SIMILAR PATTERNS OF AMINO ACIDS FOR 3OU7_A_SAMA300

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.
1bf2 ISOAMYLASE

(Pseudomonas
amyloderamosa) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 TYR A  35
GLY A  38
GLY A 158
ASP A 119
LEU A 118
 None
 1.23A 3ou7A-1bf2A:
undetectable		 3ou7A-1bf2A:
15.26
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.
1bhe POLYGALACTURONASE

(Pectobacterium
carotovorum) 		PF00295
(Glyco_hydro_28) 		5 LEU A  59
ALA A  41
GLY A  39
GLY A 112
SER A 111
 None
 1.21A 3ou7A-1bheA:
undetectable		 3ou7A-1bheA:
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.
1cem CELLULASE CELA
(1,4-BETA-D-GLUCAN-G
LUCANOHYDROLASE)

(Ruminiclostridium
thermocellum) 		PF01270
(Glyco_hydro_8) 		5 LEU A 350
TYR A  41
TRP A 284
GLY A 347
ASP A 349
 None
 0.97A 3ou7A-1cemA:
undetectable		 3ou7A-1cemA:
21.31
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.
1cjy PROTEIN (CYTOSOLIC
PHOSPHOLIPASE A2)

(Homo sapiens) 		PF00168
(C2)
PF01735
(PLA2_B) 		5 ALA A 396
GLY A 394
GLY A 551
SER A 550
LEU A 421
 None
 1.21A 3ou7A-1cjyA:
undetectable		 3ou7A-1cjyA:
13.62
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.
1db3 GDP-MANNOSE
4,6-DEHYDRATASE

(Escherichia
coli) 		PF16363
(GDP_Man_Dehyd) 		5 LEU A   5
TYR A  83
ALA A  18
GLY A  14
GLY A  30
 None
 1.12A 3ou7A-1db3A:
4.4		 3ou7A-1db3A:
22.28
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.
1ibj CYSTATHIONINE
BETA-LYASE

(Arabidopsis
thaliana) 		PF01053
(Cys_Met_Meta_PP) 		5 LEU A 108
TYR A 109
TYR A 125
ALA A 137
LEU A 322
 None
 1.12A 3ou7A-1ibjA:
undetectable		 3ou7A-1ibjA:
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.
1itx GLYCOSYL HYDROLASE

(Bacillus
circulans) 		PF00704
(Glyco_hydro_18) 		5 TYR A 279
ALA A 430
GLY A 334
ASP A 450
LEU A 451
 GOL  A1007 ( 4.8A)
None
None
None
None
 1.26A 3ou7A-1itxA:
undetectable		 3ou7A-1itxA:
19.10
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.
1jf5 ALPHA AMYLASE II

(Thermoactinomyces
vulgaris) 		PF00128
(Alpha-amylase)
PF02903
(Alpha-amylase_N)
PF16657
(Malt_amylase_C) 		5 LEU A 426
TYR A 576
ALA A 439
ASP A 456
LEU A 417
 None
 1.15A 3ou7A-1jf5A:
undetectable		 3ou7A-1jf5A:
18.46
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.
1kcw CERULOPLASMIN

(Homo sapiens) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 LEU A  54
TYR A  53
ALA A  51
GLY A 173
TRP A 211
 None
 1.16A 3ou7A-1kcwA:
undetectable		 3ou7A-1kcwA:
11.74
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.
1lgf P450 MONOOXYGENASE

(Amycolatopsis
orientalis) 		PF00067
(p450) 		5 LEU A 152
ALA A 353
GLY A 349
GLY A 237
ASP A 238
 None
HEM  A 430 ( 3.9A)
HEM  A 430 ( 3.9A)
HEM  A 430 (-3.3A)
None
 1.21A 3ou7A-1lgfA:
undetectable		 3ou7A-1lgfA:
23.26
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.
1mzj BETA-KETOACYLSYNTHAS
E III

(Streptomyces
sp. R1128) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 LEU A 322
TYR A 324
ALA A 122
GLY A 317
GLY A 319
 None
None
None
None
ACE  A 502 ( 3.9A)
 1.18A 3ou7A-1mzjA:
undetectable		 3ou7A-1mzjA:
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.
1qnl ALIPHATIC AMIDASE
EXPRESSION-REGULATIN
G PROTEIN

(Pseudomonas
aeruginosa) 		PF13433
(Peripla_BP_5) 		5 TYR A 119
TYR A 104
ALA A 123
GLY A 121
SER A 336
 None
 1.02A 3ou7A-1qnlA:
undetectable		 3ou7A-1qnlA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rpn GDP-MANNOSE
4,6-DEHYDRATASE

(Pseudomonas
aeruginosa) 		PF16363
(GDP_Man_Dehyd) 		5 LEU A   6
TYR A  79
ALA A  19
GLY A  15
GLY A  31
 None
 1.12A 3ou7A-1rpnA:
3.8		 3ou7A-1rpnA:
23.98
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.
1ulv GLUCODEXTRANASE

(Arthrobacter
globiformis) 		PF00723
(Glyco_hydro_15)
PF09136
(Glucodextran_B)
PF09137
(Glucodextran_N)
PF09985
(Glucodextran_C) 		5 LEU A1003
GLY A 968
GLY A 789
ASP A 990
LEU A 989
 None
None
None
CA  A2005 (-3.9A)
None
 1.25A 3ou7A-1ulvA:
undetectable		 3ou7A-1ulvA:
12.46
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.
1v0z NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		5 ALA A 360
GLY A 370
MET A 383
ASP A 363
LEU A 362
 None
 1.12A 3ou7A-1v0zA:
undetectable		 3ou7A-1v0zA:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ve3 HYPOTHETICAL PROTEIN
PH0226

(Pyrococcus
horikoshii) 		PF13649
(Methyltransf_25) 		5 ALA A  46
GLY A  48
SER A  69
MET A  72
ASP A  93
 SAM  A 302 (-3.4A)
SAM  A 302 (-3.6A)
SAM  A 302 (-4.7A)
SAM  A 302 (-3.9A)
SAM  A 302 (-3.4A)
 0.64A 3ou7A-1ve3A:
17.2		 3ou7A-1ve3A:
27.08
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.
1wzn SAM-DEPENDENT
METHYLTRANSFERASE

(Pyrococcus
horikoshii) 		PF13649
(Methyltransf_25) 		6 TYR A   5
TYR A  12
ALA A  49
GLY A  51
MET A  75
ASP A  96
 SAH  A1001 (-3.5A)
SAH  A1001 (-4.9A)
SAH  A1001 (-3.4A)
SAH  A1001 (-3.1A)
SAH  A1001 (-4.4A)
SAH  A1001 (-3.3A)
 0.93A 3ou7A-1wznA:
18.9		 3ou7A-1wznA:
28.69
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.
1y8c S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE

(Clostridium
acetobutylicum) 		PF13649
(Methyltransf_25) 		5 ALA A  46
GLY A  48
SER A  69
MET A  72
ASP A  93
 None
 0.62A 3ou7A-1y8cA:
18.2		 3ou7A-1y8cA:
22.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2avn UBIQUINONE/MENAQUINO
NE BIOSYNTHESIS
METHYLTRANSFERASE-RE
LATED PROTEIN

(Thermotoga
maritima) 		PF08241
(Methyltransf_11) 		6 TYR A   9
TYR A  16
GLY A  52
TRP A  56
SER A  73
MET A  76
 SAI  A1300 (-3.8A)
SAI  A1300 (-4.9A)
SAI  A1300 (-3.5A)
None
SAI  A1300 (-4.7A)
SAI  A1300 ( 4.2A)
 0.72A 3ou7A-2avnA:
19.0		 3ou7A-2avnA:
26.29
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.
2det TRNA-SPECIFIC
2-THIOURIDYLASE MNMA

(Escherichia
coli) 		PF03054
(tRNA_Me_trans) 		5 ALA A 125
GLY A  11
GLY A 127
SER A  18
MET A  12
 None
None
SO4  A5001 ( 3.8A)
SO4  A5001 (-2.7A)
None
 1.18A 3ou7A-2detA:
undetectable		 3ou7A-2detA:
21.15
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.
2ehd OXIDOREDUCTASE,
SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY

(Thermus
thermophilus) 		PF00106
(adh_short) 		5 LEU A  42
ALA A  22
GLY A  18
SER A  14
LEU A  49
 None
None
None
CO  A1001 (-3.0A)
None
 1.21A 3ou7A-2ehdA:
6.3		 3ou7A-2ehdA:
25.46
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.
2fiy PROTEIN FDHE HOMOLOG

(Pseudomonas
aeruginosa) 		PF04216
(FdhE) 		5 LEU A 107
TYR A 110
ALA A 121
GLY A 119
LEU A 152
 None
 1.19A 3ou7A-2fiyA:
undetectable		 3ou7A-2fiyA:
23.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gs9 HYPOTHETICAL PROTEIN
TT1324

(Thermus
thermophilus) 		PF08241
(Methyltransf_11) 		5 TYR A  11
GLY A  47
TRP A  51
SER A  66
MET A  69
 None
SAH  A 301 (-3.5A)
SAH  A 301 (-4.6A)
SAH  A 301 (-4.5A)
SAH  A 301 (-4.2A)
 0.72A 3ou7A-2gs9A:
15.9		 3ou7A-2gs9A:
24.14
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.
2h3g BIOSYNTHETIC PROTEIN

(Bacillus
anthracis) 		PF03309
(Pan_kinase) 		5 LEU X 246
ALA X  12
GLY X   8
SER X  63
LEU X  14
 None
None
EDO  X 501 (-3.6A)
None
None
 1.17A 3ou7A-2h3gX:
undetectable		 3ou7A-2h3gX:
22.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ifw SCYTALIDOPEPSIN B

(Scytalidium
lignicola) 		PF01828
(Peptidase_A4) 		5 TYR A  59
ALA A  28
GLY A  62
GLY A  31
SER A  32
 None
 1.22A 3ou7A-2ifwA:
undetectable		 3ou7A-2ifwA:
21.03
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.
2jah CLAVULANIC ACID
DEHYDROGENASE

(Streptomyces
clavuligerus) 		PF00106
(adh_short) 		5 LEU A  44
ALA A  24
GLY A  20
SER A  16
LEU A  51
 None
None
None
NDP  A1248 (-2.6A)
None
 1.23A 3ou7A-2jahA:
5.7		 3ou7A-2jahA:
26.10
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.
2jch PENICILLIN-BINDING
PROTEIN 1B

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase)
PF00912
(Transgly) 		5 TYR A 468
ALA A 471
GLY A 469
GLY A 478
MET A 616
 None
 1.25A 3ou7A-2jchA:
undetectable		 3ou7A-2jchA:
16.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2m9p SERINE PROTEASE
SUBUNIT NS2B, SERINE
PROTEASE NS3

(Dengue virus) 		PF00949
(Peptidase_S7)
PF01002
(Flavi_NS2B) 		5 LEU A 210
TYR A 222
GLY A 194
GLY A 197
SER A 196
 None
 1.04A 3ou7A-2m9pA:
undetectable		 3ou7A-2m9pA:
20.68
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.
2qc5 STREPTOGRAMIN B
LACTONASE

(Staphylococcus
cohnii) 		no annotation 5 LEU A 196
ALA A 153
GLY A 149
SER A 150
LEU A 154
 LEU  A 196 ( 0.6A)
ALA  A 153 ( 0.0A)
GLY  A 149 ( 0.0A)
SER  A 150 ( 0.0A)
LEU  A 154 ( 0.5A)
 1.02A 3ou7A-2qc5A:
undetectable		 3ou7A-2qc5A:
19.61
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.
2qny 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Mycobacterium
tuberculosis) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 LEU A 308
TYR A 310
ALA A 113
GLY A 303
GLY A 305
 None
None
None
None
DFD  A 760 (-3.6A)
 1.09A 3ou7A-2qnyA:
undetectable		 3ou7A-2qnyA:
23.60
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.
2uzz N-METHYL-L-TRYPTOPHA
N OXIDASE

(Escherichia
coli) 		PF01266
(DAO) 		5 ALA A  16
GLY A  18
GLY A  11
SER A  10
MET A  30
 None
None
FAD  A1373 (-3.4A)
None
None
 1.05A 3ou7A-2uzzA:
2.5		 3ou7A-2uzzA:
21.18
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.
2vsa MOSQUITOCIDAL TOXIN

(Lysinibacillus
sphaericus) 		PF05588
(Botulinum_HA-17)
PF14200
(RicinB_lectin_2) 		5 LEU A 359
GLY A 376
SER A 323
LEU A 361
TRP A 338
 None
 1.26A 3ou7A-2vsaA:
undetectable		 3ou7A-2vsaA:
12.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w9m POLYMERASE X

(Deinococcus
radiodurans) 		PF14520
(HHH_5)
PF14716
(HHH_8) 		5 LEU A 154
GLY A 104
GLY A 101
ASP A  98
LEU A  99
 None
 1.22A 3ou7A-2w9mA:
undetectable		 3ou7A-2w9mA:
20.49
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.
2wuq BETA-LACTAMASE
REGULATORY PROTEIN
BLAB

(Streptomyces
cacaoi) 		PF13354
(Beta-lactamase2) 		5 LEU A  53
ALA A 113
GLY A 111
MET A 144
LEU A 101
 None
 1.22A 3ou7A-2wuqA:
undetectable		 3ou7A-2wuqA:
24.36
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.
2xlr FLAVIN-CONTAINING
MONOOXYGENASE

(Methylophaga
aminisulfidivorans) 		PF00743
(FMO-like) 		5 LEU A 229
TYR A 240
ALA A 214
GLY A 218
SER A 219
 None
 1.23A 3ou7A-2xlrA:
2.2		 3ou7A-2xlrA:
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.
2xvs TETRATRICOPEPTIDE
REPEAT PROTEIN 5

(Homo sapiens) 		PF16669
(TTC5_OB) 		5 LEU A 296
GLY A 381
GLY A 339
SER A 383
ASP A 359
 None
 1.26A 3ou7A-2xvsA:
undetectable		 3ou7A-2xvsA:
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.
2z2n VIRGINIAMYCIN B
LYASE

(Staphylococcus
aureus) 		no annotation 5 LEU A 196
ALA A 153
GLY A 149
SER A 150
LEU A 154
 None
 1.02A 3ou7A-2z2nA:
undetectable		 3ou7A-2z2nA:
18.64
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.
2z37 CHITINASE

(Brassica juncea) 		PF00182
(Glyco_hydro_19) 		5 ALA A 289
GLY A 261
SER A 266
MET A 264
LEU A 282
 None
 1.07A 3ou7A-2z37A:
undetectable		 3ou7A-2z37A:
21.34
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.
2z37 CHITINASE

(Brassica juncea) 		PF00182
(Glyco_hydro_19) 		5 TYR A 258
ALA A 289
SER A 266
MET A 264
LEU A 282
 None
 1.11A 3ou7A-2z37A:
undetectable		 3ou7A-2z37A:
21.34
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.
3bgk PUTATIVE
UNCHARACTERIZED
PROTEIN

(Streptococcus
mutans) 		PF01256
(Carb_kinase) 		5 LEU A 101
TYR A  36
ALA A  39
GLY A  37
GLY A  31
 None
 1.25A 3ou7A-3bgkA:
4.5		 3ou7A-3bgkA:
21.15
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.
3bkw S-ADENOSYLMETHIONINE
DEPENDENT
METHYLTRANSFERASE

(Mesorhizobium
japonicum) 		PF08241
(Methyltransf_11) 		5 GLY A  52
SER A  74
MET A  77
ASP A  96
LEU A  97
 None
 0.71A 3ou7A-3bkwA:
16.9		 3ou7A-3bkwA:
25.77
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.
3bxo N,N-DIMETHYLTRANSFER
ASE

(Streptomyces
venezuelae) 		PF13649
(Methyltransf_25) 		5 ALA A  46
GLY A  48
SER A  69
MET A  72
ASP A  89
 SAM  A 238 (-3.2A)
SAM  A 238 ( 3.7A)
SAM  A 238 (-4.6A)
SAM  A 238 (-4.2A)
SAM  A 238 (-3.0A)
 0.62A 3ou7A-3bxoA:
16.3		 3ou7A-3bxoA:
25.69
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.
3dyj TALIN-1

(Mus musculus) 		no annotation 5 LEU A2283
ALA A2244
GLY A2246
GLY A2240
LEU A2216
 None
 1.21A 3ou7A-3dyjA:
undetectable		 3ou7A-3dyjA:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e23 UNCHARACTERIZED
PROTEIN RPA2492

(Rhodopseudomonas
palustris) 		PF08241
(Methyltransf_11) 		5 LEU A  14
GLY A  53
TRP A 107
GLY A  73
SER A  74
 SAM  A 221 (-4.4A)
SAM  A 221 (-3.2A)
None
SAM  A 221 (-3.2A)
SAM  A 221 (-4.6A)
 1.24A 3ou7A-3e23A:
18.6		 3ou7A-3e23A:
27.03
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.
3e23 UNCHARACTERIZED
PROTEIN RPA2492

(Rhodopseudomonas
palustris) 		PF08241
(Methyltransf_11) 		6 LEU A  14
TYR A  17
TYR A  24
GLY A  53
GLY A  73
SER A  74
 SAM  A 221 (-4.4A)
SAM  A 221 (-3.8A)
SAM  A 221 (-4.7A)
SAM  A 221 (-3.2A)
SAM  A 221 (-3.2A)
SAM  A 221 (-4.6A)
 0.89A 3ou7A-3e23A:
18.6		 3ou7A-3e23A:
27.03
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.
3fpz THIAZOLE
BIOSYNTHETIC ENZYME

(Saccharomyces
cerevisiae) 		PF01946
(Thi4) 		5 ALA A 289
GLY A  77
SER A  75
MET A 309
LEU A 232
 None
None
AHZ  A1100 (-3.6A)
AHZ  A1100 (-3.3A)
None
 1.23A 3ou7A-3fpzA:
2.1		 3ou7A-3fpzA:
23.36
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.
3fsx TETRAHYDRODIPICOLINA
TE
N-SUCCINYLTRANSFERAS
E

(Mycobacterium
tuberculosis) 		PF14602
(Hexapep_2)
PF14789
(THDPS_M) 		5 GLY A 247
GLY A 245
SER A 219
MET A 221
LEU A 260
 None
None
ACY  A 331 (-2.6A)
None
None
 1.18A 3ou7A-3fsxA:
undetectable		 3ou7A-3fsxA:
26.13
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.
3gl3 PUTATIVE
THIOL:DISULFIDE
INTERCHANGE PROTEIN
DSBE

(Chlorobaculum
tepidum) 		PF08534
(Redoxin) 		5 ALA A  35
GLY A 142
GLY A  32
ASP A  30
LEU A  29
 None
 1.26A 3ou7A-3gl3A:
undetectable		 3ou7A-3gl3A:
23.56
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.
3hdy UDP-GALACTOPYRANOSE
MUTASE

(Deinococcus
radiodurans) 		PF03275
(GLF)
PF13450
(NAD_binding_8) 		5 TYR A  69
TYR A  82
ALA A  37
GLY A  66
LEU A 230
 None
None
None
FAD  A 450 (-3.4A)
None
 1.12A 3ou7A-3hdyA:
undetectable		 3ou7A-3hdyA:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l77 SHORT-CHAIN ALCOHOL
DEHYDROGENASE

(Thermococcus
sibiricus) 		PF00106
(adh_short) 		5 LEU A  38
ALA A  18
GLY A  14
SER A  10
LEU A  45
 None
None
None
NJP  A 501 (-2.7A)
None
 1.22A 3ou7A-3l77A:
5.5		 3ou7A-3l77A:
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.
3l8d METHYLTRANSFERASE

(Bacillus
thuringiensis) 		PF08241
(Methyltransf_11) 		5 GLY A  63
SER A  84
MET A  87
ASP A 106
LEU A 107
 None
 1.06A 3ou7A-3l8dA:
14.2		 3ou7A-3l8dA:
20.47
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.
3lsc TRIAZINE HYDROLASE

(Paenarthrobacter
aurescens) 		PF01979
(Amidohydro_1) 		5 TYR A  67
ALA A 328
GLY A  69
GLY A 326
TRP A  85
 AOO  A 457 (-4.7A)
None
None
None
None
 1.16A 3ou7A-3lscA:
undetectable		 3ou7A-3lscA:
20.27
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.
3nz4 PHENYLALANINE
AMMONIA-LYASE

(Taxus
canadensis) 		PF00221
(Lyase_aromatic) 		5 TYR A 245
ALA A 247
SER A 241
ASP A 473
LEU A 476
 None
 1.21A 3ou7A-3nz4A:
undetectable		 3ou7A-3nz4A:
16.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3okz PUTATIVE
UNCHARACTERIZED
PROTEIN GBS0355

(Streptococcus
agalactiae) 		PF03816
(LytR_cpsA_psr) 		5 ALA A 130
GLY A 132
GLY A  80
SER A  79
ASP A  68
 None
 1.22A 3ou7A-3okzA:
undetectable		 3ou7A-3okzA:
22.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ou6 SAM-DEPENDENT
METHYLTRANSFERASE

(Streptomyces
luridus) 		PF13649
(Methyltransf_25) 		12 LEU A  12
TYR A  15
TYR A  22
ALA A  54
GLY A  56
TRP A  60
GLY A  76
SER A  77
MET A  80
ASP A  98
LEU A  99
TRP A 116
 SAM  A 300 ( 3.9A)
SAM  A 300 ( 3.5A)
SAM  A 300 (-4.4A)
SAM  A 300 (-3.4A)
SAM  A 300 (-3.1A)
None
SAM  A 300 (-3.3A)
SAM  A 300 (-4.5A)
SAM  A 300 (-4.0A)
SAM  A 300 (-4.0A)
SAM  A 300 (-3.9A)
None
 0.12A 3ou7A-3ou6A:
40.0		 3ou7A-3ou6A:
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.
3pei CYTOSOL
AMINOPEPTIDASE

(Francisella
tularensis) 		PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N) 		5 TYR A 372
GLY A 374
GLY A 451
SER A 452
ASP A 456
 None
 1.17A 3ou7A-3peiA:
undetectable		 3ou7A-3peiA:
18.22
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.
3px2 N-METHYLTRANSFERASE

(Streptomyces
fradiae) 		PF13649
(Methyltransf_25) 		7 TYR A  14
TYR A  22
ALA A  58
GLY A  60
SER A  81
MET A  84
ASP A 101
 SAH  A 263 ( 3.9A)
SAH  A 263 (-4.6A)
SAH  A 263 (-3.5A)
SAH  A 263 (-3.3A)
SAH  A 263 (-4.7A)
SAH  A 263 (-4.5A)
SAH  A 263 (-3.5A)
 0.93A 3ou7A-3px2A:
17.1		 3ou7A-3px2A:
28.46
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.
3q98 TRANSCARBAMYLASE

(Escherichia
coli) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 LEU A 159
ALA A 118
GLY A  63
GLY A 120
SER A  65
 None
 1.13A 3ou7A-3q98A:
undetectable		 3ou7A-3q98A:
22.17
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.
3ti7 BASIC EXTRACELLULAR
SUBTILISIN-LIKE
PROTEASE BPRV

(Dichelobacter
nodosus) 		PF00082
(Peptidase_S8) 		5 LEU A 325
ALA A 249
GLY A 251
GLY A 227
LEU A 247
 None
 1.19A 3ou7A-3ti7A:
undetectable		 3ou7A-3ti7A:
19.83
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.
3v4y SERINE/THREONINE-PRO
TEIN PHOSPHATASE
PP1-ALPHA CATALYTIC
SUBUNIT

(Homo sapiens) 		PF00149
(Metallophos)
PF16891
(STPPase_N) 		5 LEU A  75
TYR A 255
ALA A 279
GLY A 254
SER A 268
 None
 1.17A 3ou7A-3v4yA:
undetectable		 3ou7A-3v4yA:
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.
3w15 PEROXISOMAL
TARGETING SIGNAL 2
RECEPTOR

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		5 LEU A 216
ALA A 223
GLY A 240
GLY A 220
SER A 219
 NO3  A 401 (-4.4A)
None
None
None
None
 1.01A 3ou7A-3w15A:
undetectable		 3ou7A-3w15A:
21.56
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.
4aef NEOPULLULANASE
(ALPHA-AMYLASE II)

(Pyrococcus
furiosus) 		PF00128
(Alpha-amylase)
PF02903
(Alpha-amylase_N)
PF16561
(AMPK1_CBM) 		5 LEU A 507
TYR A 630
ALA A 519
ASP A 536
LEU A 498
 None
 1.13A 3ou7A-4aefA:
undetectable		 3ou7A-4aefA:
15.94
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.
4bmv SHORT-CHAIN
DEHYDROGENASE

(Sphingobium
yanoikuyae) 		PF00106
(adh_short) 		5 LEU A  41
ALA A  21
GLY A  17
SER A  13
LEU A  48
 None
None
None
NAP  A 300 (-2.8A)
None
 1.19A 3ou7A-4bmvA:
5.4		 3ou7A-4bmvA:
23.72
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.
4cmn INOSITOL
POLYPHOSPHATE
5-PHOSPHATASE OCRL-1

(Homo sapiens) 		PF03372
(Exo_endo_phos) 		5 LEU A 519
ALA A 300
GLY A 304
GLY A 257
TRP A 297
 None
 1.20A 3ou7A-4cmnA:
undetectable		 3ou7A-4cmnA:
19.03
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.
4e6e CELL DIVISION
PROTEIN FTSZ

(Thermobifida
fusca) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 ALA A 100
GLY A 107
GLY A  19
ASP A 184
LEU A 187
 None
SO4  A 607 (-3.4A)
None
None
None
 1.23A 3ou7A-4e6eA:
3.0		 3ou7A-4e6eA:
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.
4emi TODA

(Pseudomonas
putida) 		PF07992
(Pyr_redox_2)
PF14759
(Reductase_C) 		5 LEU A 394
ALA A 350
GLY A 349
GLY A 344
LEU A 352
 None
 1.13A 3ou7A-4emiA:
undetectable		 3ou7A-4emiA:
21.18
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.
4evq PUTATIVE ABC
TRANSPORTER SUBUNIT,
SUBSTRATE-BINDING
COMPONENT

(Rhodopseudomonas
palustris) 		PF13458
(Peripla_BP_6) 		5 LEU A 364
TYR A 228
ALA A 158
GLY A 160
MET A 163
 None
 1.02A 3ou7A-4evqA:
2.4		 3ou7A-4evqA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fl3 TYROSINE-PROTEIN
KINASE SYK

(Homo sapiens) 		PF00017
(SH2)
PF07714
(Pkinase_Tyr) 		5 LEU A 365
TYR A 364
ALA A 421
GLY A 437
LEU A 446
 None
 1.12A 3ou7A-4fl3A:
undetectable		 3ou7A-4fl3A:
16.48
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.
4j6c CYTOCHROME P450
MONOOXYGENASE

(Nocardia
farcinica) 		PF00067
(p450) 		5 TYR A 176
SER A 159
MET A 155
ASP A 214
LEU A 215
 None
 1.17A 3ou7A-4j6cA:
undetectable		 3ou7A-4j6cA:
20.72
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.
4jrm 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Vibrio cholerae) 		no annotation 5 LEU D 168
GLY D 280
GLY D 407
SER D 408
MET D 284
 None
 1.26A 3ou7A-4jrmD:
undetectable		 3ou7A-4jrmD:
21.39
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.
4q29 PLU4264 PROTEIN

(Photorhabdus
laumondii) 		PF07883
(Cupin_2) 		5 GLY A  36
GLY A  21
SER A  22
ASP A  20
LEU A  19
 None
 1.18A 3ou7A-4q29A:
undetectable		 3ou7A-4q29A:
20.67
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.
4qdk MAGNESIUM-PROTOPORPH
YRIN
O-METHYLTRANSFERASE

(Synechocystis
sp. PCC 6803) 		PF07109
(Mg-por_mtran_C) 		5 GLY A  72
SER A  93
MET A  96
ASP A 120
LEU A 121
 SAH  A 301 (-3.6A)
SAH  A 301 (-4.6A)
SAH  A 301 (-4.2A)
SAH  A 301 (-3.8A)
SAH  A 301 (-3.6A)
 1.08A 3ou7A-4qdkA:
17.1		 3ou7A-4qdkA:
20.49
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.
4qrl HYPOTHETICAL PROTEIN

(Bacteroides
uniformis) 		PF16585
(Lipocalin_8) 		5 TYR A 118
GLY A  26
ASP A 115
LEU A 121
TRP A  32
 None
 1.00A 3ou7A-4qrlA:
undetectable		 3ou7A-4qrlA:
17.29
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.
4qtu PUTATIVE
METHYLTRANSFERASE
BUD23

(Saccharomyces
cerevisiae) 		PF08241
(Methyltransf_11) 		5 TYR B  22
GLY B  57
SER B  79
MET B  82
ASP B  99
 SAM  B 301 (-4.6A)
SAM  B 301 (-3.3A)
EDO  B 310 ( 3.0A)
SAM  B 301 (-4.4A)
SAM  B 301 (-3.7A)
 0.55A 3ou7A-4qtuB:
15.6		 3ou7A-4qtuB:
25.55
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.
4xcg THERMOSOME SUBUNIT
BETA

(Sulfolobus
solfataricus) 		PF00118
(Cpn60_TCP1) 		5 LEU B 330
ALA B 249
GLY B 354
ASP B 252
LEU B 251
 None
 1.26A 3ou7A-4xcgB:
undetectable		 3ou7A-4xcgB:
17.18
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.
4zpi PUTATIVE
OXIDASE/HYDROXYLASE

(Streptomyces
hygroscopicus) 		PF05721
(PhyH) 		5 LEU A  36
ALA A 221
GLY A  88
GLY A  90
LEU A 219
 None
 1.20A 3ou7A-4zpiA:
undetectable		 3ou7A-4zpiA:
24.72
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.
5bsz N-METHYLTRANSFERASE

(Streptoalloteichus
sp. ATCC 53650) 		PF13649
(Methyltransf_25) 		5 ALA A  53
GLY A  55
SER A  76
MET A  79
ASP A  96
 SAH  A 301 (-3.3A)
SAH  A 301 ( 3.7A)
SAH  A 301 (-4.6A)
SAH  A 301 ( 4.4A)
SAH  A 301 (-3.7A)
 0.75A 3ou7A-5bszA:
15.8		 3ou7A-5bszA:
26.56
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.
5ex6 CYTOCHROME P450

(Streptomyces
toyocaensis) 		no annotation 5 LEU C 152
ALA C 353
GLY C 349
GLY C 237
ASP C 238
 HEM  C 502 (-4.9A)
HEM  C 502 ( 3.8A)
HEM  C 502 ( 3.7A)
HEM  C 502 (-3.5A)
None
 1.22A 3ou7A-5ex6C:
undetectable		 3ou7A-5ex6C:
22.92
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.
5h02 GLYCINE SARCOSINE
N-METHYLTRANSFERASE

(Methanohalophilus
portucalensis) 		PF13649
(Methyltransf_25) 		6 ALA A  67
GLY A  69
GLY A  89
SER A  90
MET A  93
ASP A 114
 SAH  A 301 (-3.9A)
SAH  A 301 (-3.3A)
SAH  A 301 (-3.4A)
SAH  A 301 ( 4.9A)
SAH  A 301 (-3.9A)
SAH  A 301 (-3.7A)
 0.43A 3ou7A-5h02A:
17.2		 3ou7A-5h02A:
24.57
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.
5h42 UNCHARACTERIZED
PROTEIN

(Lachnoclostridium
phytofermentans) 		PF17167
(Glyco_hydro_36) 		5 LEU A 225
TYR A 157
GLY A 153
GLY A 177
SER A 178
 None
 1.04A 3ou7A-5h42A:
undetectable		 3ou7A-5h42A:
9.71
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.
5ik8 LAMININ SUBUNIT
ALPHA-2

(Mus musculus) 		PF00054
(Laminin_G_1)
PF02210
(Laminin_G_2) 		5 TYR A2820
GLY A2817
GLY A2796
SER A2795
LEU A2798
 None
 1.22A 3ou7A-5ik8A:
undetectable		 3ou7A-5ik8A:
21.00
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.
5je3 METHYL TRANSFERASE

(Burkholderia
glumae) 		PF13847
(Methyltransf_31) 		5 ALA A  47
GLY A  49
SER A  71
MET A  74
ASP A  95
 SAH  A 301 (-3.2A)
SAH  A 301 (-3.6A)
SAH  A 301 ( 4.8A)
SAH  A 301 ( 4.5A)
SAH  A 301 (-3.7A)
 0.49A 3ou7A-5je3A:
16.3		 3ou7A-5je3A:
23.94
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.
5leb DDD_D12_06_D12_06_D1
2

(synthetic
construct) 		PF12796
(Ank_2)
PF13857
(Ank_5) 		5 ALA A  54
GLY A  58
TRP A  56
GLY A  61
LEU A  66
 None
 1.27A 3ou7A-5lebA:
undetectable		 3ou7A-5lebA:
20.04
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.
5leb DDD_D12_06_D12_06_D1
2

(synthetic
construct) 		PF12796
(Ank_2)
PF13857
(Ank_5) 		5 ALA A 206
GLY A 210
TRP A 208
GLY A 213
LEU A 218
 None
 1.25A 3ou7A-5lebA:
undetectable		 3ou7A-5lebA:
20.04
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.
5n2p TRYPTOPHAN SYNTHASE
ALPHA CHAIN

(Sulfolobus
solfataricus) 		no annotation 5 LEU A 238
TYR A 241
ALA A 201
GLY A 205
GLY A 208
 None
 0.98A 3ou7A-5n2pA:
undetectable		 3ou7A-5n2pA:
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.
5onu OUTER MEMBRANE
PROTEIN OMPU

(Vibrio cholerae) 		no annotation 5 LEU A 138
ALA A 219
GLY A 231
GLY A 233
LEU A 217
 None
 1.10A 3ou7A-5onuA:
undetectable		 3ou7A-5onuA:
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.
5u7x NOD FACTOR BINDING
LECTIN-NUCLEOTIDE
PHOSPHOHYDROLASE

(Vigna
unguiculata) 		PF01150
(GDA1_CD39) 		5 LEU F  94
ALA F  87
GLY F  14
SER F  49
LEU F 103
 None
None
PO4  F 502 (-3.4A)
None
None
 1.01A 3ou7A-5u7xF:
undetectable		 3ou7A-5u7xF:
19.18
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.
5uao TRYPTOPHANE-5-HALOGE
NASE

(Microbispora
sp. ATCC
PTA-5024) 		PF04820
(Trp_halogenase) 		5 LEU A 103
ALA A 499
GLY A 502
ASP A 121
LEU A 144
 None
 1.12A 3ou7A-5uaoA:
2.4		 3ou7A-5uaoA:
18.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uzh NAFOA.00085.B

(Naegleria
fowleri) 		PF16363
(GDP_Man_Dehyd) 		5 LEU A  37
TYR A 115
ALA A  50
GLY A  46
GLY A  62
 None
 1.12A 3ou7A-5uzhA:
undetectable		 3ou7A-5uzhA:
22.92
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.
5voc ENVELOPE
GLYCOPROTEIN H

(Human
betaherpesvirus
5) 		PF02489
(Herpes_glycop_H)
PF17488
(Herpes_glycoH_C) 		5 ALA A 351
GLY A 185
SER A 184
ASP A 146
LEU A 309
 None
 1.24A 3ou7A-5vocA:
undetectable		 3ou7A-5vocA:
14.84
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.
5wez TIR CHAPERONE

(Escherichia
coli) 		no annotation 5 LEU A  84
TYR A  83
ALA A  77
GLY A  80
LEU A  74
 None
 1.26A 3ou7A-5wezA:
undetectable		 3ou7A-5wezA:
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.
5xmj FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT

(Desulfovibrio
gigas) 		no annotation 5 LEU A 579
ALA A 536
GLY A 538
MET A 251
ASP A 541
 None
 1.06A 3ou7A-5xmjA:
undetectable		 3ou7A-5xmjA:
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.
5xru ADENYLATE KINASE

(Notothenia
coriiceps) 		no annotation 5 TYR A 153
TYR A 154
ALA A 120
GLY A 122
GLY A  18
 None
None
None
None
AP5  A 201 (-3.5A)
 1.23A 3ou7A-5xruA:
undetectable		 3ou7A-5xruA:
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.
6bq1 PHOSPHATIDYLINOSITOL
4-KINASE III ALPHA
(PI4KA)

(Homo sapiens) 		no annotation 5 LEU A1177
ALA A1230
GLY A1226
GLY A1217
MET A1221
 None
 1.15A 3ou7A-6bq1A:
undetectable		 3ou7A-6bq1A:
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.
6cfz DAD2
HSK3

(Chaetomium
thermophilum;
Chaetomium
thermophilum) 		no annotation
no annotation 		5 LEU G  62
GLY G  68
GLY G  63
SER G  64
TRP C  80
 None
 1.22A 3ou7A-6cfzG:
undetectable		 3ou7A-6cfzG:
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.
6ehc OUTER MEMBRANE
PROTEIN U

(Vibrio cholerae) 		no annotation 5 LEU A 108
ALA A 189
GLY A 201
GLY A 203
LEU A 187
 None
 1.12A 3ou7A-6ehcA:
undetectable		 3ou7A-6ehcA:
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.
6ezy -

(-) 		no annotation 5 TYR A  77
GLY A  24
GLY A  81
ASP A  83
LEU A  84
 TYR  A  77 ( 1.3A)
GLY  A  24 ( 0.0A)
GLY  A  81 ( 0.0A)
ASP  A  83 ( 0.6A)
LEU  A  84 ( 0.5A)
 1.13A 3ou7A-6ezyA:
undetectable		 3ou7A-6ezyA:
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.
6f5z 24-STEROL
C-METHYLTRANSFERASE

(Haloferax
volcanii) 		no annotation 5 GLY A  48
GLY A  70
SER A  71
MET A  74
ASP A  93
 SAH  A 301 ( 3.7A)
SAH  A 301 (-3.6A)
None
SAH  A 301 (-4.0A)
SAH  A 301 (-3.8A)
 0.58A 3ou7A-6f5zA:
17.7		 3ou7A-6f5zA:
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.
6f5z 24-STEROL
C-METHYLTRANSFERASE

(Haloferax
volcanii) 		no annotation 5 GLY A  48
TRP A 108
GLY A  70
SER A  71
MET A  74
 SAH  A 301 ( 3.7A)
None
SAH  A 301 (-3.6A)
None
SAH  A 301 (-4.0A)
 1.17A 3ou7A-6f5zA:
17.7		 3ou7A-6f5zA:
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.
6fb3 TENEURIN-2

(Gallus gallus) 		no annotation 5 ALA A1566
GLY A1543
GLY A1561
SER A1560
ASP A1563
 None
 1.20A 3ou7A-6fb3A:
undetectable		 3ou7A-6fb3A:
undetectable