SIMILAR PATTERNS OF AMINO ACIDS FOR 2OGY_A_C2FA3000_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.
1d8c MALATE SYNTHASE G

(Escherichia
coli) 		PF01274
(Malate_synthase) 		5 ILE A 642
LEU A 596
GLY A 602
GLN A 670
ILE A 603
 None
 1.35A 2ogyA-1d8cA:
7.9		 2ogyA-1d8cA:
17.48
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.
1d8c MALATE SYNTHASE G

(Escherichia
coli) 		PF01274
(Malate_synthase) 		5 MET A 680
ILE A 642
LEU A 596
GLY A 602
ILE A 603
 None
 1.32A 2ogyA-1d8cA:
7.9		 2ogyA-1d8cA:
17.48
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.
1e6y METHYL-COENZYME M
REDUCTASE I BETA
SUBUNIT

(Methanosarcina
barkeri) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		5 ILE B2420
LEU B2110
GLY B2414
SER B2410
ILE B2200
 None
 1.21A 2ogyA-1e6yB:
undetectable		 2ogyA-1e6yB:
18.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1f6y 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Moorella
thermoacetica) 		PF00809
(Pterin_bind) 		9 GLU A   6
MET A  11
PHE A  12
ASP A  75
ASN A  96
ILE A 120
LEU A 122
GLN A 202
ARG A 207
 None
 0.71A 2ogyA-1f6yA:
45.8		 2ogyA-1f6yA:
98.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1f6y 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Moorella
thermoacetica) 		PF00809
(Pterin_bind) 		11 GLU A   6
MET A  11
PHE A  12
ASP A  75
ASN A  96
ILE A 120
LEU A 122
GLY A 196
SER A 198
ARG A 207
ILE A 227
 None
 0.41A 2ogyA-1f6yA:
45.8		 2ogyA-1f6yA:
98.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1f6y 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Moorella
thermoacetica) 		PF00809
(Pterin_bind) 		5 GLU A   6
MET A  11
PHE A  12
LEU A 162
ILE A 227
 None
 1.08A 2ogyA-1f6yA:
45.8		 2ogyA-1f6yA:
98.85
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.
1k3g CYTOCHROME C-553

(Sporosarcina
pasteurii) 		PF13442
(Cytochrome_CBB3) 		5 GLU A  57
ILE A  48
LEU A  40
GLY A  52
ILE A  60
 None
HEC  A  93 (-3.8A)
None
None
HEC  A  93 (-3.5A)
 1.29A 2ogyA-1k3gA:
undetectable		 2ogyA-1k3gA:
15.00
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.
1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE

(Comamonas
testosteroni) 		PF13360
(PQQ_2)
PF13442
(Cytochrome_CBB3) 		5 GLU A 301
GLY A 260
SER A 311
GLN A 313
ILE A 285
 None
 1.22A 2ogyA-1kb0A:
undetectable		 2ogyA-1kb0A:
17.28
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.
1llp LIGNIN PEROXIDASE

(Phanerochaete
chrysosporium) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		5 GLU A  57
ILE A  50
GLY A  65
GLN A 137
ILE A  52
 None
 1.28A 2ogyA-1llpA:
undetectable		 2ogyA-1llpA:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		5 ILE A 866
LEU A1193
GLY A1111
ARG A 837
ILE A1177
 None
 1.25A 2ogyA-1ofeA:
7.5		 2ogyA-1ofeA:
11.93
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		5 ILE A1056
LEU A1035
GLY A1047
SER A 208
ARG A 206
 None
None
None
None
ONL  A2511 (-4.0A)
 1.23A 2ogyA-1ofeA:
7.5		 2ogyA-1ofeA:
11.93
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.
1ps9 2,4-DIENOYL-COA
REDUCTASE

(Escherichia
coli) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		5 ILE A 533
LEU A 543
GLY A 250
SER A 163
ILE A 249
 None
 1.28A 2ogyA-1ps9A:
9.0		 2ogyA-1ps9A:
18.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qf8 CASEIN KINASE II

(Homo sapiens) 		PF01214
(CK_II_beta) 		5 ASP A  51
ILE A  53
LEU A  79
SER A  69
GLN A  68
 None
 1.34A 2ogyA-1qf8A:
undetectable		 2ogyA-1qf8A:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rlh CONSERVED
HYPOTHETICAL PROTEIN

(Thermoplasma
acidophilum) 		PF04008
(Adenosine_kin) 		5 ILE A 110
LEU A 108
GLY A  12
SER A  99
GLN A  95
 None
 1.23A 2ogyA-1rlhA:
undetectable		 2ogyA-1rlhA:
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.
1tww DHPS,
DIHYDROPTEROATE
SYNTHASE

(Bacillus
anthracis) 		PF00809
(Pterin_bind) 		5 ASP A 101
ASN A 120
ILE A 143
GLY A 216
SER A 218
 HH2  A 282 (-3.4A)
HH2  A 282 (-2.7A)
HH2  A 282 (-4.1A)
HH2  A 282 (-3.3A)
None
 0.68A 2ogyA-1twwA:
23.2		 2ogyA-1twwA:
22.15
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.
1uuo DIHYDROOROTATE
DEHYDROGENASE

(Rattus rattus) 		PF01180
(DHO_dh) 		5 ILE A 331
LEU A  84
GLY A 179
GLN A 168
ARG A 164
 None
 1.19A 2ogyA-1uuoA:
10.4		 2ogyA-1uuoA:
21.99
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.
1wa5 IMPORTIN ALPHA
RE-EXPORTER

(Saccharomyces
cerevisiae) 		PF03378
(CAS_CSE1)
PF03810
(IBN_N)
PF08506
(Cse1) 		5 GLU C 107
ILE C  44
LEU C  41
SER C 110
ARG C 153
 None
 1.14A 2ogyA-1wa5C:
undetectable		 2ogyA-1wa5C:
14.91
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.
1y7i SALICYLIC
ACID-BINDING PROTEIN
2

(Nicotiana
tabacum) 		PF12697
(Abhydrolase_6) 		5 MET A 149
PHE A 151
LEU A  89
GLY A  83
SER A  81
 SAL  A 501 ( 4.6A)
SAL  A 501 (-4.8A)
None
None
SAL  A 501 (-3.0A)
 1.15A 2ogyA-1y7iA:
undetectable		 2ogyA-1y7iA:
23.05
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.
1yve ACETOHYDROXY ACID
ISOMEROREDUCTASE

(Spinacia
oleracea) 		PF01450
(IlvC)
PF07991
(IlvN) 		5 PHE I 504
ASN I 274
GLY I 272
GLN I 264
ILE I 273
 None
 1.25A 2ogyA-1yveI:
undetectable		 2ogyA-1yveI:
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.
2bej SEGREGATION PROTEIN

(Thermus
thermophilus) 		PF13614
(AAA_31) 		5 GLU A 241
ILE A   9
LEU A  11
GLY A 173
ARG A 194
 None
 1.25A 2ogyA-2bejA:
2.8		 2ogyA-2bejA:
24.08
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.
2bmb FOLIC ACID SYNTHESIS
PROTEIN FOL1

(Saccharomyces
cerevisiae) 		PF00809
(Pterin_bind)
PF01288
(HPPK) 		5 ASP A 591
ASN A 655
ILE A 679
GLY A 803
SER A 805
 None
PMM  A1865 (-2.9A)
PMM  A1865 ( 4.7A)
PMM  A1865 (-3.5A)
None
 1.22A 2ogyA-2bmbA:
19.8		 2ogyA-2bmbA:
19.11
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.
2bmb FOLIC ACID SYNTHESIS
PROTEIN FOL1

(Saccharomyces
cerevisiae) 		PF00809
(Pterin_bind)
PF01288
(HPPK) 		5 ASP A 636
ASN A 655
ILE A 679
GLY A 803
SER A 805
 PMM  A1865 (-3.3A)
PMM  A1865 (-2.9A)
PMM  A1865 ( 4.7A)
PMM  A1865 (-3.5A)
None
 0.64A 2ogyA-2bmbA:
19.8		 2ogyA-2bmbA:
19.11
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.
2de2 DIBENZOTHIOPHENE
DESULFURIZATION
ENZYME B

(Rhodococcus sp.
IGTS8) 		no annotation 5 GLU A 156
PHE A 103
GLY A 183
SER A 181
GLN A 210
 None
None
GOL  A 501 (-3.3A)
None
None
 1.28A 2ogyA-2de2A:
undetectable		 2ogyA-2de2A:
22.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2g02 NISIN BIOSYNTHESIS
PROTEIN NISC

(Lactococcus
lactis) 		PF05147
(LANC_like) 		5 PHE A  34
ILE A  98
GLY A  93
SER A  86
ILE A  94
 None
 1.21A 2ogyA-2g02A:
undetectable		 2ogyA-2g02A:
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.
2j0v RAC-LIKE GTP-BINDING
PROTEIN ARAC7

(Arabidopsis
thaliana) 		PF00071
(Ras) 		5 GLU A 155
ILE A 148
LEU A  97
GLY A 141
SER A 138
 None
 1.25A 2ogyA-2j0vA:
undetectable		 2ogyA-2j0vA:
23.57
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.
2j13 POLYSACCHARIDE
DEACETYLASE

(Bacillus
anthracis) 		PF01522
(Polysacc_deac_1) 		5 GLU A 121
PHE A 110
LEU A  90
GLY A  80
SER A 106
 None
 1.26A 2ogyA-2j13A:
3.0		 2ogyA-2j13A:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2osa N-CHIMAERIN

(Homo sapiens) 		PF00620
(RhoGAP) 		6 GLU A 291
ASP A 335
ASN A 337
GLY A 296
SER A 294
ILE A 336
 None
 1.48A 2ogyA-2osaA:
undetectable		 2ogyA-2osaA:
21.01
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.
2pyy IONOTROPIC GLUTAMATE
RECEPTOR BACTERIAL
HOMOLOGUE

(Nostoc
punctiforme) 		PF00497
(SBP_bac_3) 		5 PHE A 219
ILE A 198
LEU A  64
GLY A 185
ILE A  85
 None
 1.27A 2ogyA-2pyyA:
undetectable		 2ogyA-2pyyA:
20.90
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.
2vaw CELL DIVISION
PROTEIN FTSZ

(Pseudomonas
aeruginosa) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 GLU A 139
PHE A 183
ILE A 151
LEU A 154
GLY A 106
 GDP  A1317 (-2.4A)
GDP  A1317 (-4.5A)
None
None
GDP  A1317 ( 4.0A)
 1.28A 2ogyA-2vawA:
2.7		 2ogyA-2vawA:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vca ALPHA-N-ACETYLGLUCOS
AMINIDASE

(Clostridium
perfringens) 		PF00754
(F5_F8_type_C)
PF05089
(NAGLU)
PF12971
(NAGLU_N)
PF12972
(NAGLU_C) 		5 PHE A 475
ASN A 561
LEU A 613
GLY A 595
ILE A 559
 None
 1.25A 2ogyA-2vcaA:
8.2		 2ogyA-2vcaA:
13.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ycj 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Carboxydothermus
hydrogenoformans) 		PF00809
(Pterin_bind) 		11 GLU A   7
PHE A  13
ASP A  76
ASN A  97
ILE A 121
LEU A 123
GLY A 197
SER A 199
GLN A 203
ARG A 208
ILE A 228
 C2F  A3000 ( 4.1A)
C2F  A3000 (-3.9A)
C2F  A3000 (-3.4A)
C2F  A3000 (-3.0A)
C2F  A3000 ( 4.2A)
None
C2F  A3000 (-3.6A)
GOL  A1270 ( 3.9A)
C2F  A3000 (-3.9A)
C2F  A3000 ( 2.6A)
C2F  A3000 (-4.6A)
 0.53A 2ogyA-2ycjA:
42.7		 2ogyA-2ycjA:
60.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ycj 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Carboxydothermus
hydrogenoformans) 		PF00809
(Pterin_bind) 		5 GLU A   7
PHE A  13
LEU A 163
GLY A 197
ILE A 228
 C2F  A3000 ( 4.1A)
C2F  A3000 (-3.9A)
None
C2F  A3000 (-3.6A)
C2F  A3000 (-4.6A)
 1.09A 2ogyA-2ycjA:
42.7		 2ogyA-2ycjA:
60.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ycj 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Carboxydothermus
hydrogenoformans) 		PF00809
(Pterin_bind) 		5 MET A  12
ASP A  76
ASN A  97
ILE A 121
LEU A 123
 None
C2F  A3000 (-3.4A)
C2F  A3000 (-3.0A)
C2F  A3000 ( 4.2A)
None
 1.18A 2ogyA-2ycjA:
42.7		 2ogyA-2ycjA:
60.15
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.
3b05 ISOPENTENYL-DIPHOSPH
ATE DELTA-ISOMERASE

(Sulfolobus
shibatae) 		PF01070
(FMN_dh) 		5 PHE A 269
ASP A 150
ILE A 147
GLY A  93
ILE A 123
 None
 1.32A 2ogyA-3b05A:
7.7		 2ogyA-3b05A:
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.
3b1f PUTATIVE PREPHENATE
DEHYDROGENASE

(Streptococcus
mutans) 		PF02153
(PDH) 		5 PHE A  79
ILE A  22
LEU A 166
GLY A  15
ILE A   8
 None
 1.11A 2ogyA-3b1fA:
undetectable		 2ogyA-3b1fA:
25.26
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.
3bit FACT COMPLEX SUBUNIT
SPT16

(Saccharomyces
cerevisiae) 		PF00557
(Peptidase_M24)
PF14826
(FACT-Spt16_Nlob) 		5 ILE A 225
LEU A 231
GLY A 190
SER A 188
ILE A 292
 None
 1.17A 2ogyA-3bitA:
undetectable		 2ogyA-3bitA:
21.70
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.
3bjb PROBABLE
TRANSCRIPTIONAL
REGULATOR, TETR
FAMILY PROTEIN

(Rhodococcus
jostii) 		PF00440
(TetR_N) 		5 MET A  72
ILE A 189
LEU A 164
GLY A 170
ILE A 172
 None
 1.30A 2ogyA-3bjbA:
undetectable		 2ogyA-3bjbA:
24.19
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.
3bol 5-METHYLTETRAHYDROFO
LATE S-HOMOCYSTEINE
METHYLTRANSFERASE

(Thermotoga
maritima) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		8 GLU A 320
ASP A 390
ASN A 411
ILE A 435
LEU A 437
GLY A 505
SER A 507
ILE A 536
 None
 0.65A 2ogyA-3bolA:
26.3		 2ogyA-3bolA:
16.58
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.
3d8p ACETYLTRANSFERASE OF
GNAT FAMILY

(Staphylococcus
aureus) 		PF13673
(Acetyltransf_10) 		5 PHE A 146
ASP A  39
ILE A  43
LEU A  16
GLY A  69
 None
 1.21A 2ogyA-3d8pA:
undetectable		 2ogyA-3d8pA:
19.39
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.
3elk PUTATIVE
TRANSCRIPTIONAL
REGULATOR TA0346

(Thermoplasma
acidophilum) 		PF03551
(PadR) 		5 ILE A  19
LEU A  23
GLY A  30
GLN A  75
ILE A  50
 None
 1.23A 2ogyA-3elkA:
undetectable		 2ogyA-3elkA:
16.79
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.
3ezl ACETOACETYL-COA
REDUCTASE

(Burkholderia
pseudomallei) 		PF00106
(adh_short) 		5 PHE A  55
ASN A  90
ILE A 140
GLY A 220
ILE A  21
 None
 1.19A 2ogyA-3ezlA:
undetectable		 2ogyA-3ezlA:
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.
3gm8 GLYCOSIDE HYDROLASE
FAMILY 2, CANDIDATE
BETA-GLYCOSIDASE

(Bacteroides
vulgatus) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		5 GLU A 490
ILE A 462
LEU A 459
GLY A 441
ARG A 159
 GOL  A   1 (-2.5A)
None
None
None
GOL  A   1 (-3.0A)
 1.26A 2ogyA-3gm8A:
9.1		 2ogyA-3gm8A:
16.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iz3 STRUCTURAL PROTEIN
VP1

(Cypovirus 1) 		no annotation 5 GLU B1264
ASP B 351
LEU B 208
SER B1241
ILE B1296
 None
 1.32A 2ogyA-3iz3B:
undetectable		 2ogyA-3iz3B:
12.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jz4 SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE
[NADP+]

(Escherichia
coli) 		PF00171
(Aldedh) 		5 GLU A 235
ILE A 152
LEU A 228
GLY A 237
ILE A 236
 None
NAP  A 482 ( 4.2A)
None
None
NAP  A 482 (-3.6A)
 0.90A 2ogyA-3jz4A:
undetectable		 2ogyA-3jz4A:
20.58
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.
3k13 5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE

(Bacteroides
thetaiotaomicron) 		PF00809
(Pterin_bind) 		7 GLU A 358
ASP A 431
ASN A 452
GLY A 558
SER A 560
ARG A 573
ILE A 593
 THH  A 642 ( 3.5A)
THH  A 642 (-3.3A)
THH  A 642 (-3.0A)
THH  A 642 (-3.3A)
K  A 644 ( 3.4A)
THH  A 642 (-3.1A)
THH  A 642 (-4.2A)
 0.29A 2ogyA-3k13A:
29.6		 2ogyA-3k13A:
25.94
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.
3k9b LIVER
CARBOXYLESTERASE 1

(Homo sapiens) 		PF00135
(COesterase) 		5 GLU A1220
PHE A1101
ILE A1217
LEU A1230
GLY A1224
 WW2  A 193 ( 4.2A)
None
None
None
None
 1.32A 2ogyA-3k9bA:
2.1		 2ogyA-3k9bA:
18.05
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.
3lun ULILYSIN

(Methanosarcina
acetivorans) 		PF05572
(Peptidase_M43) 		5 GLU A 229
ILE A 121
LEU A 313
GLY A 231
ILE A 230
 ZN  A 999 ( 3.8A)
None
None
None
None
 1.17A 2ogyA-3lunA:
undetectable		 2ogyA-3lunA:
20.98
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.
3n9i TRYPTOPHANYL-TRNA
SYNTHETASE

(Yersinia pestis) 		PF00579
(tRNA-synt_1b) 		5 GLU A 223
ILE A 261
LEU A 258
SER A 227
ILE A 219
 None
 1.29A 2ogyA-3n9iA:
undetectable		 2ogyA-3n9iA:
23.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ncv DNA MISMATCH REPAIR
PROTEIN MUTL

(Neisseria
gonorrhoeae) 		PF08676
(MutL_C) 		5 ILE A 598
LEU A 599
GLY A 546
SER A 516
GLN A 515
 None
 1.27A 2ogyA-3ncvA:
undetectable		 2ogyA-3ncvA:
23.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r9w GTPASE ERA

(Aquifex
aeolicus) 		PF01926
(MMR_HSR1)
PF07650
(KH_2) 		5 GLU A 258
ILE A 237
GLY A 260
GLN A 265
ILE A 259
 None
None
C  B1536 ( 3.4A)
None
None
 1.07A 2ogyA-3r9wA:
2.3		 2ogyA-3r9wA:
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.
3rh9 SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE
(NAD(P)(+))

(Marinobacter
hydrocarbonoclasticus) 		PF00171
(Aldedh) 		5 MET A 188
PHE A 192
LEU A 240
GLY A 150
SER A 176
 None
 1.25A 2ogyA-3rh9A:
undetectable		 2ogyA-3rh9A:
20.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tfm MYOSIN X

(Rattus
norvegicus) 		PF00169
(PH) 		5 ILE A 114
LEU A  79
SER A 132
GLN A 133
ILE A 112
 None
 1.30A 2ogyA-3tfmA:
undetectable		 2ogyA-3tfmA:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tlk FERRIENTEROBACTIN-BI
NDING PERIPLASMIC
PROTEIN

(Escherichia
coli) 		PF01497
(Peripla_BP_2) 		5 ILE A 145
LEU A 155
GLY A 160
GLN A 168
ILE A 162
 None
 1.31A 2ogyA-3tlkA:
undetectable		 2ogyA-3tlkA:
24.63
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.
3ufc PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pyrococcus
furiosus) 		PF01881
(Cas_Cas6) 		5 GLU X  95
ILE X  28
LEU X  43
GLY X  93
ILE X  94
 None
 1.25A 2ogyA-3ufcX:
undetectable		 2ogyA-3ufcX:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v8b PUTATIVE
DEHYDROGENASE,
POSSIBLY
3-OXOACYL-[ACYL-CARR
IER PROTEIN]
REDUCTASE

(Sinorhizobium
meliloti) 		PF13561
(adh_short_C2) 		5 ILE A 234
LEU A  25
GLY A  18
SER A  15
ILE A  17
 None
 1.24A 2ogyA-3v8bA:
undetectable		 2ogyA-3v8bA:
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.
4a3s 6-PHOSPHOFRUCTOKINAS
E

(Bacillus
subtilis) 		PF00365
(PFK) 		5 GLU A 235
ILE A 201
LEU A 190
GLY A 231
ILE A 234
 None
 1.30A 2ogyA-4a3sA:
undetectable		 2ogyA-4a3sA:
22.44
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.
4afr METACASPASE

(Trypanosoma
brucei) 		PF00656
(Peptidase_C14) 		5 MET A 254
ILE A  80
GLY A 159
SER A 215
ILE A 176
 None
 1.20A 2ogyA-4afrA:
undetectable		 2ogyA-4afrA:
22.46
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.
4bmr RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
SUBUNIT BETA

(Bacillus cereus) 		PF00268
(Ribonuc_red_sm) 		5 PHE A 256
ILE A 103
LEU A 107
GLY A 185
ILE A 188
 None
 1.24A 2ogyA-4bmrA:
undetectable		 2ogyA-4bmrA:
22.51
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.
4c3s ALDEHYDE
DEHYDROGENASE

(Lachnoclostridium
phytofermentans) 		PF00171
(Aldedh) 		5 GLU A 346
ILE A 257
GLY A 364
GLN A 303
ILE A 365
 None
 1.31A 2ogyA-4c3sA:
undetectable		 2ogyA-4c3sA:
23.74
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.
4ccz METHIONINE SYNTHASE

(Homo sapiens) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		7 GLU A 376
ASP A 449
ASN A 470
GLY A 576
SER A 578
ARG A 591
ILE A 611
 THG  A1652 (-3.5A)
THG  A1652 (-3.4A)
THG  A1652 (-3.2A)
THG  A1652 (-3.6A)
THG  A1652 (-4.2A)
THG  A1652 (-3.0A)
THG  A1652 (-4.2A)
 0.38A 2ogyA-4cczA:
29.9		 2ogyA-4cczA:
18.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f52 GLOMULIN

(Homo sapiens) 		PF08568
(Kinetochor_Ybp2) 		5 GLU E  38
ILE E  89
LEU E  93
GLY E  33
ILE E  37
 None
 1.08A 2ogyA-4f52E:
undetectable		 2ogyA-4f52E:
19.97
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.
4f92 U5 SMALL NUCLEAR
RIBONUCLEOPROTEIN
200 KDA HELICASE

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		5 GLU B 890
PHE B 416
ILE B 617
LEU B 665
ILE B 889
 None
 1.20A 2ogyA-4f92B:
undetectable		 2ogyA-4f92B:
9.57
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.
4gba DCN1-LIKE PROTEIN 3

(Homo sapiens) 		PF03556
(Cullin_binding) 		5 PHE A 270
ASN A 231
GLY A 237
SER A 239
ILE A 235
 None
 1.10A 2ogyA-4gbaA:
undetectable		 2ogyA-4gbaA:
22.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h8a UREIDOGLYCOLATE
DEHYDROGENASE

(Escherichia
coli) 		PF02615
(Ldh_2) 		5 MET A 251
ILE A  12
LEU A 331
GLY A  45
SER A  43
 None
 1.29A 2ogyA-4h8aA:
undetectable		 2ogyA-4h8aA:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l0o CYSTATHIONINE
GAMMA-SYNTHASE

(Helicobacter
pylori) 		no annotation 5 ASP H 170
ILE H 168
GLY H  77
SER H  73
ILE H  78
 PLP  H 401 (-3.2A)
None
None
PLP  H 401 (-3.5A)
None
 1.06A 2ogyA-4l0oH:
undetectable		 2ogyA-4l0oH:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4m9d ADENYLOSUCCINATE
SYNTHETASE

(Bacillus
anthracis) 		PF00709
(Adenylsucc_synt) 		6 GLU A 295
ILE A 337
LEU A 340
GLY A 307
SER A 270
GLN A  10
 None
 1.49A 2ogyA-4m9dA:
undetectable		 2ogyA-4m9dA:
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.
4m9d ADENYLOSUCCINATE
SYNTHETASE

(Bacillus
anthracis) 		PF00709
(Adenylsucc_synt) 		6 GLU A 295
ILE A 337
LEU A 340
SER A 270
GLN A  10
ILE A 289
 None
 1.20A 2ogyA-4m9dA:
undetectable		 2ogyA-4m9dA:
18.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4o1e DIHYDROPTEROATE
SYNTHASE DHPS

(Desulfitobacterium
hafniense) 		PF00809
(Pterin_bind) 		7 ASP A  76
ASN A  97
ILE A 121
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 ( 3.8A)
None
C2F  A3000 (-4.3A)
 1.13A 2ogyA-4o1eA:
33.7		 2ogyA-4o1eA:
31.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4o1e DIHYDROPTEROATE
SYNTHASE DHPS

(Desulfitobacterium
hafniense) 		PF00809
(Pterin_bind) 		7 ASP A  76
ASN A  97
ILE A 121
LEU A 123
GLY A 196
ARG A 207
ILE A 227
 C2F  A3000 (-3.6A)
C2F  A3000 (-3.0A)
C2F  A3000 ( 4.1A)
None
C2F  A3000 (-3.5A)
None
C2F  A3000 (-4.3A)
 0.87A 2ogyA-4o1eA:
33.7		 2ogyA-4o1eA:
31.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4o1e DIHYDROPTEROATE
SYNTHASE DHPS

(Desulfitobacterium
hafniense) 		PF00809
(Pterin_bind) 		7 GLU A   7
ASP A  76
ASN A  97
ILE A 121
LEU A 123
GLY A 196
ILE A 227
 C2F  A3000 (-3.6A)
C2F  A3000 (-3.6A)
C2F  A3000 (-3.0A)
C2F  A3000 ( 4.1A)
None
C2F  A3000 (-3.5A)
C2F  A3000 (-4.3A)
 0.58A 2ogyA-4o1eA:
33.7		 2ogyA-4o1eA:
31.97
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.
4oen SECOND SUBSTRATE
BINDING DOMAIN OF
PUTATIVE AMINO ACID
ABC TRANSPORTER

(Streptococcus
pneumoniae) 		PF00497
(SBP_bac_3) 		5 PHE A 277
ASN A 354
GLY A 447
SER A 335
ILE A 446
 ACT  A 507 (-3.4A)
None
None
ACT  A 506 (-3.4A)
None
 1.34A 2ogyA-4oenA:
undetectable		 2ogyA-4oenA:
24.61
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.
4ojz PUTATIVE ALGINATE
LYASE

(Saccharophagus
degradans) 		PF05426
(Alginate_lyase)
PF07940
(Hepar_II_III) 		5 MET A  68
ILE A 176
LEU A 168
GLY A 160
ILE A  96
 None
 1.20A 2ogyA-4ojzA:
undetectable		 2ogyA-4ojzA:
15.47
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.
4pe5 GLUTAMATE RECEPTOR
IONOTROPIC, NMDA 2B

(Rattus
norvegicus) 		PF00060
(Lig_chan)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		5 MET B 789
PHE B 784
ILE B 408
LEU B 478
ILE B 764
 None
 1.18A 2ogyA-4pe5B:
undetectable		 2ogyA-4pe5B:
14.29
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.
4s2t PROTEIN APP-1

(Caenorhabditis
elegans) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N)
PF16188
(Peptidase_M24_C)
PF16189
(Creatinase_N_2) 		5 ILE P 502
LEU P 513
SER P 558
ARG P 588
ILE P 521
 None
None
SO4  P 704 (-4.9A)
SO4  P 704 (-4.0A)
None
 1.30A 2ogyA-4s2tP:
undetectable		 2ogyA-4s2tP:
19.78
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.
4uw9 BETA-PHOSPHOGLUCOMUT
ASE

(Pyrococcus sp.
ST04) 		PF13419
(HAD_2) 		5 GLU A 100
PHE A  14
LEU A 221
GLY A 214
SER A 212
 None
 1.30A 2ogyA-4uw9A:
undetectable		 2ogyA-4uw9A:
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.
4xqk LLABIII

(Lactococcus
lactis) 		PF00271
(Helicase_C)
PF02384
(N6_Mtase)
PF04851
(ResIII)
PF13156
(Mrr_cat_2) 		5 GLU A 958
PHE A 936
ILE A 845
ARG A1003
ILE A 955
 None
 1.29A 2ogyA-4xqkA:
undetectable		 2ogyA-4xqkA:
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.
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
 1.24A 2ogyA-4xybA:
undetectable		 2ogyA-4xybA:
21.97
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.
5a8r METHYL-COENZYME M
REDUCTASE II SUBUNIT
GAMMA

(Methanothermobacter
marburgensis) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		5 ILE B 422
LEU B 113
GLY B 416
SER B 412
ILE B 203
 None
 1.14A 2ogyA-5a8rB:
undetectable		 2ogyA-5a8rB:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ah5 LEUCINE--TRNA LIGASE

(Agrobacterium
tumefaciens) 		PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1)
PF13603
(tRNA-synt_1_2) 		5 GLU A 644
ILE A 658
LEU A 692
GLY A 706
ILE A 645
 None
 1.26A 2ogyA-5ah5A:
undetectable		 2ogyA-5ah5A:
15.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dqp EDTA MONOOXYGENASE

(EDTA-degrading
bacterium BNC1) 		PF00296
(Bac_luciferase) 		5 ILE A  82
LEU A  55
GLY A  90
ARG A   5
ILE A  89
 None
 1.20A 2ogyA-5dqpA:
7.7		 2ogyA-5dqpA:
22.37
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.
5dqp EDTA MONOOXYGENASE

(EDTA-degrading
bacterium BNC1) 		PF00296
(Bac_luciferase) 		5 PHE A 409
ILE A  82
LEU A  55
GLY A  90
ILE A  89
 None
 1.25A 2ogyA-5dqpA:
7.7		 2ogyA-5dqpA:
22.37
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.
5fv4 CARBOXYLIC ESTER
HYDROLASE

(Sus scrofa) 		PF00135
(COesterase) 		5 GLU A 203
PHE A  84
ILE A 200
LEU A 213
GLY A 207
 None
 1.32A 2ogyA-5fv4A:
2.1		 2ogyA-5fv4A:
19.08
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.
5g2v N-ACETYLGLUCOSAMINE-
6-SULFATASE

(Bacteroides
thetaiotaomicron) 		PF00884
(Sulfatase)
PF16347
(DUF4976) 		5 ILE A 344
LEU A 333
GLY A 327
ARG A 207
ILE A 326
 None
 0.93A 2ogyA-5g2vA:
undetectable		 2ogyA-5g2vA:
18.77
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.
5ha4 DIAMINOPIMELATE
EPIMERASE

(Acinetobacter
baumannii) 		PF01678
(DAP_epimerase) 		5 ILE A 252
LEU A 250
GLY A 223
GLN A  74
ARG A 212
 None
 1.25A 2ogyA-5ha4A:
undetectable		 2ogyA-5ha4A:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hes MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE MLT

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		5 PHE A 152
ILE A  72
LEU A  16
GLY A  70
GLN A  67
 032  A 401 (-4.1A)
None
None
None
None
 1.27A 2ogyA-5hesA:
undetectable		 2ogyA-5hesA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hmp UNCONVENTIONAL
MYOSIN-VC

(Homo sapiens) 		PF00063
(Myosin_head) 		5 GLU A 457
PHE A 439
LEU A 525
GLN A 549
ILE A 497
 None
 1.34A 2ogyA-5hmpA:
undetectable		 2ogyA-5hmpA:
16.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ip9 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1

(Saccharomyces
cerevisiae) 		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 A1411
ILE A 138
LEU A 113
GLY A 223
SER A1415
 None
 1.27A 2ogyA-5ip9A:
undetectable		 2ogyA-5ip9A:
8.95
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.
5jxk ASP/GLU-SPECIFIC
DIPEPTIDYL-PEPTIDASE

(Porphyromonas
endodontalis) 		PF10459
(Peptidase_S46) 		5 GLU A 712
ILE A 693
LEU A 666
SER A  75
ILE A 713
 None
 1.30A 2ogyA-5jxkA:
undetectable		 2ogyA-5jxkA:
16.64
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.
5ksd ATPASE 2, PLASMA
MEMBRANE-TYPE

(Arabidopsis
thaliana) 		PF00122
(E1-E2_ATPase)
PF00690
(Cation_ATPase_N)
PF00702
(Hydrolase) 		5 GLU A 319
ILE A 628
LEU A 620
GLY A 602
ILE A 601
 None
 1.13A 2ogyA-5ksdA:
undetectable		 2ogyA-5ksdA:
17.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kzn METABOTROPIC
GLUTAMATE RECEPTOR 2

(Homo sapiens) 		PF01094
(ANF_receptor)
PF07562
(NCD3G) 		5 GLU A  55
ASN A 342
GLY A  58
GLN A  42
ILE A  59
 None
 1.16A 2ogyA-5kznA:
undetectable		 2ogyA-5kznA:
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.
5m59 PRE-MRNA SPLICING
HELICASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		5 GLU A 940
PHE A 465
ILE A 665
LEU A 713
ILE A 939
 None
 1.12A 2ogyA-5m59A:
undetectable		 2ogyA-5m59A:
9.75
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.
5m5p PRE-MRNA-SPLICING
HELICASE BRR2

(Saccharomyces
cerevisiae) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		5 GLU A 909
PHE A 434
ILE A 636
LEU A 684
ILE A 908
 None
 1.26A 2ogyA-5m5pA:
undetectable		 2ogyA-5m5pA:
9.77
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.
5ubc PROTEIN TOC75-3,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		no annotation 5 ASP A 432
LEU A 261
GLY A 364
GLN A 345
ILE A 439
 None
 1.14A 2ogyA-5ubcA:
undetectable		 2ogyA-5ubcA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vop 5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE

(Thermus
thermophilus) 		no annotation 8 GLU A 373
ASP A 443
ASN A 464
LEU A 492
GLY A 570
SER A 572
ARG A 583
ILE A 603
 C2F  A3001 (-3.7A)
C2F  A3001 (-2.5A)
C2F  A3001 (-2.2A)
None
C2F  A3001 (-3.5A)
C2F  A3001 ( 4.5A)
C2F  A3001 (-3.0A)
C2F  A3001 (-3.5A)
 0.32A 2ogyA-5vopA:
30.5		 2ogyA-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.
5xni MCYF

(Microcystis
aeruginosa) 		no annotation 5 PHE A 137
ILE A  83
LEU A   8
GLY A  86
ILE A  85
 None
 1.21A 2ogyA-5xniA:
undetectable		 2ogyA-5xniA:
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.
5y4g AMBP3

(Fischerella
ambigua) 		no annotation 5 GLU A 207
PHE A 288
ILE A 185
LEU A 186
ILE A 208
 None
 1.17A 2ogyA-5y4gA:
undetectable		 2ogyA-5y4gA:
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.
6apj ALPHA-N-ACETYLGALACT
OSAMINIDE
ALPHA-2,6-SIALYLTRAN
SFERASE 2

(Homo sapiens) 		no annotation 5 ASP A 278
ILE A 280
GLY A 113
SER A 106
GLN A 107
 None
 1.27A 2ogyA-6apjA:
undetectable		 2ogyA-6apjA:
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.
6b5i RETINAL
DEHYDROGENASE 2

(Homo sapiens) 		no annotation 5 MET A 123
ILE A 197
LEU A 109
GLY A 223
ILE A 238
 None
 1.28A 2ogyA-6b5iA:
undetectable		 2ogyA-6b5iA:
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.
6chs PUTATIVE CELL
DIVISION CONTROL
PROTEIN

(Chaetomium
thermophilum) 		no annotation 5 MET H 404
ILE H 222
LEU H 269
GLY H 424
ILE H 396
 None
None
AGS  H 901 (-4.4A)
AGS  H 901 (-3.5A)
AGS  H 901 ( 4.2A)
 1.26A 2ogyA-6chsH:
2.2		 2ogyA-6chsH:
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.
6e12 -

(-) 		no annotation 5 ILE A 122
LEU A  67
GLY A 194
GLN A  59
ILE A 195
 None
 1.18A 2ogyA-6e12A:
undetectable		 2ogyA-6e12A:
undetectable