SIMILAR PATTERNS OF AMINO ACIDS FOR 2OGY_B_C2FB4000_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.
1bx0 PROTEIN
(FERREDOXIN:NADP+
OXIDOREDUCTASE)

(Spinacia
oleracea) 		PF00175
(NAD_binding_1) 		5 ILE A 174
LEU A 200
GLY A 203
SER A 234
GLN A 237
 None
None
None
PO4  A 316 (-3.1A)
None
 1.11A 2ogyB-1bx0A:
undetectable		 2ogyB-1bx0A:
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.
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 2ogyB-1d8cA:
8.3		 2ogyB-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 PHE A  16
ASP A 363
ASN A 339
ILE A 388
GLY A 368
 None
 1.25A 2ogyB-1d8cA:
8.3		 2ogyB-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.
1dnp DNA PHOTOLYASE

(Escherichia
coli) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		5 ILE A  54
LEU A  53
GLY A 244
GLN A 250
ARG A 249
 None
 1.36A 2ogyB-1dnpA:
undetectable		 2ogyB-1dnpA:
19.22
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.
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
 1.18A 2ogyB-1e6yB:
undetectable		 2ogyB-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) 		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
 0.40A 2ogyB-1f6yA:
45.6		 2ogyB-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
 1.12A 2ogyB-1f6yA:
45.6		 2ogyB-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) 		8 MET A  11
PHE A  12
ASP A  75
ASN A  96
SER A 198
GLN A 202
ARG A 207
ILE A 227
 None
 0.86A 2ogyB-1f6yA:
45.6		 2ogyB-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.
1itx GLYCOSYL HYDROLASE

(Bacillus
circulans) 		PF00704
(Glyco_hydro_18) 		5 MET A 277
ASP A 200
ILE A 159
GLY A 162
SER A 167
 GOL  A1007 ( 3.3A)
None
None
None
None
 1.32A 2ogyB-1itxA:
2.6		 2ogyB-1itxA:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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 2ogyB-1k3gA:
undetectable		 2ogyB-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
 1.24A 2ogyB-1kb0A:
undetectable		 2ogyB-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.
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
 1.23A 2ogyB-1ofeA:
7.9		 2ogyB-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)
 1.24A 2ogyB-1ofeA:
7.9		 2ogyB-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 2ogyB-1ps9A:
9.0		 2ogyB-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.
1qgz PROTEIN
(FERREDOXIN:NADP+
REDUCTASE)

(Nostoc sp. PCC
7119) 		PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		5 ILE A 159
LEU A 189
GLY A 192
SER A 223
GLN A 226
 None
None
None
SO4  A 307 (-2.6A)
None
 1.14A 2ogyB-1qgzA:
undetectable		 2ogyB-1qgzA:
22.93
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.
1twl INORGANIC
PYROPHOSPHATASE

(Pyrococcus
furiosus) 		PF00719
(Pyrophosphatase) 		5 ASP A 124
LEU A 130
GLY A  92
ARG A 161
ILE A  91
 None
 1.35A 2ogyB-1twlA:
undetectable		 2ogyB-1twlA:
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.
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
 0.71A 2ogyB-1twwA:
23.2		 2ogyB-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.
1v5c CHITOSANASE

(Bacillus sp.
(in: Bacteria)) 		PF01270
(Glyco_hydro_8) 		5 PHE A 293
ASN A 223
ILE A 219
LEU A 163
GLY A 184
 None
 1.21A 2ogyB-1v5cA:
undetectable		 2ogyB-1v5cA:
21.64
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.
1w36 EXODEOXYRIBONUCLEASE
V GAMMA CHAIN

(Escherichia
coli) 		PF04257
(Exonuc_V_gamma) 		5 GLU C 718
LEU C  46
GLY C 215
SER C 217
ARG C 706
 None
 1.25A 2ogyB-1w36C:
undetectable		 2ogyB-1w36C:
13.84
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.
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 2ogyB-1wa5C:
undetectable		 2ogyB-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.
2b5o FERREDOXIN--NADP
REDUCTASE

(Synechococcus
sp. PCC 7002) 		PF00175
(NAD_binding_1) 		5 ILE A 262
LEU A 288
GLY A 291
SER A 322
GLN A 325
 None
 1.13A 2ogyB-2b5oA:
undetectable		 2ogyB-2b5oA:
21.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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 2ogyB-2bejA:
undetectable		 2ogyB-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
 1.19A 2ogyB-2bmbA:
19.8		 2ogyB-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
 0.65A 2ogyB-2bmbA:
19.8		 2ogyB-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.
2dut HETEROCHROMATIN-ASSO
CIATED PROTEIN MENT

(Gallus gallus) 		PF00079
(Serpin) 		5 PHE A 105
LEU A  15
GLY A   9
SER A   5
ILE A 399
 None
 1.14A 2ogyB-2dutA:
undetectable		 2ogyB-2dutA:
21.38
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.
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
 1.24A 2ogyB-2g02A:
undetectable		 2ogyB-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.
2g02 NISIN BIOSYNTHESIS
PROTEIN NISC

(Lactococcus
lactis) 		PF05147
(LANC_like) 		5 PHE A  34
LEU A  48
GLY A  93
SER A  86
ILE A  94
 None
 1.36A 2ogyB-2g02A:
undetectable		 2ogyB-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.
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
 1.19A 2ogyB-2j13A:
3.1		 2ogyB-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.
2nv4 UPF0066 PROTEIN
AF_0241

(Archaeoglobus
fulgidus) 		PF01980
(UPF0066) 		5 GLU A  37
ILE A 121
LEU A 105
GLY A   7
ILE A   6
 None
 1.36A 2ogyB-2nv4A:
undetectable		 2ogyB-2nv4A:
19.01
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.
2osa N-CHIMAERIN

(Homo sapiens) 		PF00620
(RhoGAP) 		5 GLU A 291
ASP A 335
ASN A 337
GLY A 296
SER A 294
 None
 1.20A 2ogyB-2osaA:
undetectable		 2ogyB-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
 1.30A 2ogyB-2pyyA:
undetectable		 2ogyB-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)
 1.29A 2ogyB-2vawA:
2.9		 2ogyB-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
 1.26A 2ogyB-2vcaA:
4.9		 2ogyB-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)
 0.42A 2ogyB-2ycjA:
43.0		 2ogyB-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 2ogyB-2ycjA:
43.0		 2ogyB-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) 		6 MET A  12
ASP A  76
ASN A  97
ILE A 121
LEU A 123
GLN A 203
 None
C2F  A3000 (-3.4A)
C2F  A3000 (-3.0A)
C2F  A3000 ( 4.2A)
None
C2F  A3000 (-3.9A)
 1.17A 2ogyB-2ycjA:
43.0		 2ogyB-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
 1.35A 2ogyB-3b05A:
7.6		 2ogyB-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
 1.17A 2ogyB-3b1fA:
3.0		 2ogyB-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
 1.18A 2ogyB-3bitA:
undetectable		 2ogyB-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.
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
 0.64A 2ogyB-3bolA:
26.2		 2ogyB-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.
3cvj PUTATIVE
PHOSPHOHEPTOSE
ISOMERASE

(Bacillus
halodurans) 		PF13580
(SIS_2) 		5 ILE A  59
LEU A 202
GLY A 195
SER A 191
ILE A  55
 None
 1.07A 2ogyB-3cvjA:
undetectable		 2ogyB-3cvjA:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 1.29A 2ogyB-3d8pA:
undetectable		 2ogyB-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.
3ec1 YQEH GTPASE

(Geobacillus
stearothermophilus) 		PF01926
(MMR_HSR1) 		5 ILE A 179
GLY A 169
SER A  87
GLN A 227
ILE A  78
 None
 1.25A 2ogyB-3ec1A:
undetectable		 2ogyB-3ec1A:
19.79
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.
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
 1.28A 2ogyB-3elkA:
undetectable		 2ogyB-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.
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)
 1.24A 2ogyB-3gm8A:
4.2		 2ogyB-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.
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)
 0.94A 2ogyB-3jz4A:
undetectable		 2ogyB-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)
 0.27A 2ogyB-3k13A:
29.8		 2ogyB-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.
3lop SUBSTRATE BINDING
PERIPLASMIC PROTEIN

(Ralstonia
solanacearum) 		PF13458
(Peripla_BP_6) 		5 GLU A 318
LEU A 346
GLY A 134
GLN A  40
ILE A 151
 None
 1.32A 2ogyB-3lopA:
4.1		 2ogyB-3lopA:
24.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 1.21A 2ogyB-3lunA:
undetectable		 2ogyB-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
 1.36A 2ogyB-3n9iA:
undetectable		 2ogyB-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.
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
 1.35A 2ogyB-3r9wA:
undetectable		 2ogyB-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
 1.28A 2ogyB-3rh9A:
undetectable		 2ogyB-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.
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
 1.24A 2ogyB-3ufcX:
undetectable		 2ogyB-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
 1.25A 2ogyB-3v8bA:
2.7		 2ogyB-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.
3vo2 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Zea mays) 		PF00175
(NAD_binding_1) 		5 ILE A 174
LEU A 200
GLY A 203
SER A 234
GLN A 237
 None
 1.21A 2ogyB-3vo2A:
undetectable		 2ogyB-3vo2A:
22.19
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.
3w5v FERREDOXIN

(Zea mays) 		PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		5 ILE A 174
LEU A 200
GLY A 203
SER A 234
GLN A 237
 None
 1.15A 2ogyB-3w5vA:
undetectable		 2ogyB-3w5vA:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 1.33A 2ogyB-4a3sA:
undetectable		 2ogyB-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
 1.23A 2ogyB-4afrA:
undetectable		 2ogyB-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.
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 2ogyB-4cczA:
30.1		 2ogyB-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.
4cn8 PROXIMAL THREAD
MATRIX PROTEIN 1

(Mytilus
galloprovincialis) 		PF00092
(VWA) 		5 MET A  76
PHE A 226
ILE A 213
LEU A 145
SER A  62
 None
 1.22A 2ogyB-4cn8A:
undetectable		 2ogyB-4cn8A:
18.36
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.
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 2ogyB-4f52E:
undetectable		 2ogyB-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
 1.17A 2ogyB-4f92B:
undetectable		 2ogyB-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
 1.11A 2ogyB-4gbaA:
undetectable		 2ogyB-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.
4k68 GH10 XYLANASE

(soil metagenome) 		PF00331
(Glyco_hydro_10) 		5 MET A  79
ILE A  66
LEU A  63
GLY A 103
ILE A  73
 None
 1.30A 2ogyB-4k68A:
11.0		 2ogyB-4k68A:
23.14
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.
4m75 U6 SNRNA-ASSOCIATED
SM-LIKE PROTEIN LSM1
U6 SNRNA-ASSOCIATED
SM-LIKE PROTEIN LSM4

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF01423
(LSM)
PF01423
(LSM) 		5 GLU A 107
MET G  36
ASP A  72
ILE A  46
LEU A  68
 None
 1.22A 2ogyB-4m75A:
undetectable		 2ogyB-4m75A:
17.05
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.
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
 1.45A 2ogyB-4m9dA:
undetectable		 2ogyB-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
 1.19A 2ogyB-4m9dA:
undetectable		 2ogyB-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)
 1.09A 2ogyB-4o1eA:
33.8		 2ogyB-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)
 0.84A 2ogyB-4o1eA:
33.8		 2ogyB-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)
 0.54A 2ogyB-4o1eA:
33.8		 2ogyB-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.
4q22 GLYCOSIDE HYDROLASE
FAMILY 18

(Serratia
proteamaculans) 		PF00704
(Glyco_hydro_18) 		5 GLU A 372
LEU A 389
SER A 376
GLN A 352
ILE A 273
 None
 1.36A 2ogyB-4q22A:
7.7		 2ogyB-4q22A:
22.11
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.
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
 1.31A 2ogyB-4s2tP:
undetectable		 2ogyB-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.
4umf 3-DEOXY-D-MANNO-OCTU
LOSONATE 8-PHOSPHATE
PHOSPHATASE KDSC

(Moraxella
catarrhalis) 		PF00702
(Hydrolase) 		5 GLU A 156
PHE A 168
ILE A 108
LEU A  22
GLY A 149
 None
 1.32A 2ogyB-4umfA:
undetectable		 2ogyB-4umfA:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4v2x ENDO-BETA-1,4-GLUCAN
ASE (CELLULASE B)

(Bacillus
halodurans) 		PF00150
(Cellulase)
PF03442
(CBM_X2) 		5 ILE A 428
SER A 370
GLN A 310
ARG A 265
ILE A 373
 None
 1.28A 2ogyB-4v2xA:
5.6		 2ogyB-4v2xA:
18.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4v3d HB3VAR03 CIDRA
DOMAIN
ENDOTHELIAL PROTEIN
C RECEPTOR

(Plasmodium
falciparum;
Homo sapiens) 		PF03011
(PFEMP)
PF16497
(MHC_I_3) 		5 PHE B  91
ASP B  45
LEU A 645
GLY B  78
GLN B  85
 None
 1.04A 2ogyB-4v3dB:
undetectable		 2ogyB-4v3dB:
21.17
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.
4wd2 AROMATIC-AMINO-ACID
TRANSAMINASE TYRB

(Burkholderia
cenocepacia) 		PF00155
(Aminotran_1_2) 		5 ILE A  13
LEU A 370
GLY A  34
ARG A 317
ILE A  33
 None
None
None
None
GOL  A 501 (-4.6A)
 1.21A 2ogyB-4wd2A:
2.8		 2ogyB-4wd2A:
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.
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
 1.22A 2ogyB-4xqkA:
undetectable		 2ogyB-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
 1.32A 2ogyB-4xybA:
undetectable		 2ogyB-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.
4zr0 CERAMIDE VERY LONG
CHAIN FATTY ACID
HYDROXYLASE SCS7

(Saccharomyces
cerevisiae) 		PF04116
(FA_hydroxylase) 		5 PHE A 122
ILE A 158
LEU A 154
GLY A 269
ILE A 172
 None
 1.36A 2ogyB-4zr0A:
undetectable		 2ogyB-4zr0A:
20.39
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.
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
 1.11A 2ogyB-5a8rB:
undetectable		 2ogyB-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
 1.25A 2ogyB-5ah5A:
undetectable		 2ogyB-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.
5ahk ACETOLACTATE
SYNTHASE II, LARGE
SUBUNIT

(Pseudomonas
protegens) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 PHE A 298
ILE A 251
LEU A 231
GLY A 218
SER A 284
 None
None
None
FAD  A 701 (-3.1A)
FAD  A 701 (-3.6A)
 1.02A 2ogyB-5ahkA:
2.8		 2ogyB-5ahkA:
17.99
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.
5b47 2-OXOACID--FERREDOXI
N OXIDOREDUCTASE
ALPHA SUBUNIT

(Sulfurisphaera
tokodaii) 		PF01558
(POR)
PF01855
(POR_N)
PF17147
(PFOR_II) 		5 GLU A 619
ILE A 515
LEU A 534
GLY A 610
ILE A 614
 None
 1.33A 2ogyB-5b47A:
undetectable		 2ogyB-5b47A:
19.60
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.
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
 1.21A 2ogyB-5dqpA:
7.2		 2ogyB-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 2ogyB-5dqpA:
7.2		 2ogyB-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.
5ey8 ACYL-COA SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00501
(AMP-binding) 		5 GLU A 347
PHE A 442
ILE A 480
LEU A 478
GLY A 344
 None
None
5SV  A 701 (-3.6A)
None
5SV  A 701 (-3.6A)
 1.33A 2ogyB-5ey8A:
undetectable		 2ogyB-5ey8A:
18.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ey9 LONG-CHAIN-FATTY-ACI
D--AMP LIGASE FADD32

(Mycobacterium
marinum) 		PF00501
(AMP-binding) 		5 GLU A 346
PHE A 441
ILE A 479
LEU A 477
GLY A 343
 None
None
5SV  A 701 (-4.0A)
None
5SV  A 701 (-3.8A)
 1.36A 2ogyB-5ey9A:
undetectable		 2ogyB-5ey9A:
17.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 0.94A 2ogyB-5g2vA:
undetectable		 2ogyB-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.
5i4d SUPERANTIGEN-LIKE
PROTEIN

(Staphylococcus
aureus) 		PF02876
(Stap_Strp_tox_C)
PF09199
(SSL_OB) 		5 GLU A 262
ILE A 283
LEU A 293
SER A 264
ARG A 276
 None
 1.21A 2ogyB-5i4dA:
undetectable		 2ogyB-5i4dA:
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.
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
 1.34A 2ogyB-5jxkA:
undetectable		 2ogyB-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
 1.11A 2ogyB-5ksdA:
undetectable		 2ogyB-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.
5l2e GLUTAMATE RECEPTOR
IONOTROPIC,
DELTA-2,GLUTAMATE
RECEPTOR IONOTROPIC,
DELTA-2

(Rattus
norvegicus) 		PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		5 ASN A  54
ILE A  57
LEU A 332
GLY A 301
GLN A 296
 None
 1.36A 2ogyB-5l2eA:
2.5		 2ogyB-5l2eA:
18.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 1.20A 2ogyB-5m5pA:
undetectable		 2ogyB-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.
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)
 0.29A 2ogyB-5vopA:
30.8		 2ogyB-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
 1.19A 2ogyB-5xniA:
undetectable		 2ogyB-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
 1.12A 2ogyB-5y4gA:
undetectable		 2ogyB-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.
6a8m -

(-) 		no annotation 5 ILE A 226
LEU A 232
GLY A 191
SER A 189
ILE A 293
 None
 1.09A 2ogyB-6a8mA:
undetectable		 2ogyB-6a8mA:
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
 1.21A 2ogyB-6b5iA:
undetectable		 2ogyB-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.
6c1d UNCONVENTIONAL
MYOSIN-IB

(Rattus
norvegicus) 		no annotation 5 GLU P 392
PHE P 394
LEU P 621
GLY P 108
SER P 110
 None
 1.14A 2ogyB-6c1dP:
2.1		 2ogyB-6c1dP:
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)
 1.23A 2ogyB-6chsH:
2.4		 2ogyB-6chsH:
undetectable