SIMILAR PATTERNS OF AMINO ACIDS FOR 1SG9_A_SAMA301_1

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.
1d7a PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE

(Escherichia
coli) 		PF00731
(AIRC) 		4 THR A  22
GLY A 100
ASP A 102
ALA A  96
 None
 0.79A 1sg9A-1d7aA:
4.2		 1sg9A-1d7aA:
20.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dy2 COLLAGEN ALPHA1(XV)
CHAIN

(Mus musculus) 		PF06482
(Endostatin) 		4 THR A 182
GLY A 177
ASP A 176
ALA A  90
 None
 1.25A 1sg9A-1dy2A:
undetectable		 1sg9A-1dy2A:
18.44
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.
1e6v METHYL-COENZYME M
REDUCTASE I BETA
SUBUNIT
METHYL-COENZYME M
REDUCTASE I GAMMA
SUBUNIT

(Methanopyrus
kandleri;
Methanopyrus
kandleri) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N)
PF02240
(MCR_gamma) 		4 THR B 404
GLY C  79
ASP C 133
ALA B 321
 None
 1.11A 1sg9A-1e6vB:
undetectable		 1sg9A-1e6vB:
20.94
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.
1f7u ARGINYL-TRNA
SYNTHETASE

(Saccharomyces
cerevisiae) 		PF00750
(tRNA-synt_1d)
PF03485
(Arg_tRNA_synt_N)
PF05746
(DALR_1) 		4 THR A 349
GLY A 343
ASP A 342
ALA A 321
 None
None
None
C  B 974 ( 3.8A)
 1.23A 1sg9A-1f7uA:
2.8		 1sg9A-1f7uA:
21.09
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.
1geg ACETOIN REDUCTASE

(Klebsiella
pneumoniae) 		PF00106
(adh_short) 		4 THR A 187
GLY A  11
ASP A  33
ALA A  87
 NAD  A2001 (-2.7A)
NAD  A2001 ( 4.1A)
NAD  A2001 (-2.8A)
NAD  A2001 (-3.6A)
 1.18A 1sg9A-1gegA:
6.7		 1sg9A-1gegA:
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.
1iy8 LEVODIONE REDUCTASE

(Leifsonia
aquatica) 		PF13561
(adh_short_C2) 		4 THR A 200
GLY A  22
ASP A  44
ALA A 100
 NAD  A1268 (-2.8A)
NAD  A1268 ( 4.1A)
NAD  A1268 (-2.7A)
NAD  A1268 ( 3.7A)
 1.22A 1sg9A-1iy8A:
7.1		 1sg9A-1iy8A:
25.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lt8 BETAINE-HOMOCYSTEINE
METHYLTRANSFERASE

(Homo sapiens) 		PF02574
(S-methyl_trans) 		4 THR A 184
GLY A  25
ASP A  26
ALA A 119
 None
 1.19A 1sg9A-1lt8A:
undetectable		 1sg9A-1lt8A:
23.68
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.
1mg5 ALCOHOL
DEHYDROGENASE

(Drosophila
melanogaster) 		PF00106
(adh_short) 		4 THR A 187
GLY A  14
ASP A  38
ALA A  93
 NAI  A 850 (-2.7A)
None
NAI  A 850 (-2.8A)
NAI  A 850 (-3.5A)
 1.25A 1sg9A-1mg5A:
6.1		 1sg9A-1mg5A:
24.28
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.
1qho ALPHA-AMYLASE

(Geobacillus
stearothermophilus) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C) 		4 THR A 387
GLY A 463
ASP A 459
ALA A 486
 None
 1.19A 1sg9A-1qhoA:
undetectable		 1sg9A-1qhoA:
17.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1sg9 HEMK PROTEIN

(Thermotoga
maritima) 		PF05175
(MTS) 		4 THR A 106
GLY A 129
ASP A 151
ALA A 218
 SAM  A 301 (-3.4A)
SAM  A 301 (-3.3A)
SAM  A 301 (-2.9A)
SAM  A 301 (-3.3A)
 0.00A 1sg9A-1sg9A:
46.2		 1sg9A-1sg9A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sxj ACTIVATOR 1 95 KDA
SUBUNIT
ACTIVATOR 1 37 KDA
SUBUNIT

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF00004
(AAA)
PF08519
(RFC1)
PF00004
(AAA)
PF08542
(Rep_fac_C) 		4 THR B 120
GLY A 432
ASP A 433
ALA A 379
 None
 1.09A 1sg9A-1sxjB:
3.3		 1sg9A-1sxjB:
23.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v4g GLUTAMATE--CYSTEINE
LIGASE

(Escherichia
coli) 		PF04262
(Glu_cys_ligase) 		4 THR A 145
GLY A  37
ASP A  36
ALA A  40
 None
 1.26A 1sg9A-1v4gA:
undetectable		 1sg9A-1v4gA:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w7e BETA-IG-H3/FASCICLIN

(Rhodobacter
sphaeroides) 		PF02469
(Fasciclin) 		4 THR A  37
GLY A 151
ASP A 150
ALA A  69
 None
 1.06A 1sg9A-1w7eA:
undetectable		 1sg9A-1w7eA:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yni SUCCINYLARGININE
DIHYDROLASE

(Escherichia
coli) 		PF04996
(AstB) 		4 THR A 373
GLY A 123
ASP A 122
ALA A 115
 None
 1.15A 1sg9A-1yniA:
undetectable		 1sg9A-1yniA:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ypf GMP REDUCTASE

(Bacillus
anthracis) 		PF00478
(IMPDH) 		4 THR A 177
GLY A 187
ASP A   6
ALA A 192
 None
 1.19A 1sg9A-1ypfA:
undetectable		 1sg9A-1ypfA:
24.28
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.
1z8l GLUTAMATE
CARBOXYPEPTIDASE II

(Homo sapiens) 		PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28) 		4 THR A 738
GLY A 707
ASP A 710
ALA A 693
 None
 1.17A 1sg9A-1z8lA:
undetectable		 1sg9A-1z8lA:
17.21
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.
2b3t PROTEIN
METHYLTRANSFERASE
HEMK

(Escherichia
coli) 		PF13847
(Methyltransf_31) 		4 THR A  95
GLY A 117
ASP A 140
ALA A 206
 SAH  A 300 ( 4.3A)
SAH  A 300 (-3.4A)
SAH  A 300 (-3.1A)
SAH  A 300 (-3.4A)
 0.26A 1sg9A-2b3tA:
29.0		 1sg9A-2b3tA:
28.38
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.
2bs9 BETA-XYLOSIDASE

(Geobacillus
stearothermophilus) 		PF01229
(Glyco_hydro_39) 		4 THR A 239
GLY A 334
ASP A 291
ALA A 330
 None
 0.91A 1sg9A-2bs9A:
undetectable		 1sg9A-2bs9A:
23.06
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.
2c49 SUGAR KINASE MJ0406

(Methanocaldococcus
jannaschii) 		PF00294
(PfkB) 		4 THR A 111
GLY A 162
ASP A 160
ALA A  44
 ADN  A1301 (-3.1A)
MG  A1302 ( 4.4A)
MG  A1302 ( 4.1A)
ADN  A1301 ( 4.1A)
 1.14A 1sg9A-2c49A:
3.0		 1sg9A-2c49A:
22.70
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.
2igt SAM DEPENDENT
METHYLTRANSFERASE

(Agrobacterium
fabrum) 		PF10672
(Methyltrans_SAM) 		4 THR A 251
GLY A 141
ASP A 161
ALA A 191
 None
None
SAM  A1001 (-2.9A)
SAM  A1001 (-3.6A)
 1.27A 1sg9A-2igtA:
13.2		 1sg9A-2igtA:
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.
2k8i PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Escherichia
coli) 		PF00254
(FKBP_C) 		4 THR A  17
GLY A 121
ASP A 120
ALA A 126
 None
 1.20A 1sg9A-2k8iA:
undetectable		 1sg9A-2k8iA:
20.92
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.
2pa1 PDZ AND LIM DOMAIN
PROTEIN 2

(Homo sapiens) 		PF00595
(PDZ) 		4 THR A  30
GLY A  20
ASP A  22
ALA A  65
 None
 1.26A 1sg9A-2pa1A:
undetectable		 1sg9A-2pa1A:
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.
2qa1 POLYKETIDE OXYGENASE
PGAE

(Streptomyces
sp. PGA64) 		PF01494
(FAD_binding_3) 		4 THR A 449
GLY A  82
ASP A  80
ALA A 363
 None
 1.24A 1sg9A-2qa1A:
2.8		 1sg9A-2qa1A:
21.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vdw VACCINIA VIRUS
CAPPING ENZYME D1
SUBUNIT

(Vaccinia virus) 		PF03291
(Pox_MCEL) 		4 THR A 756
GLY A 600
ASP A 620
ALA A 680
 None
SAH  A1846 (-3.2A)
SAH  A1846 (-2.6A)
SAH  A1846 (-3.6A)
 1.10A 1sg9A-2vdwA:
11.3		 1sg9A-2vdwA:
22.70
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.
2vz5 TAX1-BINDING PROTEIN
3

(Homo sapiens) 		PF00595
(PDZ) 		4 THR A  58
GLY A  36
ASP A  38
ALA A  93
 None
 1.13A 1sg9A-2vz5A:
undetectable		 1sg9A-2vz5A:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wl7 DISKS LARGE HOMOLOG
2

(Mus musculus) 		PF00595
(PDZ) 		4 THR A 132
GLY A 117
ASP A 119
ALA A 168
 None
 1.21A 1sg9A-2wl7A:
undetectable		 1sg9A-2wl7A:
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.
2wsb GALACTITOL
DEHYDROGENASE

(Rhodobacter
sphaeroides) 		PF13561
(adh_short_C2) 		4 THR A 194
GLY A  20
ASP A  42
ALA A  93
 NAD  A 500 (-2.7A)
NAD  A 500 ( 3.8A)
NAD  A 500 (-2.8A)
NAD  A 500 (-3.6A)
 1.24A 1sg9A-2wsbA:
6.8		 1sg9A-2wsbA:
23.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x2i ALPHA-1,4-GLUCAN
LYASE ISOZYME 1

(Gracilariopsis
lemaneiformis) 		PF01055
(Glyco_hydro_31) 		4 THR A 424
GLY A 546
ASP A 548
ALA A 449
 None
 1.01A 1sg9A-2x2iA:
undetectable		 1sg9A-2x2iA:
13.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xik SERINE/THREONINE
PROTEIN KINASE 25

(Homo sapiens) 		PF00069
(Pkinase) 		4 THR A  79
GLY A 101
ASP A 105
ALA A 144
 J60  A1294 ( 4.2A)
J60  A1294 ( 3.8A)
J60  A1294 (-3.2A)
None
 1.24A 1sg9A-2xikA:
undetectable		 1sg9A-2xikA:
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.
2xkk TOPOISOMERASE IV

(Acinetobacter
baumannii) 		PF00521
(DNA_topoisoIV)
PF00986
(DNA_gyraseB_C)
PF01751
(Toprim) 		4 THR A 553
GLY A 541
ASP A 467
ALA A 399
 None
None
MG  A2487 (-2.9A)
None
 1.03A 1sg9A-2xkkA:
2.4		 1sg9A-2xkkA:
18.61
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.
2y93 CIS-2,3-DIHYDROBIPHE
NYL-2,3-DIOL
DEHYDROGENASE

(Comamonas
testosteroni) 		PF00106
(adh_short) 		4 THR A 189
GLY A  13
ASP A  36
ALA A  87
 None
 1.24A 1sg9A-2y93A:
6.0		 1sg9A-2y93A:
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.
2z0f PUTATIVE
PHOSPHOGLUCOMUTASE

(Thermus
thermophilus) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		4 THR A 387
GLY A 382
ASP A 381
ALA A 200
 None
 1.20A 1sg9A-2z0fA:
undetectable		 1sg9A-2z0fA:
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.
3a28 L-2.3-BUTANEDIOL
DEHYDROGENASE

(Corynebacterium
glutamicum) 		no annotation 4 THR C 189
GLY C  10
ASP C  33
ALA C  89
 NAD  C4300 (-2.6A)
None
NAD  C4300 (-3.0A)
NAD  C4300 ( 3.8A)
 1.24A 1sg9A-3a28C:
6.3		 1sg9A-3a28C:
22.65
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.
3afg SUBTILISIN-LIKE
SERINE PROTEASE

(Thermococcus
kodakarensis) 		PF00082
(Peptidase_S8)
PF04151
(PPC) 		4 THR A 353
GLY A 181
ASP A 147
ALA A 359
 None
 0.99A 1sg9A-3afgA:
2.0		 1sg9A-3afgA:
18.98
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.
3ak4 NADH-DEPENDENT
QUINUCLIDINONE
REDUCTASE

(Agrobacterium
tumefaciens) 		PF13561
(adh_short_C2) 		4 THR A 191
GLY A  17
ASP A  40
ALA A  91
 NAD  A 901 (-2.8A)
None
NAD  A 901 (-2.8A)
NAD  A 901 ( 3.7A)
 1.27A 1sg9A-3ak4A:
6.2		 1sg9A-3ak4A:
23.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b7f GLYCOSYL HYDROLASE,
BNR REPEAT

(Cupriavidus
pinatubonensis) 		no annotation 4 THR A 291
GLY A 354
ASP A 348
ALA A 351
 EDO  A 400 (-3.1A)
None
None
None
 1.02A 1sg9A-3b7fA:
undetectable		 1sg9A-3b7fA:
19.21
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.
3c41 AMINO ACID ABC
TRANSPORTER (ARTP)

(Geobacillus
stearothermophilus) 		PF00005
(ABC_tran) 		4 THR J 193
GLY J 203
ASP J 204
ALA J 183
 None
 1.16A 1sg9A-3c41J:
2.4		 1sg9A-3c41J:
21.43
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.
3c7o ENDO-1,4-BETA-XYLANA
SE

(Bacillus
subtilis) 		PF03422
(CBM_6)
PF04616
(Glyco_hydro_43) 		4 THR A 149
GLY A 144
ASP A 141
ALA A  97
 GOL  A1734 ( 4.3A)
None
None
None
 1.05A 1sg9A-3c7oA:
undetectable		 1sg9A-3c7oA:
20.09
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.
3fsr NADP-DEPENDENT
ALCOHOL
DEHYDROGENASE

(Clostridium
beijerinckii;
Thermoanaerobacter
brockii) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 THR A  43
GLY A 118
ASP A 117
ALA A   5
 None
 1.19A 1sg9A-3fsrA:
5.9		 1sg9A-3fsrA:
24.10
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.
3hz6 XYLULOKINASE

(Chromobacterium
violaceum) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		4 THR A 181
GLY A 240
ASP A 241
ALA A 159
 None
None
GOL  A 513 (-2.7A)
None
 1.27A 1sg9A-3hz6A:
undetectable		 1sg9A-3hz6A:
20.63
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.
3j08 COPPER-EXPORTING
P-TYPE ATPASE A

(Archaeoglobus
fulgidus) 		PF00122
(E1-E2_ATPase)
PF00702
(Hydrolase) 		4 THR A 428
GLY A 646
ASP A 647
ALA A 629
 None
 1.13A 1sg9A-3j08A:
2.9		 1sg9A-3j08A:
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.
3kd9 COENZYME A DISULFIDE
REDUCTASE

(Pyrococcus
horikoshii) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 THR A  37
GLY A 111
ASP A 280
ALA A  13
 None
 0.88A 1sg9A-3kd9A:
3.0		 1sg9A-3kd9A:
25.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kuu PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
PURE

(Yersinia pestis) 		PF00731
(AIRC) 		4 THR A  27
GLY A 105
ASP A 107
ALA A 101
 SO4  A 175 ( 4.2A)
None
None
SO4  A 176 (-3.5A)
 0.79A 1sg9A-3kuuA:
4.1		 1sg9A-3kuuA:
19.00
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.
3lr1 TUNGSTATE ABC
TRANSPORTER,
PERIPLASMIC
TUNGSTATE-BINDING
PROTEIN

(Geobacter
sulfurreducens) 		PF12849
(PBP_like_2) 		4 THR A 110
GLY A  94
ASP A  91
ALA A  98
 None
 1.20A 1sg9A-3lr1A:
undetectable		 1sg9A-3lr1A:
24.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mv3 COATOMER SUBUNIT
EPSILON

(Saccharomyces
cerevisiae) 		PF04733
(Coatomer_E) 		4 THR B  29
GLY B  57
ASP B  61
ALA B  38
 None
 1.25A 1sg9A-3mv3B:
2.3		 1sg9A-3mv3B:
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.
3o04 BETA-KETO-ACYL
CARRIER PROTEIN
SYNTHASE II

(Listeria
monocytogenes) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 THR A 305
GLY A 401
ASP A 265
ALA A 279
 None
 1.16A 1sg9A-3o04A:
undetectable		 1sg9A-3o04A:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qz4 ENDO-1,4-BETA-XYLANA
SE D

(Bacteroides
thetaiotaomicron) 		PF04616
(Glyco_hydro_43) 		4 THR A 152
GLY A 147
ASP A 145
ALA A  95
 None
 1.19A 1sg9A-3qz4A:
undetectable		 1sg9A-3qz4A:
22.47
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.
3rl7 DISKS LARGE HOMOLOG
1

(Homo sapiens) 		no annotation 4 THR B 256
GLY B 241
ASP B 243
ALA B 292
 None
 1.24A 1sg9A-3rl7B:
undetectable		 1sg9A-3rl7B:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rv2 S-ADENOSYLMETHIONINE
SYNTHASE

(Mycobacterium
marinum) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		4 THR A 165
GLY A 379
ASP A 270
ALA A 376
 None
 1.21A 1sg9A-3rv2A:
undetectable		 1sg9A-3rv2A:
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.
3wye DIACETYL REDUCTASE
[(S)-ACETOIN
FORMING],L-2,3-BUTAN
EDIOL
DEHYDROGENASE,DIACET
YL REDUCTASE
[(S)-ACETOIN
FORMING],L-2,3-BUTAN
EDIOL
DEHYDROGENASE,DIACET
YL REDUCTASE
[(S)-ACETOIN
FORMING],L-2,3-BUTAN
EDIOL
DEHYDROGENASE,DIACET
YL REDUCTASE
[(S)-ACETOIN
FORMING]

(Klebsiella
pneumoniae;
Corynebacterium
glutamicum) 		PF13561
(adh_short_C2) 		4 THR A 187
GLY A  11
ASP A  33
ALA A  87
 NAD  A 301 (-2.7A)
NAD  A 301 ( 4.2A)
NAD  A 301 (-2.8A)
NAD  A 301 ( 3.7A)
 1.19A 1sg9A-3wyeA:
6.5		 1sg9A-3wyeA:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cgt CYCLODEXTRIN
GLYCOSYLTRANSFERASE

(Bacillus
circulans) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C) 		4 THR A 386
GLY A 462
ASP A 458
ALA A 485
 None
 1.22A 1sg9A-4cgtA:
undetectable		 1sg9A-4cgtA:
17.25
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.
4f7k LACCASE

(uncultured
bacterium) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 THR A 369
GLY A 426
ASP A 216
ALA A 429
 None
 0.73A 1sg9A-4f7kA:
undetectable		 1sg9A-4f7kA:
21.59
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.
4fzd SERINE/THREONINE-PRO
TEIN KINASE MST4

(Homo sapiens) 		PF00069
(Pkinase) 		4 THR B  83
GLY B 105
ASP B 109
ALA B 148
 None
GOL  B1000 ( 3.9A)
None
None
 1.20A 1sg9A-4fzdB:
undetectable		 1sg9A-4fzdB:
25.08
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.
4h59 IRON-COMPOUND ABC
TRANSPORTER, IRON
COMPOUND-BINDING
PROTEIN

(Streptococcus
pneumoniae) 		PF01497
(Peripla_BP_2) 		4 THR A 137
GLY A 115
ASP A 112
ALA A  62
 None
None
None
CL  A 403 ( 4.1A)
 1.22A 1sg9A-4h59A:
3.3		 1sg9A-4h59A:
25.15
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.
4jb6 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Pseudomonas
aeruginosa) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 THR A 161
GLY A 111
ASP A  72
ALA A 194
 None
 1.19A 1sg9A-4jb6A:
undetectable		 1sg9A-4jb6A:
23.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jb6 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Pseudomonas
aeruginosa) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 THR A 306
GLY A 402
ASP A 266
ALA A 280
 None
 1.15A 1sg9A-4jb6A:
undetectable		 1sg9A-4jb6A:
23.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kf5 FLUORESCENT PROTEIN
SFCHERRY+GFP10-11

(synthetic
construct) 		PF01353
(GFP) 		4 THR C 106
GLY C 102
ASP C 101
ALA C 215
 None
 1.26A 1sg9A-4kf5C:
undetectable		 1sg9A-4kf5C:
20.85
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.
4kpn NUCLEOSIDE
N-RIBOHYDROLASE 1

(Physcomitrella
patens) 		PF01156
(IU_nuc_hydro) 		4 THR A 210
GLY A 142
ASP A  25
ALA A 183
 None
CA  A 400 ( 4.4A)
CA  A 400 (-2.9A)
None
 1.23A 1sg9A-4kpnA:
4.0		 1sg9A-4kpnA:
21.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kpn NUCLEOSIDE
N-RIBOHYDROLASE 1

(Physcomitrella
patens) 		PF01156
(IU_nuc_hydro) 		4 THR A 261
GLY A 142
ASP A  25
ALA A 183
 None
CA  A 400 ( 4.4A)
CA  A 400 (-2.9A)
None
 1.27A 1sg9A-4kpnA:
4.0		 1sg9A-4kpnA:
21.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kpo NUCLEOSIDE
N-RIBOHYDROLASE 3

(Zea mays) 		PF01156
(IU_nuc_hydro) 		4 THR A 192
GLY A 124
ASP A   8
ALA A 165
 None
CA  A 401 ( 4.3A)
CA  A 401 (-3.1A)
None
 1.13A 1sg9A-4kpoA:
3.9		 1sg9A-4kpoA:
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.
4nbt 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
REDUCTASE

(Acholeplasma
laidlawii) 		PF13561
(adh_short_C2) 		4 THR A 183
GLY A  14
ASP A  37
ALA A  82
 NAD  A 301 (-2.7A)
None
NAD  A 301 (-2.5A)
NAD  A 301 (-3.6A)
 1.24A 1sg9A-4nbtA:
6.0		 1sg9A-4nbtA:
22.90
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.
4nnm TAX1-BINDING PROTEIN
3

(Homo sapiens) 		PF00595
(PDZ) 		4 THR A  59
GLY A  37
ASP A  39
ALA A  94
 None
 1.23A 1sg9A-4nnmA:
undetectable		 1sg9A-4nnmA:
16.30
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.
4o27 SERINE/THREONINE-PRO
TEIN KINASE 24

(Homo sapiens) 		PF00069
(Pkinase) 		4 THR B  83
GLY B 105
ASP B 109
ALA B 148
 ADP  B 500 ( 4.9A)
None
None
None
 1.22A 1sg9A-4o27B:
undetectable		 1sg9A-4o27B:
24.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p99 MPAFP_RII
TETRA-TANDEMER

(Marinomonas
primoryensis) 		no annotation 4 THR A  14
GLY A 194
ASP A 191
ALA A  21
 CA  A 512 (-3.1A)
None
CA  A 515 (-3.5A)
None
 1.04A 1sg9A-4p99A:
undetectable		 1sg9A-4p99A:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p99 MPAFP_RII
TETRA-TANDEMER

(Marinomonas
primoryensis) 		no annotation 4 THR A 118
GLY A 298
ASP A 295
ALA A 125
 CA  A 517 (-3.0A)
None
CA  A 519 (-3.3A)
None
 1.05A 1sg9A-4p99A:
undetectable		 1sg9A-4p99A:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p99 MPAFP_RII
TETRA-TANDEMER

(Marinomonas
primoryensis) 		no annotation 4 THR A 222
GLY A 402
ASP A 399
ALA A 229
 CA  A 503 (-3.0A)
None
CA  A 501 (-3.4A)
None
 0.99A 1sg9A-4p99A:
undetectable		 1sg9A-4p99A:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r8e 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Yersinia pestis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 THR A 305
GLY A 402
ASP A 265
ALA A 279
 None
 1.19A 1sg9A-4r8eA:
undetectable		 1sg9A-4r8eA:
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.
4rzm EPOXIDE HYDROLASE
LASB

(Streptomyces
lasaliensis) 		PF12680
(SnoaL_2) 		4 THR A  42
GLY A 208
ASP A 135
ALA A 204
 None
 1.20A 1sg9A-4rzmA:
undetectable		 1sg9A-4rzmA:
22.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tma DNA GYRASE SUBUNIT B

(Escherichia
coli) 		PF00986
(DNA_gyraseB_C)
PF01751
(Toprim) 		4 THR B 753
GLY B 741
ASP B 498
ALA B 428
 None
 0.89A 1sg9A-4tmaB:
undetectable		 1sg9A-4tmaB:
22.01
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.
4wcz ENOYL-COA
HYDRATASE/ISOMERASE

(Novosphingobium
aromaticivorans) 		PF00378
(ECH_1) 		4 THR A  99
GLY A 113
ASP A 144
ALA A  88
 None
 1.27A 1sg9A-4wczA:
undetectable		 1sg9A-4wczA:
22.64
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.
4wvm STONUSTOXIN SUBUNIT
ALPHA

(Synanceia
horrida) 		PF00622
(SPRY)
PF13765
(PRY) 		4 THR A 105
GLY A 208
ASP A 209
ALA A  89
 None
 0.91A 1sg9A-4wvmA:
2.4		 1sg9A-4wvmA:
19.09
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.
4wvm STONUSTOXIN SUBUNIT
BETA

(Synanceia
horrida) 		PF00622
(SPRY)
PF13765
(PRY) 		4 THR B 106
GLY B 209
ASP B 210
ALA B  90
 None
 0.97A 1sg9A-4wvmB:
undetectable		 1sg9A-4wvmB:
17.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xfk PUTATIVE BRANCHED
CHAIN AMINO ACID ABC
TRANSPORTER,
PERIPLASMIC AMINO
ACID-BINDING PROTEIN

(Brucella ovis) 		PF13458
(Peripla_BP_6) 		4 THR A 315
GLY A 322
ASP A 440
ALA A 327
 None
 1.17A 1sg9A-4xfkA:
5.0		 1sg9A-4xfkA:
23.15
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.
4ymw ABC-TYPE POLAR AMINO
ACID TRANSPORT
SYSTEM, ATPASE
COMPONENT

(Caldanaerobacter
subterraneus) 		no annotation 4 THR J 193
GLY J 203
ASP J 204
ALA J 183
 None
 1.14A 1sg9A-4ymwJ:
2.7		 1sg9A-4ymwJ:
22.95
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.
4yyf BETA-N-ACETYLHEXOSAM
INIDASE

(Mycolicibacterium
smegmatis) 		PF00933
(Glyco_hydro_3) 		4 THR A 280
GLY A 229
ASP A 182
ALA A 233
 None
 1.17A 1sg9A-4yyfA:
undetectable		 1sg9A-4yyfA:
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.
4z5y COENZYME PQQ
SYNTHESIS PROTEIN B

(Pseudomonas
putida) 		PF12706
(Lactamase_B_2) 		4 THR A 273
GLY A 221
ASP A 220
ALA A 246
 None
 1.16A 1sg9A-4z5yA:
undetectable		 1sg9A-4z5yA:
19.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ziu UNCHARACTERIZED
LIPOPROTEIN YFHM

(Escherichia
coli) 		PF07678
(A2M_comp) 		4 THR A1158
GLY A1034
ASP A1035
ALA A1126
 None
 1.20A 1sg9A-4ziuA:
undetectable		 1sg9A-4ziuA:
18.58
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.
5a42 UNCHARACTERIZED
LIPOPROTEIN YFHM

(Escherichia
coli) 		PF00207
(A2M)
PF01835
(A2M_N)
PF07703
(A2M_N_2)
PF11974
(MG1) 		4 THR A1158
GLY A1034
ASP A1035
ALA A1126
 None
 1.26A 1sg9A-5a42A:
undetectable		 1sg9A-5a42A:
10.99
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.
5a4j FORMATE--TETRAHYDROF
OLATE LIGASE

(Tepidanaerobacter
acetatoxydans) 		PF01268
(FTHFS) 		4 THR A  61
GLY A  81
ASP A  82
ALA A 267
 None
 1.20A 1sg9A-5a4jA:
undetectable		 1sg9A-5a4jA:
19.72
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.
5a8r METHYL-COENZYME M
REDUCTASE II SUBUNIT
GAMMA
METHYL-COENZYME M
REDUCTASE II,
SUBUNIT BETA

(Methanothermobacter
marburgensis;
Methanothermobacter
marburgensis) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N)
PF02240
(MCR_gamma) 		4 THR B 403
GLY C  78
ASP C 132
ALA B 320
 None
 1.14A 1sg9A-5a8rB:
undetectable		 1sg9A-5a8rB:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5az4 FLAGELLAR HOOK
SUBUNIT PROTEIN

(Campylobacter
jejuni) 		PF07196
(Flagellin_IN)
PF07559
(FlaE) 		4 THR A 414
GLY A 524
ASP A 519
ALA A 527
 None
 1.26A 1sg9A-5az4A:
undetectable		 1sg9A-5az4A:
16.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5d7w SERRALYSIN

(Serratia
marcescens) 		PF00353
(HemolysinCabind)
PF00413
(Peptidase_M10)
PF08548
(Peptidase_M10_C) 		4 THR A 272
GLY A 333
ASP A 338
ALA A 299
 THR  A 272 ( 0.8A)
GLY  A 333 ( 0.0A)
ASP  A 338 (-0.5A)
ALA  A 299 ( 0.0A)
 1.25A 1sg9A-5d7wA:
undetectable		 1sg9A-5d7wA:
21.14
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.
5d7w SERRALYSIN

(Serratia
marcescens) 		PF00353
(HemolysinCabind)
PF00413
(Peptidase_M10)
PF08548
(Peptidase_M10_C) 		4 THR A 272
GLY A 334
ASP A 338
ALA A 299
 THR  A 272 ( 0.8A)
GLY  A 334 (-0.0A)
ASP  A 338 (-0.5A)
ALA  A 299 ( 0.0A)
 0.90A 1sg9A-5d7wA:
undetectable		 1sg9A-5d7wA:
21.14
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.
5en4 17-BETA-HYDROXYSTERO
ID DEHYDROGENASE 14

(Homo sapiens) 		PF13561
(adh_short_C2) 		4 THR A 189
GLY A  18
ASP A  40
ALA A  90
 NAD  A 301 (-2.8A)
NAD  A 301 ( 4.2A)
NAD  A 301 (-2.8A)
NAD  A 301 ( 3.8A)
 1.20A 1sg9A-5en4A:
6.5		 1sg9A-5en4A:
24.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fp1 TONB-DEPENDENT
SIDEROPHORE RECEPTOR

(Acinetobacter
baumannii) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 THR A 117
GLY A  97
ASP A  96
ALA A  26
 None
 1.16A 1sg9A-5fp1A:
undetectable		 1sg9A-5fp1A:
16.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fzp DISPASE
AUTOLYSIS-INDUCING
PROTEIN

(Streptomyces
mobaraensis) 		no annotation 4 THR A  22
GLY A 323
ASP A 322
ALA A 320
 None
None
CA  A1351 (-2.3A)
None
 1.08A 1sg9A-5fzpA:
undetectable		 1sg9A-5fzpA:
19.72
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.
5irb RTX-ADHESIN

(Marinomonas
primoryensis) 		no annotation 4 THR A 197
GLY A 376
ASP A 373
ALA A 204
 CA  A 601 (-3.2A)
None
None
None
 1.10A 1sg9A-5irbA:
undetectable		 1sg9A-5irbA:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5irb RTX-ADHESIN

(Marinomonas
primoryensis) 		no annotation 4 THR A 301
GLY A 480
ASP A 477
ALA A 308
 CA  A 604 (-3.0A)
None
CA  A 602 (-3.2A)
None
 1.11A 1sg9A-5irbA:
undetectable		 1sg9A-5irbA:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5itw DIHYDROANTICAPSIN
7-DEHYDROGENASE

(Bacillus
subtilis) 		PF13561
(adh_short_C2) 		4 THR A 189
GLY A  15
ASP A  38
ALA A  90
 SO4  A 302 ( 3.9A)
None
None
None
 1.22A 1sg9A-5itwA:
6.9		 1sg9A-5itwA:
22.48
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.
5jla PUTATIVE SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE

(Paraburkholderia
xenovorans) 		PF13561
(adh_short_C2) 		4 THR A 188
GLY A  18
ASP A  40
ALA A  89
 NAD  A 401 (-2.5A)
NAD  A 401 ( 4.0A)
NAD  A 401 (-2.9A)
NAD  A 401 (-3.6A)
 1.25A 1sg9A-5jlaA:
6.3		 1sg9A-5jlaA:
23.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l2x DNA-DIRECTED
PRIMASE/POLYMERASE
PROTEIN

(Homo sapiens) 		no annotation 4 THR A 307
GLY A 127
ASP A 126
ALA A 132
 None
 0.84A 1sg9A-5l2xA:
undetectable		 1sg9A-5l2xA:
26.06
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.
5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE

(Methanocaldococcus
jannaschii) 		no annotation 4 THR A 196
GLY A 441
ASP A 442
ALA A 274
 None
PO4  A 504 (-3.3A)
GLC  A 501 ( 2.6A)
GLC  A 501 ( 4.3A)
 1.04A 1sg9A-5od2A:
3.9		 1sg9A-5od2A:
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.
5tw1 DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA

(Mycolicibacterium
smegmatis) 		PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF10385
(RNA_pol_Rpb2_45) 		4 THR C 962
GLY C 702
ASP C 695
ALA C 705
 None
 1.24A 1sg9A-5tw1C:
undetectable		 1sg9A-5tw1C:
14.72
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.
5ucy TUBULIN ALPHA CHAIN

(Tetrahymena
thermophila) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		4 THR A 179
GLY A  10
ASP A  69
ALA A  99
 GTP  A 501 (-3.6A)
GTP  A 501 (-2.2A)
GTP  A 501 ( 2.1A)
GTP  A 501 (-2.9A)
 1.11A 1sg9A-5ucyA:
undetectable		 1sg9A-5ucyA:
21.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v4s TRANSPORTER, CATION
CHANNEL FAMILY /
CYCLIC
NUCLEOTIDE-BINDING
DOMAIN MULTI-DOMAIN
PROTEIN

(Leptospira
licerasiae) 		PF00027
(cNMP_binding)
PF00520
(Ion_trans) 		4 THR A 213
GLY A 200
ASP A 201
ALA A 192
 None
 1.19A 1sg9A-5v4sA:
2.0		 1sg9A-5v4sA:
22.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5x7n DIAMINOPIMELATE
DECARBOXYLASE

(Corynebacterium
glutamicum) 		no annotation 4 THR A  43
GLY A 337
ASP A 378
ALA A 333
 None
 1.22A 1sg9A-5x7nA:
undetectable		 1sg9A-5x7nA:
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.
5xbj FLAGELLAR
HOOK-ASSOCIATED
PROTEIN FLGK

(Campylobacter
jejuni) 		no annotation 4 THR A 366
GLY A 470
ASP A 475
ALA A 327
 None
 1.02A 1sg9A-5xbjA:
undetectable		 1sg9A-5xbjA:
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.
6d9y SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Paraburkholderia
phymatum) 		no annotation 4 THR A 192
GLY A  16
ASP A  39
ALA A  92
 None
 1.23A 1sg9A-6d9yA:
7.1		 1sg9A-6d9yA:
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.
6ekv TOXIN COMPLEX
COMPONENT ORF-X2

(Clostridium
botulinum) 		no annotation 4 THR A 177
GLY A 713
ASP A 274
ALA A 348
 None
 1.07A 1sg9A-6ekvA:
undetectable		 1sg9A-6ekvA:
18.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6f8z ALPHA-1,2-MANNOSIDAS
E, PUTATIVE

(Bacteroides
thetaiotaomicron) 		no annotation 4 THR A  91
GLY A  72
ASP A  60
ALA A 167
 None
None
None
EDO  A 802 ( 4.2A)
 1.10A 1sg9A-6f8zA:
undetectable		 1sg9A-6f8zA:
undetectable