SIMILAR PATTERNS OF AMINO ACIDS FOR 2J9D_J_ACTJ1116

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.
1l3a P24: PLANT
TRANSCRIPTIONAL
REGULATOR PBF-2

(Solanum
tuberosum) 		PF08536
(Whirly) 		4 LYS A 100
ILE A 220
GLU A 226
ILE A  98
 None
 0.90A 2j9dJ-1l3aA:
0.0
2j9dK-1l3aA:
0.0
2j9dL-1l3aA:
0.0		 2j9dJ-1l3aA:
19.82
2j9dK-1l3aA:
19.82
2j9dL-1l3aA:
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.
1ox4 IMIDAZOLE GLYCEROL
PHOSPHATE SYNTHASE
HISHF

(Saccharomyces
cerevisiae) 		PF00117
(GATase)
PF00977
(His_biosynth) 		4 GLU B 293
ILE B 241
GLU B 465
ILE B 497
 None
 0.90A 2j9dJ-1ox4B:
0.0
2j9dK-1ox4B:
0.0
2j9dL-1ox4B:
0.0		 2j9dJ-1ox4B:
12.41
2j9dK-1ox4B:
12.41
2j9dL-1ox4B:
12.41
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.
1ox4 IMIDAZOLE GLYCEROL
PHOSPHATE SYNTHASE
HISHF

(Saccharomyces
cerevisiae) 		PF00117
(GATase)
PF00977
(His_biosynth) 		4 GLU B 465
ILE B 497
GLU B 293
ILE B 241
 None
 0.85A 2j9dJ-1ox4B:
0.0
2j9dK-1ox4B:
0.0
2j9dL-1ox4B:
0.0		 2j9dJ-1ox4B:
12.41
2j9dK-1ox4B:
12.41
2j9dL-1ox4B:
12.41
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.
1qrh ECO RI ENDONCULEASE

(Escherichia
coli) 		PF02963
(EcoRI) 		5 GLU A  96
ILE A  94
LYS A  62
GLU A  65
ILE A  61
 None
 1.05A 2j9dJ-1qrhA:
0.0
2j9dK-1qrhA:
0.0
2j9dL-1qrhA:
0.0		 2j9dJ-1qrhA:
19.84
2j9dK-1qrhA:
19.84
2j9dL-1qrhA:
19.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qrh ECO RI ENDONCULEASE

(Escherichia
coli) 		PF02963
(EcoRI) 		4 LYS A  62
GLU A  65
ILE A  61
GLU A  96
 None
 0.98A 2j9dJ-1qrhA:
0.0
2j9dK-1qrhA:
0.0
2j9dL-1qrhA:
0.0		 2j9dJ-1qrhA:
19.84
2j9dK-1qrhA:
19.84
2j9dL-1qrhA:
19.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v71 HYPOTHETICAL PROTEIN
C320.14 IN
CHROMOSOME III

(Schizosaccharomyces
pombe) 		PF00291
(PALP) 		4 LYS A 101
ILE A 124
GLU A 144
ILE A 140
 None
 0.58A 2j9dJ-1v71A:
0.0
2j9dK-1v71A:
0.0
2j9dL-1v71A:
0.0		 2j9dJ-1v71A:
16.93
2j9dK-1v71A:
16.93
2j9dL-1v71A:
16.93
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.
1ve1 O-ACETYLSERINE
SULFHYDRYLASE

(Thermus
thermophilus) 		PF00291
(PALP) 		4 GLU A   4
ILE A  80
GLU A  52
ILE A  48
 None
 0.94A 2j9dJ-1ve1A:
0.0
2j9dK-1ve1A:
undetectable
2j9dL-1ve1A:
0.0		 2j9dJ-1ve1A:
18.67
2j9dK-1ve1A:
18.67
2j9dL-1ve1A:
18.67
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.
2ahw PUTATIVE ENZYME YDIF

(Escherichia
coli) 		PF01144
(CoA_trans) 		4 GLU A 172
ILE A 141
LYS A 455
GLU A 459
 None
 0.78A 2j9dJ-2ahwA:
0.0
2j9dK-2ahwA:
0.0
2j9dL-2ahwA:
0.0		 2j9dJ-2ahwA:
13.94
2j9dK-2ahwA:
13.94
2j9dL-2ahwA:
13.94
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.
2ahw PUTATIVE ENZYME YDIF

(Escherichia
coli) 		PF01144
(CoA_trans) 		5 GLU A 172
ILE A 141
LYS A 455
GLU A 459
ILE A 456
 None
 0.80A 2j9dJ-2ahwA:
0.0
2j9dK-2ahwA:
0.0
2j9dL-2ahwA:
0.0		 2j9dJ-2ahwA:
13.94
2j9dK-2ahwA:
13.94
2j9dL-2ahwA:
13.94
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.
2ahw PUTATIVE ENZYME YDIF

(Escherichia
coli) 		PF01144
(CoA_trans) 		4 LYS A 455
GLU A 459
ILE A 456
GLU A 172
 None
 0.57A 2j9dJ-2ahwA:
0.0
2j9dK-2ahwA:
0.0
2j9dL-2ahwA:
0.0		 2j9dJ-2ahwA:
13.94
2j9dK-2ahwA:
13.94
2j9dL-2ahwA:
13.94
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.
2bx7 DIHYDROOROTATE
DEHYDROGENASE

(Lactococcus
lactis) 		PF01180
(DHO_dh) 		4 GLU A 288
ILE A 285
GLU A 277
ILE A 281
 None
 0.93A 2j9dJ-2bx7A:
0.0
2j9dK-2bx7A:
undetectable
2j9dL-2bx7A:
undetectable		 2j9dJ-2bx7A:
17.42
2j9dK-2bx7A:
17.42
2j9dL-2bx7A:
17.42
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.
2dbh TUMOR NECROSIS
FACTOR RECEPTOR
SUPERFAMILY MEMBER
21

(Homo sapiens) 		no annotation 4 LYS A  76
ILE A  73
GLU A  52
ILE A  72
 None
 0.75A 2j9dJ-2dbhA:
undetectable
2j9dK-2dbhA:
1.1
2j9dL-2dbhA:
undetectable		 2j9dJ-2dbhA:
20.00
2j9dK-2dbhA:
20.00
2j9dL-2dbhA:
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.
2dgd 223AA LONG
HYPOTHETICAL
ARYLMALONATE
DECARBOXYLASE

(Sulfurisphaera
tokodaii) 		no annotation 4 LYS A  86
ILE A  85
GLU A  97
ILE A  94
 None
 0.92A 2j9dJ-2dgdA:
undetectable
2j9dK-2dgdA:
undetectable
2j9dL-2dgdA:
undetectable		 2j9dJ-2dgdA:
18.39
2j9dK-2dgdA:
18.39
2j9dL-2dgdA:
18.39
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.
2flq NITRIC OXIDE
SYNTHASE

(Geobacillus
stearothermophilus) 		PF02898
(NO_synthase) 		4 GLU A  60
ILE A  24
LYS A  33
GLU A  37
 None
 0.83A 2j9dJ-2flqA:
0.0
2j9dK-2flqA:
undetectable
2j9dL-2flqA:
undetectable		 2j9dJ-2flqA:
13.76
2j9dK-2flqA:
13.76
2j9dL-2flqA:
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.
2flq NITRIC OXIDE
SYNTHASE

(Geobacillus
stearothermophilus) 		PF02898
(NO_synthase) 		4 ILE A  24
LYS A  33
GLU A  37
GLU A  60
 None
 0.78A 2j9dJ-2flqA:
0.0
2j9dK-2flqA:
undetectable
2j9dL-2flqA:
undetectable		 2j9dJ-2flqA:
13.76
2j9dK-2flqA:
13.76
2j9dL-2flqA:
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.
2ici EXOTOXIN I

(Streptococcus
pyogenes) 		PF01123
(Stap_Strp_toxin)
PF02876
(Stap_Strp_tox_C) 		4 LYS A 209
ILE A 135
GLU A 184
ILE A 186
 None
 0.93A 2j9dJ-2iciA:
undetectable
2j9dK-2iciA:
undetectable
2j9dL-2iciA:
undetectable		 2j9dJ-2iciA:
17.17
2j9dK-2iciA:
17.17
2j9dL-2iciA:
17.17
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.
2ph0 UNCHARACTERIZED
PROTEIN

(Pectobacterium
carotovorum) 		PF06228
(ChuX_HutX) 		4 ILE A  71
LYS A 135
ILE A  64
GLU A  18
 None
 0.58A 2j9dJ-2ph0A:
undetectable
2j9dK-2ph0A:
undetectable
2j9dL-2ph0A:
undetectable		 2j9dJ-2ph0A:
21.05
2j9dK-2ph0A:
21.05
2j9dL-2ph0A:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2po4 VIRION RNA
POLYMERASE

(Escherichia
virus N4) 		no annotation 4 LYS A 670
GLU A 658
ILE A 668
GLU A 191
 None
 0.95A 2j9dJ-2po4A:
0.3
2j9dK-2po4A:
0.0
2j9dL-2po4A:
undetectable		 2j9dJ-2po4A:
7.64
2j9dK-2po4A:
7.64
2j9dL-2po4A:
7.64
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.
2po4 VIRION RNA
POLYMERASE

(Escherichia
virus N4) 		no annotation 4 LYS A 670
GLU A 658
ILE A 668
GLU A 191
 None
 0.95A 2j9dJ-2po4A:
0.3
2j9dK-2po4A:
0.0
2j9dL-2po4A:
undetectable		 2j9dJ-2po4A:
7.64
2j9dK-2po4A:
7.64
2j9dL-2po4A:
7.64
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.
2qip PROTEIN OF UNKNOWN
FUNCTION VPA0982

(Vibrio
parahaemolyticus) 		PF01936
(NYN) 		4 ILE A 110
LYS A  43
GLU A   7
ILE A   9
 None
 0.95A 2j9dJ-2qipA:
undetectable
2j9dK-2qipA:
undetectable
2j9dL-2qipA:
undetectable		 2j9dJ-2qipA:
23.03
2j9dK-2qipA:
23.03
2j9dL-2qipA:
23.03
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.
2qvg TWO COMPONENT
RESPONSE REGULATOR

(Legionella
pneumophila) 		PF00072
(Response_reg) 		4 LYS A  40
ILE A  38
GLU A  17
ILE A  20
 None
 0.93A 2j9dJ-2qvgA:
undetectable
2j9dK-2qvgA:
undetectable
2j9dL-2qvgA:
undetectable		 2j9dJ-2qvgA:
21.53
2j9dK-2qvgA:
21.53
2j9dL-2qvgA:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wch GENERAL
ODORANT-BINDING
PROTEIN 1

(Bombyx mori) 		PF01395
(PBP_GOBP) 		4 GLU A 135
ILE A 138
LYS A  34
GLU A  32
 None
 0.88A 2j9dJ-2wchA:
undetectable
2j9dK-2wchA:
undetectable
2j9dL-2wchA:
undetectable		 2j9dJ-2wchA:
21.71
2j9dK-2wchA:
21.71
2j9dL-2wchA:
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.
2wch GENERAL
ODORANT-BINDING
PROTEIN 1

(Bombyx mori) 		PF01395
(PBP_GOBP) 		4 LYS A  34
GLU A  32
GLU A 135
ILE A 138
 None
 0.91A 2j9dJ-2wchA:
undetectable
2j9dK-2wchA:
undetectable
2j9dL-2wchA:
undetectable		 2j9dJ-2wchA:
21.71
2j9dK-2wchA:
21.71
2j9dL-2wchA:
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.
2wtb FATTY ACID
MULTIFUNCTIONAL
PROTEIN (ATMFP2)

(Arabidopsis
thaliana) 		PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N) 		4 GLU A 401
ILE A 430
LYS A 406
GLU A 397
 None
 0.98A 2j9dJ-2wtbA:
undetectable
2j9dK-2wtbA:
undetectable
2j9dL-2wtbA:
undetectable		 2j9dJ-2wtbA:
12.23
2j9dK-2wtbA:
12.23
2j9dL-2wtbA:
12.23
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.
2wtb FATTY ACID
MULTIFUNCTIONAL
PROTEIN (ATMFP2)

(Arabidopsis
thaliana) 		PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N) 		4 LYS A 406
ILE A 435
GLU A 401
ILE A 430
 None
 0.92A 2j9dJ-2wtbA:
undetectable
2j9dK-2wtbA:
undetectable
2j9dL-2wtbA:
undetectable		 2j9dJ-2wtbA:
12.23
2j9dK-2wtbA:
12.23
2j9dL-2wtbA:
12.23
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.
2xvg ALPHA XYLOSIDASE

(Cellvibrio
japonicus) 		PF01055
(Glyco_hydro_31)
PF16338
(DUF4968)
PF17137
(DUF5110) 		5 GLU A 398
ILE A 229
GLU A 237
LYS A 598
GLU A 595
 None
 1.29A 2j9dJ-2xvgA:
undetectable
2j9dK-2xvgA:
undetectable
2j9dL-2xvgA:
undetectable		 2j9dJ-2xvgA:
9.19
2j9dK-2xvgA:
9.19
2j9dL-2xvgA:
9.19
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.
2xvg ALPHA XYLOSIDASE

(Cellvibrio
japonicus) 		PF01055
(Glyco_hydro_31)
PF16338
(DUF4968)
PF17137
(DUF5110) 		5 LYS A 598
GLU A 595
GLU A 398
ILE A 229
GLU A 237
 None
 1.32A 2j9dJ-2xvgA:
undetectable
2j9dK-2xvgA:
undetectable
2j9dL-2xvgA:
undetectable		 2j9dJ-2xvgA:
9.19
2j9dK-2xvgA:
9.19
2j9dL-2xvgA:
9.19
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.
2ypd PROBABLE JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION PROT
EIN 2C

(Homo sapiens) 		PF02373
(JmjC) 		4 LYS A2408
GLU A2412
ILE A2409
GLU A2442
 None
 0.78A 2j9dJ-2ypdA:
undetectable
2j9dK-2ypdA:
undetectable
2j9dL-2ypdA:
undetectable		 2j9dJ-2ypdA:
18.11
2j9dK-2ypdA:
18.11
2j9dL-2ypdA:
18.11
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.
2ypd PROBABLE JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION PROT
EIN 2C

(Homo sapiens) 		PF02373
(JmjC) 		4 LYS A2408
GLU A2412
ILE A2409
GLU A2442
 None
 0.80A 2j9dJ-2ypdA:
undetectable
2j9dK-2ypdA:
undetectable
2j9dL-2ypdA:
undetectable		 2j9dJ-2ypdA:
18.11
2j9dK-2ypdA:
18.11
2j9dL-2ypdA:
18.11
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.
3b05 ISOPENTENYL-DIPHOSPH
ATE DELTA-ISOMERASE

(Sulfolobus
shibatae) 		PF01070
(FMN_dh) 		4 GLU A  10
ILE A  14
GLU A 229
ILE A 228
 None
 0.96A 2j9dJ-3b05A:
undetectable
2j9dK-3b05A:
undetectable
2j9dL-3b05A:
undetectable		 2j9dJ-3b05A:
13.51
2j9dK-3b05A:
13.51
2j9dL-3b05A:
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.
3b05 ISOPENTENYL-DIPHOSPH
ATE DELTA-ISOMERASE

(Sulfolobus
shibatae) 		PF01070
(FMN_dh) 		4 GLU A 229
ILE A 228
ILE A 231
GLU A  10
 None
 0.98A 2j9dJ-3b05A:
undetectable
2j9dK-3b05A:
undetectable
2j9dL-3b05A:
undetectable		 2j9dJ-3b05A:
13.51
2j9dK-3b05A:
13.51
2j9dL-3b05A:
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.
3bq9 PREDICTED ROSSMANN
FOLD
NUCLEOTIDE-BINDING
DOMAIN-CONTAINING
PROTEIN

(Idiomarina
baltica) 		PF03641
(Lysine_decarbox)
PF11892
(DUF3412)
PF14793
(DUF4478) 		4 GLU A 212
ILE A 215
GLU A 259
LYS A 397
 None
 0.98A 2j9dJ-3bq9A:
undetectable
2j9dK-3bq9A:
undetectable
2j9dL-3bq9A:
undetectable		 2j9dJ-3bq9A:
14.73
2j9dK-3bq9A:
14.73
2j9dL-3bq9A:
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.
3bq9 PREDICTED ROSSMANN
FOLD
NUCLEOTIDE-BINDING
DOMAIN-CONTAINING
PROTEIN

(Idiomarina
baltica) 		PF03641
(Lysine_decarbox)
PF11892
(DUF3412)
PF14793
(DUF4478) 		4 LYS A 397
GLU A 212
ILE A 215
GLU A 259
 None
 0.96A 2j9dJ-3bq9A:
undetectable
2j9dK-3bq9A:
undetectable
2j9dL-3bq9A:
undetectable		 2j9dJ-3bq9A:
14.73
2j9dK-3bq9A:
14.73
2j9dL-3bq9A:
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.
3bwq CAPSID PROTEIN VP1

(Macaca mulatta
polyomavirus 1) 		PF00718
(Polyoma_coat) 		4 ILE A  32
GLU A 216
LYS A 255
GLU A 157
 None
 0.95A 2j9dJ-3bwqA:
undetectable
2j9dK-3bwqA:
undetectable
2j9dL-3bwqA:
undetectable		 2j9dJ-3bwqA:
18.55
2j9dK-3bwqA:
18.55
2j9dL-3bwqA:
18.55
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.
3bwq CAPSID PROTEIN VP1

(Macaca mulatta
polyomavirus 1) 		PF00718
(Polyoma_coat) 		4 LYS A 255
GLU A 157
ILE A  32
GLU A 216
 None
 0.93A 2j9dJ-3bwqA:
undetectable
2j9dK-3bwqA:
undetectable
2j9dL-3bwqA:
undetectable		 2j9dJ-3bwqA:
18.55
2j9dK-3bwqA:
18.55
2j9dL-3bwqA:
18.55
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.
3fg7 VILLIN-1

(Homo sapiens) 		PF00626
(Gelsolin) 		4 LYS A 671
GLU A 668
LYS A 699
ILE A 662
 None
 0.90A 2j9dJ-3fg7A:
undetectable
2j9dK-3fg7A:
undetectable
2j9dL-3fg7A:
undetectable		 2j9dJ-3fg7A:
17.22
2j9dK-3fg7A:
17.22
2j9dL-3fg7A:
17.22
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.
3fg7 VILLIN-1

(Homo sapiens) 		PF00626
(Gelsolin) 		4 LYS A 699
ILE A 662
LYS A 671
GLU A 668
 None
 0.93A 2j9dJ-3fg7A:
undetectable
2j9dK-3fg7A:
undetectable
2j9dL-3fg7A:
undetectable		 2j9dJ-3fg7A:
17.22
2j9dK-3fg7A:
17.22
2j9dL-3fg7A:
17.22
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.
3gkq TERMINAL OXYGENASE
COMPONENT OF
CARBAZOLE
1,9A-DIOXYGENASE

(Sphingomonas
sp. KA1) 		PF00355
(Rieske)
PF11723
(Aromatic_hydrox) 		4 ILE A 364
GLU A 179
ILE A 363
GLU A 354
 None
 0.98A 2j9dJ-3gkqA:
0.7
2j9dK-3gkqA:
0.7
2j9dL-3gkqA:
undetectable		 2j9dJ-3gkqA:
16.45
2j9dK-3gkqA:
16.45
2j9dL-3gkqA:
16.45
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.
3hr8 PROTEIN RECA

(Thermotoga
maritima) 		PF00154
(RecA) 		4 GLU A 235
ILE A 240
LYS A 268
ILE A 265
 None
 0.91A 2j9dJ-3hr8A:
undetectable
2j9dK-3hr8A:
undetectable
2j9dL-3hr8A:
undetectable		 2j9dJ-3hr8A:
17.70
2j9dK-3hr8A:
17.70
2j9dL-3hr8A:
17.70
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.
3kg9 CURK

(Lyngbya
majuscula) 		PF14765
(PS-DH) 		4 ILE A1098
LYS A1095
LYS A1223
GLU A1234
 None
 0.94A 2j9dJ-3kg9A:
undetectable
2j9dK-3kg9A:
undetectable
2j9dL-3kg9A:
undetectable		 2j9dJ-3kg9A:
17.91
2j9dK-3kg9A:
17.91
2j9dL-3kg9A:
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.
3kg9 CURK

(Lyngbya
majuscula) 		PF14765
(PS-DH) 		4 LYS A1223
GLU A1234
ILE A1098
LYS A1095
 None
 0.98A 2j9dJ-3kg9A:
undetectable
2j9dK-3kg9A:
undetectable
2j9dL-3kg9A:
undetectable		 2j9dJ-3kg9A:
17.91
2j9dK-3kg9A:
17.91
2j9dL-3kg9A:
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.
3ldu PUTATIVE METHYLASE

(Clostridioides
difficile) 		PF01170
(UPF0020)
PF02926
(THUMP) 		4 GLU A  33
LYS A  62
ILE A   7
GLU A  65
 None
 0.84A 2j9dJ-3lduA:
3.7
2j9dK-3lduA:
3.5
2j9dL-3lduA:
3.1		 2j9dJ-3lduA:
15.32
2j9dK-3lduA:
15.32
2j9dL-3lduA:
15.32
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.
3ldu PUTATIVE METHYLASE

(Clostridioides
difficile) 		PF01170
(UPF0020)
PF02926
(THUMP) 		4 ILE A  87
LYS A 116
ILE A 119
GLU A 135
 None
 0.88A 2j9dJ-3lduA:
3.7
2j9dK-3lduA:
3.5
2j9dL-3lduA:
3.1		 2j9dJ-3lduA:
15.32
2j9dK-3lduA:
15.32
2j9dL-3lduA:
15.32
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.
3ldu PUTATIVE METHYLASE

(Clostridioides
difficile) 		PF01170
(UPF0020)
PF02926
(THUMP) 		4 LYS A  62
ILE A   7
GLU A  65
GLU A  33
 None
 0.81A 2j9dJ-3lduA:
3.7
2j9dK-3lduA:
3.5
2j9dL-3lduA:
3.1		 2j9dJ-3lduA:
15.32
2j9dK-3lduA:
15.32
2j9dL-3lduA:
15.32
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.
3m7d TOPOISOMERASE V

(Methanopyrus
kandleri) 		PF13412
(HTH_24) 		4 GLU A 171
ILE A 174
GLU A 186
ILE A 181
 None
 0.90A 2j9dJ-3m7dA:
undetectable
2j9dK-3m7dA:
undetectable
2j9dL-3m7dA:
undetectable		 2j9dJ-3m7dA:
16.39
2j9dK-3m7dA:
16.39
2j9dL-3m7dA:
16.39
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.
3m7d TOPOISOMERASE V

(Methanopyrus
kandleri) 		PF13412
(HTH_24) 		4 GLU A 186
ILE A 181
GLU A 171
ILE A 174
 None
 0.88A 2j9dJ-3m7dA:
undetectable
2j9dK-3m7dA:
undetectable
2j9dL-3m7dA:
undetectable		 2j9dJ-3m7dA:
16.39
2j9dK-3m7dA:
16.39
2j9dL-3m7dA:
16.39
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.
3m7g TOPOISOMERASE V

(Methanopyrus
kandleri) 		PF13404
(HTH_AsnC-type) 		4 GLU A 171
ILE A 174
GLU A 186
ILE A 181
 None
 0.83A 2j9dJ-3m7gA:
undetectable
2j9dK-3m7gA:
undetectable
2j9dL-3m7gA:
undetectable		 2j9dJ-3m7gA:
21.76
2j9dK-3m7gA:
21.76
2j9dL-3m7gA:
21.76
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.
3m7g TOPOISOMERASE V

(Methanopyrus
kandleri) 		PF13404
(HTH_AsnC-type) 		4 GLU A 186
ILE A 181
GLU A 171
ILE A 174
 None
 0.91A 2j9dJ-3m7gA:
undetectable
2j9dK-3m7gA:
undetectable
2j9dL-3m7gA:
undetectable		 2j9dJ-3m7gA:
21.76
2j9dK-3m7gA:
21.76
2j9dL-3m7gA:
21.76
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.
3nzn GLUTAREDOXIN

(Methanosarcina
mazei) 		PF00462
(Glutaredoxin) 		4 LYS A  87
LYS A  93
GLU A  96
ILE A  89
 None
 0.93A 2j9dJ-3nznA:
undetectable
2j9dK-3nznA:
undetectable
2j9dL-3nznA:
undetectable		 2j9dJ-3nznA:
25.98
2j9dK-3nznA:
25.98
2j9dL-3nznA:
25.98
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.
3nzn GLUTAREDOXIN

(Methanosarcina
mazei) 		PF00462
(Glutaredoxin) 		4 LYS A  93
GLU A  96
ILE A  89
LYS A  87
 None
 0.91A 2j9dJ-3nznA:
undetectable
2j9dK-3nznA:
undetectable
2j9dL-3nznA:
undetectable		 2j9dJ-3nznA:
25.98
2j9dK-3nznA:
25.98
2j9dL-3nznA:
25.98
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.
3oix PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
DIHYDROOROTATE
OXIDASE

(Streptococcus
mutans) 		PF01180
(DHO_dh) 		4 GLU A 287
ILE A 284
GLU A 276
ILE A 280
 MLY  A 251 ( 4.7A)
MLY  A 251 ( 4.8A)
None
None
 0.90A 2j9dJ-3oixA:
undetectable
2j9dK-3oixA:
undetectable
2j9dL-3oixA:
undetectable		 2j9dJ-3oixA:
16.72
2j9dK-3oixA:
16.72
2j9dL-3oixA:
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.
3tq9 DIHYDROFOLATE
REDUCTASE

(Coxiella
burnetii) 		PF00186
(DHFR_1) 		4 ILE A   6
LYS A  39
GLU A  92
ILE A  94
 MTX  A2001 (-4.0A)
None
None
None
 0.85A 2j9dJ-3tq9A:
undetectable
2j9dK-3tq9A:
undetectable
2j9dL-3tq9A:
undetectable		 2j9dJ-3tq9A:
20.79
2j9dK-3tq9A:
20.79
2j9dL-3tq9A:
20.79
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.
3uug MULTIPLE
SUGAR-BINDING
PERIPLASMIC RECEPTOR
CHVE

(Agrobacterium
fabrum) 		PF13407
(Peripla_BP_4) 		4 GLU A 255
ILE A 220
ILE A 217
LYS A 224
 None
 0.91A 2j9dJ-3uugA:
undetectable
2j9dK-3uugA:
undetectable
2j9dL-3uugA:
undetectable		 2j9dJ-3uugA:
18.04
2j9dK-3uugA:
18.04
2j9dL-3uugA:
18.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v4p INTEGRIN ALPHA-4

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		4 LYS A 126
ILE A 121
GLU A  88
ILE A 118
 None
 0.96A 2j9dJ-3v4pA:
undetectable
2j9dK-3v4pA:
undetectable
2j9dL-3v4pA:
undetectable		 2j9dJ-3v4pA:
12.18
2j9dK-3v4pA:
12.18
2j9dL-3v4pA:
12.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v7p AMIDOHYDROLASE
FAMILY PROTEIN

(Nitratiruptor
sp. SB155-2) 		PF01979
(Amidohydro_1) 		4 GLU A  46
ILE A   4
LYS A 394
GLU A 401
 None
 0.97A 2j9dJ-3v7pA:
undetectable
2j9dK-3v7pA:
undetectable
2j9dL-3v7pA:
undetectable		 2j9dJ-3v7pA:
15.11
2j9dK-3v7pA:
15.11
2j9dL-3v7pA:
15.11
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.
3v7p AMIDOHYDROLASE
FAMILY PROTEIN

(Nitratiruptor
sp. SB155-2) 		PF01979
(Amidohydro_1) 		4 LYS A 394
GLU A 401
GLU A  46
ILE A   4
 None
 0.94A 2j9dJ-3v7pA:
undetectable
2j9dK-3v7pA:
undetectable
2j9dL-3v7pA:
undetectable		 2j9dJ-3v7pA:
15.11
2j9dK-3v7pA:
15.11
2j9dL-3v7pA:
15.11
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.
3zh4 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Streptococcus
pneumoniae) 		PF00275
(EPSP_synthase) 		4 ILE A 253
LYS A 406
ILE A  16
GLU A 236
 None
 0.84A 2j9dJ-3zh4A:
undetectable
2j9dK-3zh4A:
undetectable
2j9dL-3zh4A:
undetectable		 2j9dJ-3zh4A:
16.67
2j9dK-3zh4A:
16.67
2j9dL-3zh4A:
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.
4b6l SERINE/THREONINE-PRO
TEIN KINASE PLK3

(Homo sapiens) 		PF00069
(Pkinase) 		4 ILE A  93
LYS A 106
GLU A 110
ILE A 107
 None
 0.87A 2j9dJ-4b6lA:
2.2
2j9dK-4b6lA:
2.2
2j9dL-4b6lA:
2.0		 2j9dJ-4b6lA:
16.40
2j9dK-4b6lA:
16.40
2j9dL-4b6lA:
16.40
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.
4b93 VESICLE-ASSOCIATED
MEMBRANE PROTEIN 7

(Mus musculus) 		PF00957
(Synaptobrevin)
PF13774
(Longin) 		4 LYS A  42
ILE A  55
GLU A 135
LYS A  83
 None
 0.86A 2j9dJ-4b93A:
undetectable
2j9dK-4b93A:
undetectable
2j9dL-4b93A:
undetectable		 2j9dJ-4b93A:
20.61
2j9dK-4b93A:
20.61
2j9dL-4b93A:
20.61
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.
4b93 VESICLE-ASSOCIATED
MEMBRANE PROTEIN 7

(Mus musculus) 		PF00957
(Synaptobrevin)
PF13774
(Longin) 		4 LYS A  83
LYS A  42
ILE A  55
GLU A 135
 None
 0.88A 2j9dJ-4b93A:
undetectable
2j9dK-4b93A:
undetectable
2j9dL-4b93A:
undetectable		 2j9dJ-4b93A:
20.61
2j9dK-4b93A:
20.61
2j9dL-4b93A:
20.61
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.
4c1o BETA-XYLOSIDASE

(Parageobacillus
thermoglucosidasius) 		PF03512
(Glyco_hydro_52) 		4 GLU A 305
ILE A 304
ILE A 165
GLU A 167
 None
 0.94A 2j9dJ-4c1oA:
undetectable
2j9dK-4c1oA:
undetectable
2j9dL-4c1oA:
undetectable		 2j9dJ-4c1oA:
10.47
2j9dK-4c1oA:
10.47
2j9dL-4c1oA:
10.47
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.
4erd TELOMERASE
ASSOCIATED PROTEIN
P65

(Tetrahymena
thermophila) 		PF08777
(RRM_3) 		4 LYS A 382
ILE A 499
GLU A 506
ILE A 502
 None
 0.86A 2j9dJ-4erdA:
4.5
2j9dK-4erdA:
3.0
2j9dL-4erdA:
undetectable		 2j9dJ-4erdA:
20.29
2j9dK-4erdA:
20.29
2j9dL-4erdA:
20.29
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.
4evz HISF-LUCA

(synthetic
construct) 		PF00977
(His_biosynth) 		4 GLU A 167
ILE A 199
GLU A  46
ILE A   7
 None
 0.94A 2j9dJ-4evzA:
undetectable
2j9dK-4evzA:
undetectable
2j9dL-4evzA:
undetectable		 2j9dJ-4evzA:
21.46
2j9dK-4evzA:
21.46
2j9dL-4evzA:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fwt ELONGATION FACTOR
TS, ELONGATION
FACTOR TU, LINKER, Q
BETA REPLICASE

(Escherichia
coli;
Escherichia
virus Qbeta) 		PF00009
(GTP_EFTU)
PF00889
(EF_TS)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2)
PF03431
(RNA_replicase_B) 		4 ILE A 491
GLU A 552
ILE A 520
GLU A 557
 None
 0.71A 2j9dJ-4fwtA:
1.8
2j9dK-4fwtA:
undetectable
2j9dL-4fwtA:
undetectable		 2j9dJ-4fwtA:
7.08
2j9dK-4fwtA:
7.08
2j9dL-4fwtA:
7.08
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.
4grs PHOSPHO-2-DEHYDRO-3-
DEOXYHEPTONATE
ALDOLASE,
2-DEHYDRO-3-DEOXYPHO
SPHOHEPTONATE
ALDOLASE

(Pyrococcus
furiosus;
Thermotoga
maritima) 		PF00793
(DAHP_synth_1) 		4 LYS A  32
ILE A  30
GLU A  11
ILE A  14
 None
 0.68A 2j9dJ-4grsA:
undetectable
2j9dK-4grsA:
4.0
2j9dL-4grsA:
3.6		 2j9dJ-4grsA:
16.77
2j9dK-4grsA:
16.77
2j9dL-4grsA:
16.77
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.
4koo SINGLE-STRANDED
DNA-BINDING PROTEIN
WHY1, CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF08536
(Whirly) 		4 LYS A  89
ILE A 209
GLU A 215
ILE A  87
 None
 0.88A 2j9dJ-4kooA:
undetectable
2j9dK-4kooA:
undetectable
2j9dL-4kooA:
undetectable		 2j9dJ-4kooA:
24.00
2j9dK-4kooA:
24.00
2j9dL-4kooA:
24.00
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.
4koq SINGLE-STRANDED
DNA-BINDING PROTEIN
WHY3, CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF08536
(Whirly) 		4 LYS A  93
ILE A 213
GLU A 219
ILE A  91
 None
 0.86A 2j9dJ-4koqA:
undetectable
2j9dK-4koqA:
undetectable
2j9dL-4koqA:
undetectable		 2j9dJ-4koqA:
24.40
2j9dK-4koqA:
24.40
2j9dL-4koqA:
24.40
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.
4li3 CYSTEINE SYNTHASE

(Haemophilus
influenzae) 		PF00291
(PALP) 		4 ILE X 161
ILE X 185
LYS X  31
GLU X  33
 None
 0.92A 2j9dJ-4li3X:
undetectable
2j9dK-4li3X:
undetectable
2j9dL-4li3X:
undetectable		 2j9dJ-4li3X:
20.14
2j9dK-4li3X:
20.14
2j9dL-4li3X:
20.14
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.
4lxy WLARD, A SUGAR
3N-FORMYL
TRANSFERASE

(Campylobacter
jejuni) 		PF00551
(Formyl_trans_N) 		4 LYS A 263
GLU A 240
ILE A 242
ILE A 255
 None
 0.98A 2j9dJ-4lxyA:
undetectable
2j9dK-4lxyA:
undetectable
2j9dL-4lxyA:
undetectable		 2j9dJ-4lxyA:
20.74
2j9dK-4lxyA:
20.74
2j9dL-4lxyA:
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.
4muz OROTIDINE
5'-PHOSPHATE
DECARBOXYLASE

(Archaeoglobus
fulgidus) 		PF00215
(OMPdecase) 		4 GLU A 100
ILE A  75
ILE A  25
GLU A 182
 None
 0.70A 2j9dJ-4muzA:
undetectable
2j9dK-4muzA:
undetectable
2j9dL-4muzA:
undetectable		 2j9dJ-4muzA:
22.27
2j9dK-4muzA:
22.27
2j9dL-4muzA:
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.
4n9j SERINE/THREONINE-PRO
TEIN KINASE PLK4

(Homo sapiens) 		no annotation 4 LYS A 762
GLU A 764
ILE A 765
LYS A 748
 None
 0.62A 2j9dJ-4n9jA:
undetectable
2j9dK-4n9jA:
undetectable
2j9dL-4n9jA:
undetectable		 2j9dJ-4n9jA:
19.66
2j9dK-4n9jA:
19.66
2j9dL-4n9jA:
19.66
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.
4n9j SERINE/THREONINE-PRO
TEIN KINASE PLK4

(Homo sapiens) 		no annotation 4 LYS A 762
GLU A 764
ILE A 765
LYS A 748
 None
 0.65A 2j9dJ-4n9jA:
undetectable
2j9dK-4n9jA:
undetectable
2j9dL-4n9jA:
undetectable		 2j9dJ-4n9jA:
19.66
2j9dK-4n9jA:
19.66
2j9dL-4n9jA:
19.66
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.
4pu5 TOXIN-ANTITOXIN
SYSTEM TOXIN HIPA
FAMILY

(Shewanella
oneidensis) 		PF07804
(HipA_C)
PF13657
(Couple_hipA) 		4 LYS A 215
ILE A 208
GLU A 403
ILE A 187
 None
 0.91A 2j9dJ-4pu5A:
undetectable
2j9dK-4pu5A:
0.5
2j9dL-4pu5A:
undetectable		 2j9dJ-4pu5A:
15.19
2j9dK-4pu5A:
15.19
2j9dL-4pu5A:
15.19
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.
4yba REGULATORY PROTEIN C

(Klebsiella
pneumoniae) 		PF01381
(HTH_3) 		4 GLU A  62
ILE A  58
LYS A   5
ILE A   6
 GLU  A  62 ( 0.6A)
ILE  A  58 ( 0.6A)
HIS  A   5 ( 0.0A)
ILE  A   6 ( 0.6A)
 0.85A 2j9dJ-4ybaA:
undetectable
2j9dK-4ybaA:
undetectable
2j9dL-4ybaA:
undetectable		 2j9dJ-4ybaA:
23.53
2j9dK-4ybaA:
23.53
2j9dL-4ybaA:
23.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c65 SOLUTE CARRIER
FAMILY 2,
FACILITATED GLUCOSE
TRANSPORTER MEMBER 3

(Homo sapiens) 		PF00083
(Sugar_tr) 		4 GLU A 391
ILE A 388
ILE A 384
GLU A 452
 None
 0.90A 2j9dJ-5c65A:
undetectable
2j9dK-5c65A:
undetectable
2j9dL-5c65A:
undetectable		 2j9dJ-5c65A:
13.51
2j9dK-5c65A:
13.51
2j9dL-5c65A:
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.
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo sapiens) 		PF00117
(GATase)
PF00988
(CPSase_sm_chain)
PF02142
(MGS)
PF02786
(CPSase_L_D2)
PF02787
(CPSase_L_D3) 		4 LYS A 740
GLU A 455
ILE A 745
ILE A 750
 None
 0.93A 2j9dJ-5dotA:
undetectable
2j9dK-5dotA:
undetectable
2j9dL-5dotA:
undetectable		 2j9dJ-5dotA:
5.87
2j9dK-5dotA:
5.87
2j9dL-5dotA:
5.87
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.
5dyq YD REPEAT-CONTAINING
PROTEIN

(Verrucosispora
maris) 		no annotation 4 GLU A  78
ILE A  80
ILE A 137
GLU A  19
 None
 0.91A 2j9dJ-5dyqA:
undetectable
2j9dK-5dyqA:
undetectable
2j9dL-5dyqA:
undetectable		 2j9dJ-5dyqA:
23.31
2j9dK-5dyqA:
23.31
2j9dL-5dyqA:
23.31
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.
5fzo PROBABLE JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION PROT
EIN 2C

(Homo sapiens) 		PF02373
(JmjC) 		4 LYS A2408
GLU A2412
ILE A2409
GLU A2442
 None
 0.83A 2j9dJ-5fzoA:
undetectable
2j9dK-5fzoA:
undetectable
2j9dL-5fzoA:
undetectable		 2j9dJ-5fzoA:
15.36
2j9dK-5fzoA:
15.36
2j9dL-5fzoA:
15.36
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.
5fzo PROBABLE JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION PROT
EIN 2C

(Homo sapiens) 		PF02373
(JmjC) 		4 LYS A2408
GLU A2412
ILE A2409
GLU A2442
 None
 0.84A 2j9dJ-5fzoA:
undetectable
2j9dK-5fzoA:
undetectable
2j9dL-5fzoA:
undetectable		 2j9dJ-5fzoA:
15.36
2j9dK-5fzoA:
15.36
2j9dL-5fzoA:
15.36
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.
5h5m ALPHA-CATENIN-LIKE
PROTEIN HMP-1

(Caenorhabditis
elegans) 		PF01044
(Vinculin) 		4 LYS A 482
GLU A 479
ILE A 396
LYS A 403
 None
 0.97A 2j9dJ-5h5mA:
undetectable
2j9dK-5h5mA:
undetectable
2j9dL-5h5mA:
undetectable		 2j9dJ-5h5mA:
15.08
2j9dK-5h5mA:
15.08
2j9dL-5h5mA:
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.
5hm5 TOPOISOMERASE V

(Methanopyrus
kandleri) 		PF13412
(HTH_24)
PF14520
(HHH_5) 		4 GLU A 171
ILE A 174
GLU A 186
ILE A 181
 None
 0.85A 2j9dJ-5hm5A:
undetectable
2j9dK-5hm5A:
undetectable
2j9dL-5hm5A:
undetectable		 2j9dJ-5hm5A:
9.72
2j9dK-5hm5A:
9.72
2j9dL-5hm5A:
9.72
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.
5hm5 TOPOISOMERASE V

(Methanopyrus
kandleri) 		PF13412
(HTH_24)
PF14520
(HHH_5) 		4 GLU A 186
ILE A 181
GLU A 171
ILE A 174
 None
 0.93A 2j9dJ-5hm5A:
undetectable
2j9dK-5hm5A:
undetectable
2j9dL-5hm5A:
undetectable		 2j9dJ-5hm5A:
9.72
2j9dK-5hm5A:
9.72
2j9dL-5hm5A:
9.72
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.
5ihx TYROSINE--TRNA
LIGASE,
MITOCHONDRIAL

(Aspergillus
nidulans) 		PF00579
(tRNA-synt_1b) 		4 LYS A 387
GLU A 383
ILE A 397
ILE A 394
 None
 0.98A 2j9dJ-5ihxA:
undetectable
2j9dK-5ihxA:
undetectable
2j9dL-5ihxA:
undetectable		 2j9dJ-5ihxA:
17.01
2j9dK-5ihxA:
17.01
2j9dL-5ihxA:
17.01
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.
5iy2 BETA-LACTAMASE
OXA-143

(Acinetobacter
baumannii) 		PF00905
(Transpeptidase) 		4 LYS A 202
GLU A 199
LYS A 243
GLU A 237
 None
 0.88A 2j9dJ-5iy2A:
undetectable
2j9dK-5iy2A:
undetectable
2j9dL-5iy2A:
undetectable		 2j9dJ-5iy2A:
19.58
2j9dK-5iy2A:
19.58
2j9dL-5iy2A:
19.58
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.
5iy2 BETA-LACTAMASE
OXA-143

(Acinetobacter
baumannii) 		PF00905
(Transpeptidase) 		4 LYS A 202
GLU A 199
LYS A 243
GLU A 237
 None
 0.88A 2j9dJ-5iy2A:
undetectable
2j9dK-5iy2A:
undetectable
2j9dL-5iy2A:
undetectable		 2j9dJ-5iy2A:
19.58
2j9dK-5iy2A:
19.58
2j9dL-5iy2A:
19.58
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.
5iy2 BETA-LACTAMASE
OXA-143

(Acinetobacter
baumannii) 		PF00905
(Transpeptidase) 		4 LYS A 243
GLU A 237
LYS A 202
GLU A 199
 None
 0.90A 2j9dJ-5iy2A:
undetectable
2j9dK-5iy2A:
undetectable
2j9dL-5iy2A:
undetectable		 2j9dJ-5iy2A:
19.58
2j9dK-5iy2A:
19.58
2j9dL-5iy2A:
19.58
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.
5juf TRANSCRIPTIONAL
REGULATOR

(Streptococcus
thermophilus) 		PF01381
(HTH_3) 		4 LYS A  42
GLU A  44
ILE A  38
GLU A 143
 None
 0.96A 2j9dJ-5jufA:
undetectable
2j9dK-5jufA:
undetectable
2j9dL-5jufA:
undetectable		 2j9dJ-5jufA:
18.69
2j9dK-5jufA:
18.69
2j9dL-5jufA:
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.
5kbp GLYCOSYL HYDROLASE,
FAMILY 38

(Enterococcus
faecalis) 		PF01074
(Glyco_hydro_38)
PF07748
(Glyco_hydro_38C)
PF09261
(Alpha-mann_mid) 		4 GLU A 110
ILE A 106
GLU A 835
LYS A 342
 None
 0.94A 2j9dJ-5kbpA:
undetectable
2j9dK-5kbpA:
undetectable
2j9dL-5kbpA:
undetectable		 2j9dJ-5kbpA:
9.12
2j9dK-5kbpA:
9.12
2j9dL-5kbpA:
9.12
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.
5kbp GLYCOSYL HYDROLASE,
FAMILY 38

(Enterococcus
faecalis) 		PF01074
(Glyco_hydro_38)
PF07748
(Glyco_hydro_38C)
PF09261
(Alpha-mann_mid) 		4 LYS A 342
GLU A 110
ILE A 106
GLU A 835
 None
 0.92A 2j9dJ-5kbpA:
undetectable
2j9dK-5kbpA:
undetectable
2j9dL-5kbpA:
undetectable		 2j9dJ-5kbpA:
9.12
2j9dK-5kbpA:
9.12
2j9dL-5kbpA:
9.12
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.
5lf7 PROTEASOME SUBUNIT
BETA TYPE-1

(Homo sapiens) 		PF00227
(Proteasome) 		4 GLU L 206
ILE L 195
ILE L  22
LYS L 176
 None
 0.96A 2j9dJ-5lf7L:
undetectable
2j9dK-5lf7L:
undetectable
2j9dL-5lf7L:
1.3		 2j9dJ-5lf7L:
17.84
2j9dK-5lf7L:
17.84
2j9dL-5lf7L:
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.
5oc9 -

(-) 		no annotation 4 LYS A 466
LYS A 486
GLU A 487
ILE A 483
 None
 0.96A 2j9dJ-5oc9A:
3.5
2j9dK-5oc9A:
undetectable
2j9dL-5oc9A:
2.1		 2j9dJ-5oc9A:
undetectable
2j9dK-5oc9A:
undetectable
2j9dL-5oc9A:
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.
5ohx CYSTATHIONINE
BETA-SYNTHASE

(Apis mellifera) 		no annotation 4 ILE A 199
ILE A 223
LYS A  67
GLU A  69
 None
 0.97A 2j9dJ-5ohxA:
undetectable
2j9dK-5ohxA:
undetectable
2j9dL-5ohxA:
undetectable		 2j9dJ-5ohxA:
undetectable
2j9dK-5ohxA:
undetectable
2j9dL-5ohxA:
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.
5opq 3,6-ANHYDRO-D-GALACT
OSIDASE

(Zobellia
galactanivorans) 		no annotation 5 GLU A 649
ILE A 651
GLU A 662
ILE A 661
GLU A 631
 None
 1.24A 2j9dJ-5opqA:
undetectable
2j9dK-5opqA:
undetectable
2j9dL-5opqA:
undetectable		 2j9dJ-5opqA:
undetectable
2j9dK-5opqA:
undetectable
2j9dL-5opqA:
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.
5ui5 RNA POLYMERASE SIGMA
FACTOR RPON

(Aquifex
aeolicus) 		PF04552
(Sigma54_DBD)
PF04963
(Sigma54_CBD) 		4 ILE I 162
LYS I 177
GLU I 179
ILE I 180
 None
 0.95A 2j9dJ-5ui5I:
undetectable
2j9dK-5ui5I:
undetectable
2j9dL-5ui5I:
undetectable		 2j9dJ-5ui5I:
16.37
2j9dK-5ui5I:
16.37
2j9dL-5ui5I:
16.37
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.
5wti CRISPR-ASSOCIATED
PROTEIN

(Bacillus
thermoamylovorans) 		no annotation 4 GLU Z  68
ILE Z  65
GLU Z  48
ILE Z  46
 None
 0.90A 2j9dJ-5wtiZ:
undetectable
2j9dK-5wtiZ:
undetectable
2j9dL-5wtiZ:
undetectable		 2j9dJ-5wtiZ:
7.16
2j9dK-5wtiZ:
7.16
2j9dL-5wtiZ:
7.16
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.
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) 		5 GLU A1153
LYS A1237
GLU A1198
ILE A1239
GLU A1167
 None
 1.35A 2j9dJ-5xogA:
2.5
2j9dK-5xogA:
2.4
2j9dL-5xogA:
1.9		 2j9dJ-5xogA:
6.28
2j9dK-5xogA:
6.28
2j9dL-5xogA:
6.28
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.
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) 		5 LYS A1237
GLU A1198
ILE A1239
GLU A1167
GLU A1153
 None
 1.34A 2j9dJ-5xogA:
2.5
2j9dK-5xogA:
2.4
2j9dL-5xogA:
1.9		 2j9dJ-5xogA:
6.28
2j9dK-5xogA:
6.28
2j9dL-5xogA:
6.28
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.
6bwc POLYSACCHARIDE
BIOSYNTHESIS PROTEIN
CAPD

(Bacillus
thuringiensis) 		no annotation 4 GLU A 278
ILE A 291
ILE A 226
GLU A 145
 None
 0.91A 2j9dJ-6bwcA:
undetectable
2j9dK-6bwcA:
undetectable
2j9dL-6bwcA:
undetectable		 2j9dJ-6bwcA:
undetectable
2j9dK-6bwcA:
undetectable
2j9dL-6bwcA:
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.
6cwo RIBONUCLEOTIDE
REDUCTASE

(Flavobacterium
johnsoniae) 		no annotation 4 GLU A 160
ILE A 159
GLU A  67
ILE A  66
 MN  A 402 (-2.5A)
None
MN  A 401 (-2.0A)
None
 0.78A 2j9dJ-6cwoA:
undetectable
2j9dK-6cwoA:
undetectable
2j9dL-6cwoA:
undetectable		 2j9dJ-6cwoA:
undetectable
2j9dK-6cwoA:
undetectable
2j9dL-6cwoA:
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.
6d6v TELOMERASE
ASSOCIATED PROTEIN
P65

(Tetrahymena
thermophila) 		no annotation 4 LYS H 382
ILE H 499
GLU H 506
ILE H 502
 None
 0.84A 2j9dJ-6d6vH:
4.0
2j9dK-6d6vH:
2.7
2j9dL-6d6vH:
3.5		 2j9dJ-6d6vH:
undetectable
2j9dK-6d6vH:
undetectable
2j9dL-6d6vH:
undetectable