SIMILAR PATTERNS OF AMINO ACIDS FOR 1Q8J_A_C2FA801_0

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.
1dqz PROTEIN (ANTIGEN
85-C)

(Mycobacterium
tuberculosis) 		PF00756
(Esterase) 		5 ASN A  52
ILE A  51
GLY A  39
SER A 126
PHE A 150
 None
 1.28A 1q8jA-1dqzA:
undetectable		 1q8jA-1dqzA:
16.84
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.
1eye DIHYDROPTEROATE
SYNTHASE I

(Mycobacterium
tuberculosis) 		PF00809
(Pterin_bind) 		5 ASP A  86
ASN A 105
ASP A 177
GLY A 209
SER A 211
 PMM  A 301 (-3.2A)
PMM  A 301 (-2.9A)
PMM  A 301 (-3.1A)
PMM  A 301 (-3.5A)
None
 0.62A 1q8jA-1eyeA:
13.1		 1q8jA-1eyeA:
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.
1f6y 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Moorella
thermoacetica) 		PF00809
(Pterin_bind) 		10 ASN A   9
ARG A   7
ASP A  75
ASN A  96
ILE A 120
ASP A 160
GLY A 196
SER A 198
ARG A 207
ILE A 227
 None
 0.97A 1q8jA-1f6yA:
13.8		 1q8jA-1f6yA:
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.
1f6y 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Moorella
thermoacetica) 		PF00809
(Pterin_bind) 		10 GLU A   6
ASN A   9
ASP A  75
ASN A  96
ILE A 120
ASP A 160
GLY A 196
SER A 198
ARG A 207
ILE A 227
 None
 0.54A 1q8jA-1f6yA:
13.8		 1q8jA-1f6yA:
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.
1h54 MALTOSE
PHOSPHORYLASE

(Lactobacillus
brevis) 		PF03632
(Glyco_hydro_65m)
PF03633
(Glyco_hydro_65C)
PF03636
(Glyco_hydro_65N) 		5 ASN A  86
ILE A  88
ASP A  41
GLY A  53
ILE A  54
 None
 1.48A 1q8jA-1h54A:
undetectable		 1q8jA-1h54A:
22.18
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.
1lrt INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE

(Tritrichomonas
suis) 		PF00478
(IMPDH) 		5 ARG A 299
ASP A 294
ILE A 313
GLY A 265
ILE A 292
 None
None
TAD  A 901 (-4.1A)
None
None
 1.32A 1q8jA-1lrtA:
6.5		 1q8jA-1lrtA:
21.75
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.
1tww DHPS,
DIHYDROPTEROATE
SYNTHASE

(Bacillus
anthracis) 		PF00809
(Pterin_bind) 		6 ASP A 101
ASN A 120
ILE A 143
ASP A 184
GLY A 216
SER A 218
 HH2  A 282 (-3.4A)
HH2  A 282 (-2.7A)
HH2  A 282 (-4.1A)
HH2  A 282 (-3.1A)
HH2  A 282 (-3.3A)
None
 0.63A 1q8jA-1twwA:
22.6		 1q8jA-1twwA:
21.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1up2 CELA1 PROTEIN

(Mycobacterium
tuberculosis) 		PF01341
(Glyco_hydro_6) 		5 ASP A 303
ILE A 202
ASP A 244
GLY A 246
SER A 248
 None
 1.45A 1q8jA-1up2A:
7.2		 1q8jA-1up2A:
18.07
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.
1up2 CELA1 PROTEIN

(Mycobacterium
tuberculosis) 		PF01341
(Glyco_hydro_6) 		5 GLU A 284
ILE A 202
ASP A 244
GLY A 246
SER A 248
 None
 1.29A 1q8jA-1up2A:
7.2		 1q8jA-1up2A:
18.07
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.
1ygu LEUKOCYTE COMMON
ANTIGEN

(Homo sapiens) 		PF00102
(Y_phosphatase) 		5 ASN A 735
ASP A 705
GLY A 702
SER A 829
ARG A 834
 None
 1.34A 1q8jA-1yguA:
undetectable		 1q8jA-1yguA:
22.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a9f PUTATIVE MALIC
ENZYME
((S)-MALATE:NAD+
OXIDOREDUCTASE
(DECARBOXYLATING))

(Streptococcus
pyogenes) 		PF00390
(malic)
PF03949
(Malic_M) 		5 ASN A 135
ASP A 162
ILE A 169
GLY A 327
ILE A 328
 None
 1.33A 1q8jA-2a9fA:
4.0		 1q8jA-2a9fA:
23.75
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.
2bmb FOLIC ACID SYNTHESIS
PROTEIN FOL1

(Saccharomyces
cerevisiae) 		PF00809
(Pterin_bind)
PF01288
(HPPK) 		5 ASN A 551
ASP A 636
ILE A 679
ASP A 755
SER A 805
 PMM  A1865 ( 3.8A)
PMM  A1865 (-3.3A)
PMM  A1865 ( 4.7A)
PMM  A1865 (-3.2A)
None
 0.89A 1q8jA-2bmbA:
11.7		 1q8jA-2bmbA:
21.25
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.
2bmb FOLIC ACID SYNTHESIS
PROTEIN FOL1

(Saccharomyces
cerevisiae) 		PF00809
(Pterin_bind)
PF01288
(HPPK) 		6 ASP A 636
ASN A 655
ILE A 679
ASP A 755
GLY A 803
SER A 805
 PMM  A1865 (-3.3A)
PMM  A1865 (-2.9A)
PMM  A1865 ( 4.7A)
PMM  A1865 (-3.2A)
PMM  A1865 (-3.5A)
None
 0.62A 1q8jA-2bmbA:
11.7		 1q8jA-2bmbA:
21.25
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.
2bty ACETYLGLUTAMATE
KINASE

(Thermotoga
maritima) 		PF00696
(AA_kinase) 		5 GLU A  95
ASP A 124
ILE A 165
GLY A 169
SER A 176
 None
 1.49A 1q8jA-2btyA:
undetectable		 1q8jA-2btyA:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2buf ACETYLGLUTAMATE
KINASE

(Pseudomonas
aeruginosa) 		PF00696
(AA_kinase) 		5 GLU A 101
ASP A 130
ILE A 182
GLY A 186
SER A 193
 None
 1.48A 1q8jA-2bufA:
undetectable		 1q8jA-2bufA:
21.74
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.
2bvt BETA-1,4-MANNANASE

(Cellulomonas
fimi) 		PF02156
(Glyco_hydro_26) 		5 GLU A 175
ASN A 176
ILE A 267
ASP A 263
GLY A 221
 CAC  A 600 (-2.6A)
None
None
None
None
 1.29A 1q8jA-2bvtA:
7.5		 1q8jA-2bvtA:
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.
2bw2 BYPASS OF FORESPORE
C

(Bacillus
subtilis) 		PF08955
(BofC_C)
PF08977
(BOFC_N) 		5 ASN A  72
ASP A  21
ILE A 132
GLY A  76
ILE A  75
 None
 1.35A 1q8jA-2bw2A:
undetectable		 1q8jA-2bw2A:
13.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cev PROTEIN (ARGINASE)

([Bacillus]
caldovelox) 		PF00491
(Arginase) 		5 GLU A 271
ASN A 273
ASP A  21
ILE A  51
GLY A  14
 None
 1.17A 1q8jA-2cevA:
undetectable		 1q8jA-2cevA:
20.53
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.
2dqw DIHYDROPTEROATE
SYNTHASE

(Thermus
thermophilus) 		PF00809
(Pterin_bind) 		5 ASP A 109
ASN A 128
ASP A 197
GLY A 229
SER A 231
 None
 1.00A 1q8jA-2dqwA:
21.7		 1q8jA-2dqwA:
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.
2gzh RAS-RELATED PROTEIN
RAB-11A

(Homo sapiens) 		PF00071
(Ras) 		5 GLU A 171
ILE A  64
SER A 149
PHE A 150
ILE A 168
 None
 1.18A 1q8jA-2gzhA:
2.4		 1q8jA-2gzhA:
16.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hfs MEVALONATE KINASE,
PUTATIVE

(Leishmania
major) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		5 GLU A 144
ASN A 156
ILE A  20
GLY A 110
SER A 112
 None
 1.36A 1q8jA-2hfsA:
undetectable		 1q8jA-2hfsA:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2j5c 1,8-CINEOLE SYNTHASE

(Salvia
fruticosa) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		5 ARG A 558
ASN A 338
GLY A 448
SER A 481
ILE A 451
 None
 1.36A 1q8jA-2j5cA:
undetectable		 1q8jA-2j5cA:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2osa N-CHIMAERIN

(Homo sapiens) 		PF00620
(RhoGAP) 		5 GLU A 291
ASP A 335
ASN A 337
GLY A 296
SER A 294
 None
 1.21A 1q8jA-2osaA:
undetectable		 1q8jA-2osaA:
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.
2pq0 HYPOTHETICAL
CONSERVED PROTEIN
GK1056

(Geobacillus
kaustophilus) 		PF08282
(Hydrolase_3) 		5 GLU A 213
ASN A 210
ASP A   9
ILE A  41
SER A 183
 None
 1.38A 1q8jA-2pq0A:
undetectable		 1q8jA-2pq0A:
19.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qne PUTATIVE
METHYLTRANSFERASE

(Desulfitobacterium
hafniense) 		PF06253
(MTTB) 		5 ARG A 106
ASN A 315
ASP A 364
GLY A 348
ILE A 349
 None
 1.30A 1q8jA-2qneA:
15.7		 1q8jA-2qneA:
24.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qzj TWO-COMPONENT
RESPONSE REGULATOR

(Clostridioides
difficile) 		PF00072
(Response_reg) 		5 GLU A  38
ASN A  36
ILE A  70
GLY A  42
ILE A  41
 None
 1.34A 1q8jA-2qzjA:
4.1		 1q8jA-2qzjA:
13.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vef DIHYDROPTEROATE
SYNTHASE

(Streptococcus
pneumoniae) 		PF00809
(Pterin_bind) 		5 ASP A  91
ASN A 110
ASP A 201
GLY A 233
SER A 235
 None
 0.70A 1q8jA-2vefA:
20.0		 1q8jA-2vefA:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2y5j DIHYDROPTEROATE
SYNTHASE

(Burkholderia
cenocepacia) 		PF00809
(Pterin_bind) 		5 ASP A 101
ASN A 120
ASP A 191
GLY A 229
SER A 231
 None
None
None
None
EDO  A1294 (-2.6A)
 0.72A 1q8jA-2y5jA:
8.8		 1q8jA-2y5jA:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ycj 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Carboxydothermus
hydrogenoformans) 		PF00809
(Pterin_bind) 		9 ASN A  10
ARG A   8
ASP A  76
ASN A  97
ILE A 121
ASP A 161
GLY A 197
SER A 199
ARG A 208
 C2F  A3000 ( 4.8A)
None
C2F  A3000 (-3.4A)
C2F  A3000 (-3.0A)
C2F  A3000 ( 4.2A)
C2F  A3000 (-3.5A)
C2F  A3000 (-3.6A)
GOL  A1270 ( 3.9A)
C2F  A3000 ( 2.6A)
 0.93A 1q8jA-2ycjA:
13.6		 1q8jA-2ycjA:
19.14
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.
2ycj 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Carboxydothermus
hydrogenoformans) 		PF00809
(Pterin_bind) 		10 GLU A   7
ASN A  10
ASP A  76
ASN A  97
ILE A 121
ASP A 161
GLY A 197
SER A 199
ARG A 208
ILE A 228
 C2F  A3000 ( 4.1A)
C2F  A3000 ( 4.8A)
C2F  A3000 (-3.4A)
C2F  A3000 (-3.0A)
C2F  A3000 ( 4.2A)
C2F  A3000 (-3.5A)
C2F  A3000 (-3.6A)
GOL  A1270 ( 3.9A)
C2F  A3000 ( 2.6A)
C2F  A3000 (-4.6A)
 0.37A 1q8jA-2ycjA:
13.6		 1q8jA-2ycjA:
19.14
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.
2yl2 ACETYL-COA
CARBOXYLASE 1

(Homo sapiens) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 ASN A 643
ILE A 432
ASP A 414
ARG A 419
ILE A 645
 None
 1.37A 1q8jA-2yl2A:
undetectable		 1q8jA-2yl2A:
22.94
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.
2ynm LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE SUBUNIT B

(Prochlorococcus
marinus) 		PF00148
(Oxidored_nitro)
PF08369
(PCP_red) 		5 GLU D 227
ASN D 130
ASN D 352
GLY D 303
PHE D 179
 None
 1.43A 1q8jA-2ynmD:
undetectable		 1q8jA-2ynmD:
24.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3bol 5-METHYLTETRAHYDROFO
LATE S-HOMOCYSTEINE
METHYLTRANSFERASE

(Thermotoga
maritima) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		7 ARG A 321
ASP A 390
ASN A 411
ILE A 435
ASP A 473
GLY A 505
SER A 507
 None
 1.42A 1q8jA-3bolA:
61.2		 1q8jA-3bolA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3bol 5-METHYLTETRAHYDROFO
LATE S-HOMOCYSTEINE
METHYLTRANSFERASE

(Thermotoga
maritima) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		6 ASN A 323
ARG A 327
ASP A 358
ILE A 435
ASP A 473
GLY A 505
 None
 1.41A 1q8jA-3bolA:
61.2		 1q8jA-3bolA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3bol 5-METHYLTETRAHYDROFO
LATE S-HOMOCYSTEINE
METHYLTRANSFERASE

(Thermotoga
maritima) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		10 GLU A 320
ASN A 323
ARG A 327
ASP A 390
ASN A 411
ILE A 435
ASP A 473
GLY A 505
SER A 507
ILE A 536
 None
 0.23A 1q8jA-3bolA:
61.2		 1q8jA-3bolA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cnh HYDROLASE FAMILY
PROTEIN

(Deinococcus
radiodurans) 		PF13419
(HAD_2) 		5 GLU A 109
ASP A  20
ASP A 165
GLY A  11
PHE A 121
 PO4  A 201 ( 4.6A)
None
NA  A 200 (-2.9A)
PO4  A 201 ( 3.5A)
None
 1.40A 1q8jA-3cnhA:
2.4		 1q8jA-3cnhA:
17.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cpx AMINOPEPTIDASE, M42
FAMILY

(Cytophaga
hutchinsonii) 		PF05343
(Peptidase_M42) 		5 ASN A  16
GLY A  70
SER A  68
ARG A 148
ILE A  82
 None
 1.30A 1q8jA-3cpxA:
undetectable		 1q8jA-3cpxA:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dkh LACCASE-1

(Melanocarpus
albomyces) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 GLU A 519
ASP A 516
ASP A 106
GLY A 437
PHE A 440
 None
 1.44A 1q8jA-3dkhA:
undetectable		 1q8jA-3dkhA:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e3a POSSIBLE PEROXIDASE
BPOC

(Mycobacterium
tuberculosis) 		PF12697
(Abhydrolase_6) 		5 ARG A 120
ILE A 174
GLY A  20
SER A  87
PHE A  91
 None
 1.30A 1q8jA-3e3aA:
undetectable		 1q8jA-3e3aA:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fe1 HEAT SHOCK 70 KDA
PROTEIN 6

(Homo sapiens) 		PF00012
(HSP70) 		5 ASN A 362
ASP A 335
ILE A 214
ASP A 188
GLY A 186
 None
 1.48A 1q8jA-3fe1A:
2.7		 1q8jA-3fe1A:
22.63
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.
3gvx GLYCERATE
DEHYDROGENASE
RELATED PROTEIN

(Thermoplasma
acidophilum) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 GLU A  70
ILE A  63
ASP A  64
GLY A  67
ILE A  68
 None
 1.39A 1q8jA-3gvxA:
2.2		 1q8jA-3gvxA:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hpf MUCONATE
CYCLOISOMERASE

(Oceanobacillus
iheyensis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ASN A 336
ILE A  37
ASP A 106
GLY A 356
ILE A 357
 None
 1.42A 1q8jA-3hpfA:
7.8		 1q8jA-3hpfA:
20.75
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.
3iau THREONINE DEAMINASE

(Solanum
lycopersicum) 		PF00291
(PALP) 		5 GLU A 201
ARG A 204
ILE A 214
GLY A 196
ILE A 198
 None
 1.28A 1q8jA-3iauA:
2.8		 1q8jA-3iauA:
22.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jyf 2',3'-CYCLIC
NUCLEOTIDE
2'-PHOSPHODIESTERASE
/3'-NUCLEOTIDASE
BIFUNCTIONAL
PERIPLASMIC PROTEIN

(Klebsiella
pneumoniae) 		PF00149
(Metallophos) 		5 GLU A  13
ILE A 306
ASP A 278
GLY A 274
PHE A 247
 None
 1.33A 1q8jA-3jyfA:
undetectable		 1q8jA-3jyfA:
21.19
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.
3k13 5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE

(Bacteroides
thetaiotaomicron) 		PF00809
(Pterin_bind) 		7 ARG A 359
ASP A 431
ASN A 452
ASP A 519
GLY A 558
SER A 560
ARG A 573
 None
THH  A 642 (-3.3A)
THH  A 642 (-3.0A)
THH  A 642 (-3.4A)
THH  A 642 (-3.3A)
K  A 644 ( 3.4A)
THH  A 642 (-3.1A)
 1.26A 1q8jA-3k13A:
12.3		 1q8jA-3k13A:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k13 5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE

(Bacteroides
thetaiotaomicron) 		PF00809
(Pterin_bind) 		9 GLU A 358
ASN A 361
ASP A 431
ASN A 452
ASP A 519
GLY A 558
SER A 560
ARG A 573
ILE A 593
 THH  A 642 ( 3.5A)
GOL  A 643 (-3.1A)
THH  A 642 (-3.3A)
THH  A 642 (-3.0A)
THH  A 642 (-3.4A)
THH  A 642 (-3.3A)
K  A 644 ( 3.4A)
THH  A 642 (-3.1A)
THH  A 642 (-4.2A)
 0.47A 1q8jA-3k13A:
12.3		 1q8jA-3k13A:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k13 5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE

(Bacteroides
thetaiotaomicron) 		PF00809
(Pterin_bind) 		8 GLU A 358
ASN A 361
ASP A 431
GLY A 558
SER A 560
PHE A 564
ARG A 573
ILE A 593
 THH  A 642 ( 3.5A)
GOL  A 643 (-3.1A)
THH  A 642 (-3.3A)
THH  A 642 (-3.3A)
K  A 644 ( 3.4A)
None
THH  A 642 (-3.1A)
THH  A 642 (-4.2A)
 0.79A 1q8jA-3k13A:
12.3		 1q8jA-3k13A:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n6r PROPIONYL-COA
CARBOXYLASE, ALPHA
SUBUNIT

(Ruegeria
pomeroyi) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 ARG A 419
ILE A 414
GLY A 479
ARG A 628
ILE A 478
 None
 1.07A 1q8jA-3n6rA:
2.0		 1q8jA-3n6rA:
22.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ne5 CATION EFFLUX SYSTEM
PROTEIN CUSA

(Escherichia
coli) 		PF00873
(ACR_tran) 		5 GLU A 141
ASN A 279
ASP A 593
GLY A 607
ARG A 669
 None
 1.35A 1q8jA-3ne5A:
undetectable		 1q8jA-3ne5A:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tr9 DIHYDROPTEROATE
SYNTHASE

(Coxiella
burnetii) 		PF00809
(Pterin_bind) 		5 ASN A  35
ASP A 111
ASN A 130
ASP A 199
SER A 236
 CL  A 315 (-3.6A)
PT1  A1001 ( 3.4A)
PT1  A1001 ( 2.9A)
PT1  A1001 (-3.3A)
None
 0.77A 1q8jA-3tr9A:
5.2		 1q8jA-3tr9A:
20.28
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.
3tr9 DIHYDROPTEROATE
SYNTHASE

(Coxiella
burnetii) 		PF00809
(Pterin_bind) 		5 ASP A  67
ASN A 130
ASP A 199
GLY A 234
SER A 236
 None
PT1  A1001 ( 2.9A)
PT1  A1001 (-3.3A)
PT1  A1001 (-3.9A)
None
 1.24A 1q8jA-3tr9A:
5.2		 1q8jA-3tr9A:
20.28
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.
3tr9 DIHYDROPTEROATE
SYNTHASE

(Coxiella
burnetii) 		PF00809
(Pterin_bind) 		5 ASP A 111
ASN A 130
ASP A 199
GLY A 234
SER A 236
 PT1  A1001 ( 3.4A)
PT1  A1001 ( 2.9A)
PT1  A1001 (-3.3A)
PT1  A1001 (-3.9A)
None
 0.72A 1q8jA-3tr9A:
5.2		 1q8jA-3tr9A:
20.28
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.
3wz4 DOTI

(Legionella
pneumophila) 		PF11393
(T4BSS_DotI_IcmL) 		5 ARG A 159
GLY A 198
SER A 200
PHE A 202
ILE A 197
 MPD  A 504 (-2.7A)
None
None
None
None
 1.42A 1q8jA-3wz4A:
undetectable		 1q8jA-3wz4A:
13.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zle APICAL MEMBRANE
ANTIGEN 1

(Toxoplasma
gondii) 		PF02430
(AMA-1) 		5 ASN A 393
ILE A 115
GLY A 122
ARG A 135
ILE A 123
 None
 1.41A 1q8jA-3zleA:
undetectable		 1q8jA-3zleA:
22.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aip FE-REGULATED PROTEIN
B

(Neisseria
meningitidis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 ARG A 465
ASP A 118
GLY A 161
SER A 505
ILE A 160
 None
 1.42A 1q8jA-4aipA:
undetectable		 1q8jA-4aipA:
22.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ccz METHIONINE SYNTHASE

(Homo sapiens) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		7 ARG A 377
ASP A 449
ASP A 537
GLY A 576
SER A 578
ARG A 591
ILE A 611
 THG  A1652 ( 4.8A)
THG  A1652 (-3.4A)
THG  A1652 (-3.4A)
THG  A1652 (-3.6A)
THG  A1652 (-4.2A)
THG  A1652 (-3.0A)
THG  A1652 (-4.2A)
 1.36A 1q8jA-4cczA:
36.8		 1q8jA-4cczA:
30.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ccz METHIONINE SYNTHASE

(Homo sapiens) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		5 ASN A 379
ASP A 449
ASN A 470
ASP A 537
ARG A 585
 THG  A1652 (-4.6A)
THG  A1652 (-3.4A)
THG  A1652 (-3.2A)
THG  A1652 (-3.4A)
THG  A1652 (-3.3A)
 0.92A 1q8jA-4cczA:
36.8		 1q8jA-4cczA:
30.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ccz METHIONINE SYNTHASE

(Homo sapiens) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		9 GLU A 376
ASN A 379
ASP A 449
ASN A 470
ASP A 537
GLY A 576
SER A 578
ARG A 591
ILE A 611
 THG  A1652 (-3.5A)
THG  A1652 (-4.6A)
THG  A1652 (-3.4A)
THG  A1652 (-3.2A)
THG  A1652 (-3.4A)
THG  A1652 (-3.6A)
THG  A1652 (-4.2A)
THG  A1652 (-3.0A)
THG  A1652 (-4.2A)
 0.61A 1q8jA-4cczA:
36.8		 1q8jA-4cczA:
30.69
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.
4drs PYRUVATE KINASE

(Cryptosporidium
parvum) 		PF00224
(PK)
PF02887
(PK_C) 		5 GLU A 272
ASN A 273
ILE A 115
GLY A 112
SER A 236
 GOL  A 603 (-3.9A)
None
None
None
GOL  A 603 ( 4.8A)
 1.42A 1q8jA-4drsA:
13.5		 1q8jA-4drsA:
22.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f92 U5 SMALL NUCLEAR
RIBONUCLEOPROTEIN
200 KDA HELICASE

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		5 GLU B1468
ARG B1762
GLY B1460
SER B1726
ILE B1459
 None
 1.28A 1q8jA-4f92B:
undetectable		 1q8jA-4f92B:
16.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fdg MINICHROMOSOME
MAINTENANCE PROTEIN
MCM

(Sulfolobus
solfataricus) 		no annotation 5 ARG B 355
ILE B 417
ASP B 413
GLY B 372
SER B 368
 None
 1.44A 1q8jA-4fdgB:
undetectable		 1q8jA-4fdgB:
24.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g4p AMINO ACID ABC
TRANSPORTER, AMINO
ACID-BINDING/PERMEAS
E PROTEIN

(Enterococcus
faecalis) 		PF00497
(SBP_bac_3) 		5 ASN A 223
ILE A 219
GLY A 207
SER A 205
PHE A 107
 None
 1.35A 1q8jA-4g4pA:
undetectable		 1q8jA-4g4pA:
18.87
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.
4igl YENC2

(Yersinia
entomophaga) 		no annotation 5 ASN B 446
ARG B 447
ASP B  57
GLY B 670
ARG B 650
 None
 1.31A 1q8jA-4iglB:
undetectable		 1q8jA-4iglB:
22.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ixu ARGINASE-2,
MITOCHONDRIAL

(Homo sapiens) 		PF00491
(Arginase) 		5 GLU A  43
ASP A  70
ILE A  49
GLY A 118
SER A  34
 None
 1.46A 1q8jA-4ixuA:
2.6		 1q8jA-4ixuA:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mx8 PERIPLASMIC BINDING
PROTEIN

(Xylanimonas
cellulosilytica) 		PF01497
(Peripla_BP_2) 		5 GLU A  27
ASN A  22
ASP A 128
GLY A 111
PHE A 294
 None
 1.41A 1q8jA-4mx8A:
undetectable		 1q8jA-4mx8A:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o1e DIHYDROPTEROATE
SYNTHASE DHPS

(Desulfitobacterium
hafniense) 		PF00809
(Pterin_bind) 		8 ASN A  10
ASP A  76
ASN A  97
ILE A 121
ASP A 161
GLY A 196
SER A 198
ILE A 227
 C2F  A3000 ( 4.5A)
C2F  A3000 (-3.6A)
C2F  A3000 (-3.0A)
C2F  A3000 ( 4.1A)
C2F  A3000 (-3.5A)
C2F  A3000 (-3.5A)
C2F  A3000 ( 3.8A)
C2F  A3000 (-4.3A)
 1.11A 1q8jA-4o1eA:
29.8		 1q8jA-4o1eA:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o1e DIHYDROPTEROATE
SYNTHASE DHPS

(Desulfitobacterium
hafniense) 		PF00809
(Pterin_bind) 		8 ASP A  76
ASN A  97
ILE A 121
ASP A 161
GLY A 196
SER A 198
ARG A 207
ILE A 227
 C2F  A3000 (-3.6A)
C2F  A3000 (-3.0A)
C2F  A3000 ( 4.1A)
C2F  A3000 (-3.5A)
C2F  A3000 (-3.5A)
C2F  A3000 ( 3.8A)
None
C2F  A3000 (-4.3A)
 1.14A 1q8jA-4o1eA:
29.8		 1q8jA-4o1eA:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o1e DIHYDROPTEROATE
SYNTHASE DHPS

(Desulfitobacterium
hafniense) 		PF00809
(Pterin_bind) 		8 GLU A   7
ASN A  10
ASP A  76
ASN A  97
ILE A 121
ASP A 161
GLY A 196
ILE A 227
 C2F  A3000 (-3.6A)
C2F  A3000 ( 4.5A)
C2F  A3000 (-3.6A)
C2F  A3000 (-3.0A)
C2F  A3000 ( 4.1A)
C2F  A3000 (-3.5A)
C2F  A3000 (-3.5A)
C2F  A3000 (-4.3A)
 0.55A 1q8jA-4o1eA:
29.8		 1q8jA-4o1eA:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o9x TCDB2, TCCC3

(Photorhabdus
luminescens) 		PF03534
(SpvB)
PF12255
(TcdB_toxin_midC)
PF12256
(TcdB_toxin_midN) 		5 ASN A1946
ARG A1947
ASP A1572
GLY A2171
ARG A2151
 None
 1.26A 1q8jA-4o9xA:
undetectable		 1q8jA-4o9xA:
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.
4pqi IN2-1 FAMILY
PROTEIN, GLUTATHIONE
TRANSFERASE LAMBDA3

(Populus
trichocarpa) 		PF13410
(GST_C_2)
PF13417
(GST_N_3) 		5 GLU A 213
ASN A 216
ASN A 190
ILE A 201
ASP A 200
 None
 1.40A 1q8jA-4pqiA:
undetectable		 1q8jA-4pqiA:
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.
4pzv 2-AMINO-4-HYDROXY-6-
HYDROXYMETHYLDIHYDRO
PTERIDINE
PYROPHOSPHOKINASE/DI
HYDROPTEROATE
SYNTHASE

(Francisella
tularensis) 		PF00809
(Pterin_bind)
PF01288
(HPPK) 		5 ASP A 254
ASN A 276
ASP A 345
GLY A 378
SER A 380
 None
 0.79A 1q8jA-4pzvA:
9.2		 1q8jA-4pzvA:
22.18
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.
4xyb FORMATE
DEHYDROGENASE

(Granulicella
mallensis) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 GLU A 175
ASP A 182
ILE A 180
GLY A 177
ILE A 172
 None
 1.34A 1q8jA-4xybA:
undetectable		 1q8jA-4xybA:
23.18
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.
4zkt BONTOXILYSIN A

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N) 		5 ASP A 259
ILE A 247
GLY A 353
PHE A 194
ILE A 352
 None
 1.26A 1q8jA-4zktA:
undetectable		 1q8jA-4zktA:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zpj EXTRACELLULAR
LIGAND-BINDING
RECEPTOR

(Sphaerobacter
thermophilus) 		PF13458
(Peripla_BP_6) 		5 GLU A 234
ASN A 201
ILE A 257
GLY A 284
SER A 310
 None
 1.39A 1q8jA-4zpjA:
2.5		 1q8jA-4zpjA:
22.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a2p SYNTENIN-1

(Rattus
norvegicus) 		PF00595
(PDZ) 		5 ASN A 247
ARG A 155
ASP A 253
GLY A 218
ILE A 240
 None
 1.22A 1q8jA-5a2pA:
undetectable		 1q8jA-5a2pA:
14.03
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.
5a3y THERMOLYSIN

(Bacillus
thermoproteolyticus) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		5 GLU A 177
ASN A 183
ASP A  72
GLY A 136
ILE A 137
 CA  A1318 ( 2.3A)
None
None
None
None
 1.36A 1q8jA-5a3yA:
undetectable		 1q8jA-5a3yA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5b4c UDP-2,3-DIACYLGLUCOS
AMINE HYDROLASE

(Pseudomonas
aeruginosa) 		PF00149
(Metallophos) 		5 ARG A 213
ASP A 116
ASN A  79
ASP A  81
GLY A  40
 None
None
MN  A 301 (-2.7A)
None
None
 1.06A 1q8jA-5b4cA:
2.4		 1q8jA-5b4cA:
19.47
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.
5csl ACETYL-COA
CARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF01039
(Carboxyl_trans)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
PF08326
(ACC_central) 		5 ASN A1317
ARG A1318
ILE A1385
GLY A1340
ARG A1108
 None
 1.33A 1q8jA-5cslA:
undetectable		 1q8jA-5cslA:
14.45
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.
5d8m METAGENOMIC CARBOXYL
ESTERASE MGS0156

(uncultured
organism) 		no annotation 5 GLU A 410
ILE A 226
ASP A 224
GLY A 160
ILE A 161
 None
 1.15A 1q8jA-5d8mA:
undetectable		 1q8jA-5d8mA:
21.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5d8m METAGENOMIC CARBOXYL
ESTERASE MGS0156

(uncultured
organism) 		no annotation 5 GLU A 410
ILE A 226
ASP A 224
GLY A 160
SER A 157
 None
 1.49A 1q8jA-5d8mA:
undetectable		 1q8jA-5d8mA:
21.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dbo TRANSLATION
INITIATION FACTOR
EIF-2B-LIKE PROTEIN

(Chaetomium
thermophilum) 		PF01008
(IF-2B) 		5 ARG A 291
ASN A 396
ILE A 395
PHE A 169
ILE A 175
 None
 1.44A 1q8jA-5dboA:
undetectable		 1q8jA-5dboA:
22.07
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.
5fxn THERMOLYSIN

(Bacillus
thermoproteolyticus) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		5 GLU A 177
ASN A 183
ASP A  72
GLY A 136
ILE A 137
 CA  A1321 ( 2.3A)
None
None
None
None
 1.34A 1q8jA-5fxnA:
undetectable		 1q8jA-5fxnA:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h3h ABHYDROLASE
DOMAIN-CONTAINING
PROTEIN

(Exiguobacterium
antarcticum) 		PF00561
(Abhydrolase_1)
PF08386
(Abhydrolase_4) 		5 GLU A 254
ILE A 214
GLY A 217
SER A 246
PHE A 165
 None
 1.42A 1q8jA-5h3hA:
undetectable		 1q8jA-5h3hA:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hxt (2Z,6Z)-FARNESYL
DIPHOSPHATE
SYNTHASE,
CHLOROPLASTIC

(Solanum
habrochaites) 		PF01255
(Prenyltransf) 		5 GLU A 133
ILE A 207
ASP A 206
GLY A 202
SER A 131
 None
None
None
None
IPR  A 403 (-2.9A)
 1.42A 1q8jA-5hxtA:
undetectable		 1q8jA-5hxtA:
17.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jnq PHOSPHO-N-ACETYLMURA
MOYL-PENTAPEPTIDE-TR
ANSFERASE

([Clostridium]
bolteae) 		PF00953
(Glycos_transf_4)
PF10555
(MraY_sig1) 		5 ASN A 172
ASP A 168
ILE A 118
GLY A  90
ILE A  89
 TUM  A 401 (-3.4A)
None
None
None
None
 1.49A 1q8jA-5jnqA:
undetectable		 1q8jA-5jnqA:
21.75
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.
5jq9 DIHYDROPTEROATE
SYNTHASE

(Yersinia pestis) 		PF00809
(Pterin_bind) 		5 ASP A  96
ASN A 115
ASP A 185
GLY A 217
SER A 219
 6MB  A 301 (-3.2A)
6MB  A 301 (-2.9A)
6MB  A 301 (-3.2A)
6MB  A 301 (-3.4A)
None
 0.63A 1q8jA-5jq9A:
14.9		 1q8jA-5jq9A:
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.
5kis RHS2

(Yersinia
entomophaga) 		no annotation 5 ASN B 445
ARG B 446
ASP B  57
GLY B 669
ARG B 649
 None
 1.37A 1q8jA-5kisB:
undetectable		 1q8jA-5kisB:
21.36
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.
5usw DIHYDROPTEROATE
SYNTHASE

(Aliivibrio
fischeri) 		PF00809
(Pterin_bind) 		5 ASP A  96
ASN A 115
ASP A 185
GLY A 217
SER A 219
 GOL  A 303 ( 4.7A)
GOL  A 303 (-3.5A)
GOL  A 303 (-2.8A)
GOL  A 303 ( 3.9A)
None
 0.70A 1q8jA-5uswA:
13.8		 1q8jA-5uswA:
21.25
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.
5vop 5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE

(Thermus
thermophilus) 		no annotation 5 ARG A 374
ASP A 531
GLY A 570
SER A 572
ARG A 583
 None
C2F  A3001 (-2.5A)
C2F  A3001 (-3.5A)
C2F  A3001 ( 4.5A)
C2F  A3001 (-3.0A)
 1.13A 1q8jA-5vopA:
27.4		 1q8jA-5vopA:
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.
5vop 5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE

(Thermus
thermophilus) 		no annotation 5 ASN A 376
ASP A 411
ASP A 531
GLY A 570
ARG A 583
 NA  A3005 (-3.0A)
C2F  A3001 ( 3.8A)
C2F  A3001 (-2.5A)
C2F  A3001 (-3.5A)
C2F  A3001 (-3.0A)
 1.46A 1q8jA-5vopA:
27.4		 1q8jA-5vopA:
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.
5vop 5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE

(Thermus
thermophilus) 		no annotation 5 ASP A 443
ASN A 464
GLY A 570
PHE A 535
ILE A 603
 C2F  A3001 (-2.5A)
C2F  A3001 (-2.2A)
C2F  A3001 (-3.5A)
None
C2F  A3001 (-3.5A)
 1.43A 1q8jA-5vopA:
27.4		 1q8jA-5vopA:
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.
5vop 5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE

(Thermus
thermophilus) 		no annotation 9 GLU A 373
ASN A 376
ASP A 443
ASN A 464
ASP A 531
GLY A 570
SER A 572
ARG A 583
ILE A 603
 C2F  A3001 (-3.7A)
NA  A3005 (-3.0A)
C2F  A3001 (-2.5A)
C2F  A3001 (-2.2A)
C2F  A3001 (-2.5A)
C2F  A3001 (-3.5A)
C2F  A3001 ( 4.5A)
C2F  A3001 (-3.0A)
C2F  A3001 (-3.5A)
 0.39A 1q8jA-5vopA:
27.4		 1q8jA-5vopA:
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.
5vop 5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE

(Thermus
thermophilus) 		no annotation 9 GLU A 373
ASN A 376
ASP A 443
ASN A 464
GLY A 570
SER A 572
PHE A 576
ARG A 583
ILE A 603
 C2F  A3001 (-3.7A)
NA  A3005 (-3.0A)
C2F  A3001 (-2.5A)
C2F  A3001 (-2.2A)
C2F  A3001 (-3.5A)
C2F  A3001 ( 4.5A)
C2F  A3001 (-4.7A)
C2F  A3001 (-3.0A)
C2F  A3001 (-3.5A)
 0.95A 1q8jA-5vopA:
27.4		 1q8jA-5vopA:
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.
5w3f TUBULIN ALPHA-1
CHAIN

(Saccharomyces
cerevisiae) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		5 ARG A 244
ASP A 252
ASN A 254
GLY A 135
ARG A  65
 None
 1.34A 1q8jA-5w3fA:
2.1		 1q8jA-5w3fA:
21.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wly UDP-2,3-DIACYLGLUCOS
AMINE HYDROLASE

(Escherichia
coli) 		no annotation 5 ARG A 213
ASP A 116
ASN A  79
ASP A  81
GLY A  40
 None
None
MN  A 301 ( 2.7A)
None
None
 1.14A 1q8jA-5wlyA:
3.2		 1q8jA-5wlyA:
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.
5xbf UNCONVENTIONAL
MYOSIN-VIIB

(Homo sapiens) 		PF00373
(FERM_M)
PF00784
(MyTH4) 		5 GLU A1727
ASN A1723
ASP A1680
ILE A1674
GLY A1730
 None
 1.27A 1q8jA-5xbfA:
undetectable		 1q8jA-5xbfA:
24.12
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.
6bja ACETYL-COA
ACETYLTRANSFERASE A

(Ascaris suum) 		no annotation 5 ARG A 147
ASN A  59
ILE A  69
GLY A  64
PHE A 127
 None
 1.04A 1q8jA-6bjaA:
undetectable		 1q8jA-6bjaA:
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.
6cza -

(-) 		no annotation 5 ASN A 827
ASP A 722
ASP A 754
GLY A 824
ARG A 125
 MGD  A 903 (-2.2A)
MGD  A 903 ( 2.1A)
None
None
None
 1.45A 1q8jA-6czaA:
undetectable		 1q8jA-6czaA:
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.
6day DIHYDROPTEROATE
SYNTHASE

(Xanthomonas
albilineans) 		no annotation 5 ASN A  27
ASP A 101
ASN A 120
ASP A 190
SER A 224
 SO4  A 403 (-3.1A)
None
None
None
None
 0.89A 1q8jA-6dayA:
12.1		 1q8jA-6dayA:
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.
6day DIHYDROPTEROATE
SYNTHASE

(Xanthomonas
albilineans) 		no annotation 5 ASP A 101
ASN A 120
ASP A 190
GLY A 222
SER A 224
 None
 0.74A 1q8jA-6dayA:
12.1		 1q8jA-6dayA:
undetectable