE SYNTHASE
[NADPH] LARGE CHAIN

(Azospirillum
brasilense) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		4 GLY A  74
VAL A  76
ILE A  97
VAL A 133
 None
 0.89A 3fi0E-2vdcA:
undetectable		 3fi0E-2vdcA:
11.74
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.
2vdc GLUTAMATE SYNTHASE
[NADPH] LARGE CHAIN

(Azospirillum
brasilense) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		4 GLY A1007
ILE A1021
VAL A1013
GLN A 505
 None
 0.85A 3fi0E-2vdcA:
undetectable		 3fi0E-2vdcA:
11.74
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.
2vp3 VP39

(Vaccinia virus) 		PF01358
(PARP_regulatory) 		4 GLY A  96
HIS A  99
ILE A  67
VAL A 116
 SAH  A 400 ( 4.8A)
None
None
SAH  A 400 (-3.5A)
 0.79A 3fi0E-2vp3A:
undetectable		 3fi0E-2vp3A:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xub DNA-DIRECTED RNA
POLYMERASE III
SUBUNIT RPC3

(Homo sapiens) 		PF05645
(RNA_pol_Rpc82)
PF08221
(HTH_9) 		4 GLY A  44
ASP A  42
ILE A  39
VAL A  50
 None
 0.90A 3fi0E-2xubA:
undetectable		 3fi0E-2xubA:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ypf AVRBS3

(Xanthomonas
campestris) 		PF03377
(TAL_effector) 		4 GLY A 541
HIS A 538
ILE A 501
VAL A 514
 None
 0.80A 3fi0E-2ypfA:
undetectable		 3fi0E-2ypfA:
18.18
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) 		5 GLY A   8
HIS A  44
ASP A 140
ILE A 141
VAL A 149
 WSA  A1350 (-3.7A)
WSA  A1350 (-3.5A)
WSA  A1350 (-4.1A)
WSA  A1350 ( 4.9A)
None
 0.35A 3fi0E-2yy5A:
33.9		 3fi0E-2yy5A:
40.52
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) 		5 HIS A  44
ASP A 140
ILE A 141
VAL A 149
GLN A 155
 WSA  A1350 (-3.5A)
WSA  A1350 (-4.1A)
WSA  A1350 ( 4.9A)
None
SO4  A1363 ( 3.2A)
 0.49A 3fi0E-2yy5A:
33.9		 3fi0E-2yy5A:
40.52
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.
2zua NUCLEOSIDE
DIPHOSPHATE KINASE

(Haloarcula
quadrata) 		PF00334
(NDK) 		4 GLY A  19
ASP A  23
ILE A  24
VAL A  11
 None
 0.74A 3fi0E-2zuaA:
undetectable		 3fi0E-2zuaA:
19.94
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.
3a05 TRYPTOPHANYL-TRNA
SYNTHETASE

(Aeropyrum
pernix) 		PF00579
(tRNA-synt_1b) 		4 GLY A  76
ASP A 195
ILE A 196
VAL A 212
 TRP  A 377 (-3.6A)
TRP  A 377 (-3.6A)
None
None
 0.44A 3fi0E-3a05A:
21.5		 3fi0E-3a05A:
25.43
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.
3cav 3-OXO-5-BETA-STEROID
4-DEHYDROGENASE

(Homo sapiens) 		PF00248
(Aldo_ket_red) 		4 GLY A  22
ILE A  18
VAL A 269
GLN A 193
 None
None
None
NAP  A 327 (-3.8A)
 0.69A 3fi0E-3cavA:
undetectable		 3fi0E-3cavA:
23.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cos ALCOHOL
DEHYDROGENASE 4

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 GLY A 205
ASP A 273
ILE A 298
VAL A 209
 NAD  A 400 (-3.4A)
None
NAD  A 400 (-4.8A)
NAD  A 400 ( 3.8A)
 0.88A 3fi0E-3cosA:
undetectable		 3fi0E-3cosA:
22.17
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.
3cq5 HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE

(Corynebacterium
glutamicum) 		PF00155
(Aminotran_1_2) 		4 GLY A 329
VAL A  28
ILE A 332
GLN A 323
 None
 0.83A 3fi0E-3cq5A:
undetectable		 3fi0E-3cq5A:
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.
3dra GERANYLGERANYLTRANSF
ERASE TYPE I BETA
SUBUNIT

(Candida
albicans) 		PF00432
(Prenyltrans) 		4 GLY B 136
ASP B 192
ILE B 191
GLN B 153
 None
 0.86A 3fi0E-3draB:
undetectable		 3fi0E-3draB:
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.
3g9q FERRICHROME-BINDING
PROTEIN

(Bacillus
subtilis) 		PF01497
(Peripla_BP_2) 		4 GLY A 199
ASP A 201
ILE A 202
VAL A 269
 None
 0.90A 3fi0E-3g9qA:
undetectable		 3fi0E-3g9qA:
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.
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) 		4 GLY A1068
HIS A1373
VAL A 856
GLN A 871
 None
 0.83A 3fi0E-3h0gA:
undetectable		 3fi0E-3h0gA:
12.62
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.
3h95 NUCLEOSIDE
DIPHOSPHATE-LINKED
MOIETY X MOTIF 6

(Homo sapiens) 		PF00293
(NUDIX) 		4 ASP A 183
ILE A 184
VAL A 146
GLN A 143
 None
 0.83A 3fi0E-3h95A:
undetectable		 3fi0E-3h95A:
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.
3hm7 ALLANTOINASE

(Bacillus
halodurans) 		PF01979
(Amidohydro_1) 		4 GLY A 257
ILE A 252
VAL A 262
GLN A 232
 None
 0.73A 3fi0E-3hm7A:
undetectable		 3fi0E-3hm7A:
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.
3hug RNA POLYMERASE SIGMA
FACTOR

(Mycobacterium
tuberculosis) 		PF04545
(Sigma70_r4) 		4 GLY A 149
ASP A 147
ILE A 144
VAL A 155
 None
 0.81A 3fi0E-3hugA:
undetectable		 3fi0E-3hugA:
16.21
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.
3iay DNA POLYMERASE DELTA
CATALYTIC SUBUNIT

(Saccharomyces
cerevisiae) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		4 GLY A 400
ASP A 407
ILE A 408
GLN A 466
 None
CA  A   4 ( 4.2A)
None
None
 0.75A 3fi0E-3iayA:
undetectable		 3fi0E-3iayA:
17.39
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.
3k53 FERROUS IRON
TRANSPORT PROTEIN B

(Pyrococcus
furiosus) 		PF02421
(FeoB_N) 		4 VAL A  89
ASP A  87
ILE A 112
VAL A 140
 None
 0.80A 3fi0E-3k53A:
undetectable		 3fi0E-3k53A:
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.
3kwu MUNC13-1

(Rattus
norvegicus) 		PF00168
(C2) 		4 GLY A 779
VAL A 807
ILE A 811
VAL A 753
 None
 0.90A 3fi0E-3kwuA:
undetectable		 3fi0E-3kwuA:
16.04
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.
3lf5 CYTOCHROME B5
REDUCTASE 4

(Homo sapiens) 		PF00173
(Cyt-b5) 		4 VAL A 115
HIS A 112
ILE A  73
VAL A  82
 HEM  A   1 (-4.4A)
HEM  A   1 (-3.2A)
HEM  A   1 ( 4.6A)
None
 0.80A 3fi0E-3lf5A:
undetectable		 3fi0E-3lf5A:
15.08
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.
3ln3 DIHYDRODIOL
DEHYDROGENASE

(Mus musculus) 		PF00248
(Aldo_ket_red) 		4 GLY A  20
ILE A  16
VAL A 266
GLN A 190
 None
None
None
NAD  A 327 (-3.6A)
 0.75A 3fi0E-3ln3A:
undetectable		 3fi0E-3ln3A:
23.42
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) 		6 GLY A   6
HIS A  42
ASP A 131
ILE A 132
VAL A 140
GLN A 146
 None
 0.59A 3fi0E-3m5wA:
31.8		 3fi0E-3m5wA:
39.47
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.
3m9x D-XYLOSE-BINDING
PERIPLASMIC PROTEIN

(Escherichia
coli) 		PF13407
(Peripla_BP_4) 		4 GLY A 259
VAL A   3
ILE A 254
GLN A 262
 None
 0.90A 3fi0E-3m9xA:
undetectable		 3fi0E-3m9xA:
22.80
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) 		7 GLY A  21
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
None
 0.49A 3fi0E-3n9iA:
36.9		 3fi0E-3n9iA:
54.94
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.
3ntv MW1564 PROTEIN

(Staphylococcus
aureus) 		PF01596
(Methyltransf_3) 		4 GLY A 181
ASP A 185
ILE A 188
VAL A 198
 None
 0.80A 3fi0E-3ntvA:
2.3		 3fi0E-3ntvA:
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.
3o66 GLYCINE
BETAINE/CARNITINE/CH
OLINE ABC
TRANSPORTER

(Staphylococcus
aureus) 		PF04069
(OpuAC) 		4 GLY A 219
ASP A 223
ILE A 226
VAL A 233
 None
ACT  A 323 (-4.3A)
None
None
 0.81A 3fi0E-3o66A:
undetectable		 3fi0E-3o66A:
21.93
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
ASP A 133
ILE A 134
VAL A 142
 None
 0.43A 3fi0E-3prhA:
38.4		 3fi0E-3prhA:
69.44
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) 		4 VAL A  41
HIS A  44
ASP A 133
GLN A 148
 None
 0.56A 3fi0E-3prhA:
38.4		 3fi0E-3prhA:
69.44
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.
3q4g NH(3)-DEPENDENT
NAD(+) SYNTHETASE

(Vibrio cholerae) 		PF02540
(NAD_synthase) 		4 GLY A 160
ILE A 155
VAL A  41
GLN A  74
 None
 0.86A 3fi0E-3q4gA:
2.2		 3fi0E-3q4gA:
22.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qde CELLOBIOSE
PHOSPHORYLASE

(Ruminiclostridium
thermocellum) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		4 GLY A 779
ASP A 745
ILE A 744
VAL A 808
 None
 0.79A 3fi0E-3qdeA:
undetectable		 3fi0E-3qdeA:
16.63
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.
3sn0 PUTATIVE
L-ALANINE-DL-GLUTAMA
TE EPIMERASE

(Paraburkholderia
xenovorans) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 GLY A 226
VAL A 189
ILE A 244
VAL A 255
 None
 0.79A 3fi0E-3sn0A:
undetectable		 3fi0E-3sn0A:
21.90
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) 		4 ASP A 135
ILE A 136
VAL A 144
GLN A 150
 TRP  A 401 (-4.0A)
None
TRP  A 401 (-4.9A)
TRP  A 401 (-3.8A)
 0.87A 3fi0E-3sz3A:
36.6		 3fi0E-3sz3A:
52.52
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) 		5 GLY A   9
VAL A  42
ASP A 135
ILE A 136
VAL A 144
 TRP  A 401 (-3.8A)
TRP  A 401 (-4.7A)
TRP  A 401 (-4.0A)
None
TRP  A 401 (-4.9A)
 0.42A 3fi0E-3sz3A:
36.6		 3fi0E-3sz3A:
52.52
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.
3v8b PUTATIVE
DEHYDROGENASE,
POSSIBLY
3-OXOACYL-[ACYL-CARR
IER PROTEIN]
REDUCTASE

(Sinorhizobium
meliloti) 		PF13561
(adh_short_C2) 		4 GLY A 117
VAL A  63
ILE A 111
GLN A 164
 None
 0.83A 3fi0E-3v8bA:
undetectable		 3fi0E-3v8bA:
23.44
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.
4c3h DNA-DIRECTED RNA
POLYMERASE I SUBUNIT
RPA190

(Saccharomyces
cerevisiae) 		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) 		4 HIS A1581
ILE A1179
VAL A1032
GLN A1047
 None
 0.91A 3fi0E-4c3hA:
undetectable		 3fi0E-4c3hA:
11.55
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.
4cq1 POLYPYRIMIDINE
TRACT-BINDING
PROTEIN 2

(Homo sapiens) 		PF00076
(RRM_1)
PF13893
(RRM_5) 		4 GLY A 360
HIS A 437
ILE A 380
GLN A 353
 None
 0.86A 3fi0E-4cq1A:
undetectable		 3fi0E-4cq1A:
18.69
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.
4dk1 PUTATIVE MACA,
MULTIDRUG RESISTANCE
PROTEIN MEXA

(Pseudomonas
aeruginosa;
Aggregatibacter
actinomycetemcomitans) 		PF16576
(HlyD_D23) 		4 GLY A 208
ASP A 228
ILE A 249
VAL A 211
 None
 0.84A 3fi0E-4dk1A:
undetectable		 3fi0E-4dk1A:
23.55
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.
4dq7 MEMBRANE PROTEIN
PHI6 P5

(Pseudomonas
virus phi6) 		PF10464
(Peptidase_U40) 		4 GLY A 102
VAL A  99
ILE A  92
VAL A  70
 None
 0.79A 3fi0E-4dq7A:
undetectable		 3fi0E-4dq7A:
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.
4h1x PHOSPHATE-BINDING
PROTEIN PSTS 2

(Streptococcus
pneumoniae) 		PF12849
(PBP_like_2) 		4 GLY A  95
VAL A  87
ILE A  37
VAL A 279
 None
 0.89A 3fi0E-4h1xA:
undetectable		 3fi0E-4h1xA:
21.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i2o FIXK2 PROTEIN

(Bradyrhizobium
japonicum) 		PF00027
(cNMP_binding)
PF13545
(HTH_Crp_2) 		4 GLY A 192
HIS A 148
ILE A 187
VAL A 198
 None
 0.72A 3fi0E-4i2oA:
undetectable		 3fi0E-4i2oA:
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.
4j3o OUTER MEMBRANE USHER
PROTEIN FIMD

(Escherichia
coli) 		PF00577
(Usher)
PF13953
(PapC_C)
PF13954
(PapC_N) 		4 VAL D 280
ILE D 256
VAL D 301
GLN D 311
 None
 0.70A 3fi0E-4j3oD:
undetectable		 3fi0E-4j3oD:
17.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nq3 CYANURIC ACID
AMIDOHYDROLASE

(Azorhizobium
caulinodans) 		PF09663
(Amido_AtzD_TrzD) 		4 GLY A 194
VAL A 131
ILE A 212
GLN A 339
 None
 0.90A 3fi0E-4nq3A:
undetectable		 3fi0E-4nq3A:
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.
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) 		4 GLY C  65
HIS C 304
VAL A 854
GLN A 869
 None
 0.85A 3fi0E-4qiwC:
undetectable		 3fi0E-4qiwC:
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.
4r1j GU4 NUCLEIC-BINDING
PROTEIN 1

(Saccharomyces
cerevisiae) 		PF01588
(tRNA_bind) 		4 GLY A 103
ASP A  34
ILE A  33
VAL A  64
 None
 0.89A 3fi0E-4r1jA:
undetectable		 3fi0E-4r1jA:
19.94
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.
4rdy PARATHION HYDROLASE

(Vulcanisaeta
moutnovskia) 		PF02126
(PTE) 		4 GLY A  94
ASP A 122
ILE A 123
VAL A 166
 None
 0.80A 3fi0E-4rdyA:
undetectable		 3fi0E-4rdyA:
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.
4txg CHITINASE

(Chromobacterium
violaceum) 		PF00704
(Glyco_hydro_18)
PF06483
(ChiC) 		4 GLY A 660
ASP A 658
ILE A 657
VAL A 771
 None
 0.81A 3fi0E-4txgA:
undetectable		 3fi0E-4txgA:
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.
5az0 UNCHARACTERIZED
PROTEIN

(Bombyx mori) 		PF00248
(Aldo_ket_red) 		4 GLY A  21
ILE A  17
VAL A 273
GLN A 197
 None
None
None
ACT  A 405 ( 4.8A)
 0.77A 3fi0E-5az0A:
undetectable		 3fi0E-5az0A:
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.
5e72 N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE

(Thermococcus
kodakarensis) 		PF01170
(UPF0020)
PF02926
(THUMP) 		4 GLY A 198
VAL A 226
ILE A 183
VAL A 174
 None
 0.87A 3fi0E-5e72A:
undetectable		 3fi0E-5e72A:
23.56
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) 		6 GLY A  40
VAL A  74
ASP A 167
ILE A 168
VAL A 176
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
5BX  A 401 ( 3.0A)
 0.60A 3fi0E-5ekdA:
34.6		 3fi0E-5ekdA:
40.75
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) 		6 GLY A  40
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
 0.35A 3fi0E-5ekdA:
34.6		 3fi0E-5ekdA:
40.75
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) 		4 GLY A  40
VAL A  74
HIS A  77
VAL A 178
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
ATP  A 402 (-3.2A)
 0.80A 3fi0E-5ekdA:
34.6		 3fi0E-5ekdA:
40.75
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.
5fgu GREEN FLUORESCENT
PROTEIN,EXTRACELLULA
R STREPTODORNASE D

(Streptococcus
pyogenes;
Aequorea
victoria) 		PF01353
(GFP)
PF13930
(Endonuclea_NS_2) 		4 VAL A 224
ILE A 152
VAL A 163
GLN A  94
 None
None
None
CR2  A  66 ( 3.3A)
 0.86A 3fi0E-5fguA:
undetectable		 3fi0E-5fguA:
20.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hgz N-ALPHA-ACETYLTRANSF
ERASE 60

(Homo sapiens) 		PF00583
(Acetyltransf_1) 		4 HIS A 138
ASP A  81
ILE A  77
VAL A  95
 None
 0.85A 3fi0E-5hgzA:
undetectable		 3fi0E-5hgzA:
20.37
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.
5hh0 N-ALPHA-ACETYLTRANSF
ERASE 60

(Homo sapiens) 		PF00583
(Acetyltransf_1) 		4 HIS A 138
ASP A  81
ILE A  77
VAL A  95
 None
 0.87A 3fi0E-5hh0A:
undetectable		 3fi0E-5hh0A:
20.86
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.
5ho1 MAGNETOSOME PROTEIN
MAMB

(Magnetospira
sp. QH-2) 		PF16916
(ZT_dimer) 		4 GLY A 237
HIS A 245
ASP A 247
ILE A 248
 None
ZN  A 301 (-3.4A)
ZN  A 301 (-2.1A)
None
 0.76A 3fi0E-5ho1A:
undetectable		 3fi0E-5ho1A:
14.07
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.
5icv N-ALPHA-ACETYLTRANSF
ERASE 60

(Homo sapiens) 		PF00583
(Acetyltransf_1) 		4 HIS A 138
ASP A  81
ILE A  77
VAL A  95
 None
 0.86A 3fi0E-5icvA:
undetectable		 3fi0E-5icvA:
19.94
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.
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) 		4 GLY A1088
HIS A1397
VAL A 873
GLN A 888
 None
 0.89A 3fi0E-5iy9A:
undetectable		 3fi0E-5iy9A:
11.71
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.
5jm0 ALPHA-MANNOSIDASE,AL
PHA-MANNOSIDASE,ALPH
A-MANNOSIDASE

(Saccharomyces
cerevisiae) 		PF01074
(Glyco_hydro_38)
PF07748
(Glyco_hydro_38C)
PF09261
(Alpha-mann_mid) 		4 GLY A 505
HIS A 298
ASP A 300
GLN A 340
 None
 0.82A 3fi0E-5jm0A:
undetectable		 3fi0E-5jm0A:
13.76
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.
5k94 MALTOSE-BINDING
PERIPLASMIC
PROTEIN,PROTEIN
TRANSLOCASE SUBUNIT
SECA,MALTOSE-BINDING
PERIPLASMIC PROTEIN

(Escherichia
coli) 		PF01043
(SecA_PP_bind)
PF01547
(SBP_bac_1)
PF13416
(SBP_bac_8) 		4 GLY A 352
HIS A 308
ASP A1177
ILE A1178
 None
 0.85A 3fi0E-5k94A:
undetectable		 3fi0E-5k94A:
22.04
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
HIS A  47
ASP A 145
ILE A 146
VAL A 154
 None
 0.30A 3fi0E-5tevA:
31.9		 3fi0E-5tevA:
33.62
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) 		7 GLY A   9
VAL A  42
HIS A  45
ASP A 135
ILE A 136
VAL A 144
GLN A 150
 TRP  A 402 (-3.7A)
TRP  A 402 (-4.7A)
TRP  A 402 (-3.6A)
TRP  A 402 (-3.9A)
None
None
TRP  A 402 (-3.1A)
 0.48A 3fi0E-5v0iA:
37.8		 3fi0E-5v0iA:
57.23
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.
5w3w ARYLDIALKYLPHOSPHATA
SE

(Sulfolobus
solfataricus) 		no annotation 4 GLY A  93
ASP A 121
ILE A 122
VAL A 165
 None
 0.81A 3fi0E-5w3wA:
undetectable		 3fi0E-5w3wA:
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.
5wx1 SERINE PROTEASE NS3

(Pestivirus C) 		PF00271
(Helicase_C)
PF05578
(Peptidase_S31)
PF07652
(Flavi_DEAD) 		4 GLY A 164
VAL A  67
ILE A 167
VAL A 117
 None
 0.72A 3fi0E-5wx1A:
undetectable		 3fi0E-5wx1A:
19.65
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.
5xlk FLAGELLAR
HOOK-ASSOCIATED
PROTEIN 2

(Serratia
marcescens) 		PF07195
(FliD_C)
PF07196
(Flagellin_IN) 		4 GLY A 135
ILE A 132
VAL A 166
GLN A 105
 None
 0.60A 3fi0E-5xlkA:
undetectable		 3fi0E-5xlkA:
21.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xog DNA-DIRECTED RNA
POLYMERASE SUBUNIT

(Komagataella
phaffii) 		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) 		4 GLY A1067
HIS A1370
VAL A 851
GLN A 866
 None
 0.90A 3fi0E-5xogA:
undetectable		 3fi0E-5xogA:
10.66
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.
5yrp SENSORY BOX/RESPONSE
REGULATOR

(Mycolicibacterium
smegmatis) 		no annotation 4 GLY A 509
ASP A 529
ILE A 528
VAL A 549
 None
 0.83A 3fi0E-5yrpA:
undetectable		 3fi0E-5yrpA:
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.
6d0p PIRIN FAMILY PROTEIN

(Acinetobacter
baumannii) 		no annotation 4 VAL A 127
ILE A 163
VAL A  94
GLN A 141
 None
 0.87A 3fi0E-6d0pA:
undetectable		 3fi0E-6d0pA:
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.
6dfu TRYPTOPHAN--TRNA
LIGASE

(Haemophilus
influenzae) 		no annotation 5 GLY A   9
ASP A 135
ILE A 136
VAL A 144
GLN A 150
 TRP  A 501 (-3.5A)
TRP  A 501 (-3.9A)
None
None
TRP  A 501 (-3.3A)
 0.61A 3fi0E-6dfuA:
38.1		 3fi0E-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.
6dfu TRYPTOPHAN--TRNA
LIGASE

(Haemophilus
influenzae) 		no annotation 6 GLY A   9
VAL A  42
HIS A  45
ASP A 135
ILE A 136
VAL A 144
 TRP  A 501 (-3.5A)
TRP  A 501 ( 4.6A)
TRP  A 501 (-4.0A)
TRP  A 501 (-3.9A)
None
None
 0.23A 3fi0E-6dfuA:
38.1		 3fi0E-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.
6es9 ACYL-COA
DEHYDROGENASE

(Paracoccus
denitrificans) 		no annotation 4 GLY A  99
VAL A 462
ILE A  72
GLN A 106
 None
 0.90A 3fi0E-6es9A:
undetectable		 3fi0E-6es9A:
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.
6fju -

(-) 		no annotation 4 HIS A  85
ASP A  96
ILE A  97
VAL A 142
 ZN  A 301 (-3.2A)
ZN  A 301 (-2.5A)
None
None
 0.87A 3fi0E-6fjuA:
undetectable		 3fi0E-6fjuA:
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.
6fno -

(-) 		no annotation 4 VAL A 114
HIS A  85
ASP A  96
ILE A  97
 None
ZN  A 201 (-3.2A)
ZN  A 201 (-2.1A)
None
 0.82A 3fi0E-6fnoA:
undetectable		 3fi0E-6fnoA:
undetectable