SIMILAR PATTERNS OF AMINO ACIDS FOR 5X80_B_SALB203

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.
1bdg HEXOKINASE

(Schistosoma
mansoni) 		PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2) 		4 GLY A 387
TYR A 384
LEU A 443
VAL A 230
 None
 0.90A 5x80A-1bdgA:
0.0
5x80B-1bdgA:
0.0		 5x80A-1bdgA:
17.08
5x80B-1bdgA:
17.08
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.
1cte CATHEPSIN B

(Rattus
norvegicus) 		PF00112
(Peptidase_C1) 		4 PRO A  76
GLY A  78
TYR A  75
VAL A 247
 None
 0.96A 5x80A-1cteA:
0.0
5x80B-1cteA:
0.0		 5x80A-1cteA:
18.70
5x80B-1cteA:
18.70
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.
1dl5 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Thermotoga
maritima) 		PF01135
(PCMT) 		4 GLY A 135
TYR A 136
LEU A  80
VAL A 150
 SAH  A 699 (-3.5A)
None
None
None
 0.71A 5x80A-1dl5A:
0.0
5x80B-1dl5A:
0.0		 5x80A-1dl5A:
17.67
5x80B-1dl5A:
17.67
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.
1ek6 UDP-GALACTOSE
4-EPIMERASE

(Homo sapiens) 		PF16363
(GDP_Man_Dehyd) 		4 PRO A 139
GLY A 137
TYR A 136
VAL A 304
 None
 0.90A 5x80A-1ek6A:
0.0
5x80B-1ek6A:
0.0		 5x80A-1ek6A:
19.53
5x80B-1ek6A:
19.53
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.
1gvh FLAVOHEMOPROTEIN

(Escherichia
coli) 		PF00042
(Globin)
PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		4 GLY A 121
TYR A 124
LEU A   2
VAL A  10
 None
HEM  A1398 ( 4.9A)
None
None
 0.63A 5x80A-1gvhA:
1.0
5x80B-1gvhA:
0.8		 5x80A-1gvhA:
20.06
5x80B-1gvhA:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1h4u NIDOGEN-1

(Mus musculus) 		PF07474
(G2F) 		5 PRO A 530
GLY A 532
TYR A 531
LEU A 455
VAL A 561
 None
 1.44A 5x80A-1h4uA:
0.0
5x80B-1h4uA:
0.0		 5x80A-1h4uA:
21.24
5x80B-1h4uA:
21.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jzo THIOL:DISULFIDE
INTERCHANGE PROTEIN
DSBC

(Escherichia
coli) 		PF10411
(DsbC_N)
PF13098
(Thioredoxin_2) 		4 PRO A 183
GLY A 195
TYR A 100
VAL A  92
 None
 0.98A 5x80A-1jzoA:
undetectable
5x80B-1jzoA:
undetectable		 5x80A-1jzoA:
23.87
5x80B-1jzoA:
23.87
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.
1lvw GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E

(Methanothermobacter
thermautotrophicus) 		PF00483
(NTP_transferase) 		4 PRO A  37
TYR A  36
LEU A  65
VAL A   5
 None
 0.87A 5x80A-1lvwA:
0.0
5x80B-1lvwA:
0.0		 5x80A-1lvwA:
21.89
5x80B-1lvwA:
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.
1poj ISOASPARTYL
DIPEPTIDASE

(Escherichia
coli) 		PF01979
(Amidohydro_1) 		5 PRO A 276
GLY A 274
LEU A 242
ARG A 279
VAL A 280
 None
 1.35A 5x80A-1pojA:
0.0
5x80B-1pojA:
0.0		 5x80A-1pojA:
20.26
5x80B-1pojA:
20.26
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.
1qh5 PROTEIN
(HYDROXYACYLGLUTATHI
ONE HYDROLASE)

(Homo sapiens) 		PF00753
(Lactamase_B)
PF16123
(HAGH_C) 		4 PRO A  30
GLY A  62
LEU A  69
VAL A  36
 None
 0.99A 5x80A-1qh5A:
0.0
5x80B-1qh5A:
0.0		 5x80A-1qh5A:
20.15
5x80B-1qh5A:
20.15
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.
1sh8 HYPOTHETICAL PROTEIN
PA5026

(Pseudomonas
aeruginosa) 		PF14539
(DUF4442) 		4 PRO A  62
GLY A  63
LEU A 101
VAL A  34
 None
 0.95A 5x80A-1sh8A:
undetectable
5x80B-1sh8A:
undetectable		 5x80A-1sh8A:
28.49
5x80B-1sh8A:
28.49
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.
1t3b THIOL:DISULFIDE
INTERCHANGE PROTEIN
DSBC

(Haemophilus
influenzae) 		PF10411
(DsbC_N)
PF13098
(Thioredoxin_2) 		5 PRO A 183
GLY A 195
TYR A 100
LEU A 202
VAL A  92
 None
 1.25A 5x80A-1t3bA:
undetectable
5x80B-1t3bA:
undetectable		 5x80A-1t3bA:
18.35
5x80B-1t3bA:
18.35
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.
1tr1 BETA-GLUCOSIDASE A

(Paenibacillus
polymyxa) 		PF00232
(Glyco_hydro_1) 		4 PRO A 221
GLY A 292
LEU A 337
VAL A 223
 None
 0.86A 5x80A-1tr1A:
undetectable
5x80B-1tr1A:
undetectable		 5x80A-1tr1A:
14.58
5x80B-1tr1A:
14.58
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.
1uio ADENOSINE DEAMINASE

(Mus musculus) 		PF00962
(A_deaminase) 		4 GLY A 136
TYR A  84
LEU A  18
VAL A 148
 None
 0.97A 5x80A-1uioA:
undetectable
5x80B-1uioA:
undetectable		 5x80A-1uioA:
17.87
5x80B-1uioA:
17.87
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.
1wry SH3 DOMAIN-BINDING
GLUTAMIC
ACID-RICH-LIKE
PROTEIN

(Homo sapiens) 		PF04908
(SH3BGR) 		4 PRO A  74
TYR A  86
LEU A 102
VAL A  12
 None
 0.96A 5x80A-1wryA:
undetectable
5x80B-1wryA:
undetectable		 5x80A-1wryA:
25.15
5x80B-1wryA:
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.
1wvv CHITINASE C

(Streptomyces
griseus) 		PF00182
(Glyco_hydro_19) 		4 GLY A 224
TYR A 227
LEU A 202
VAL A 213
 None
GOL  A 401 ( 4.5A)
None
None
 0.79A 5x80A-1wvvA:
1.6
5x80B-1wvvA:
1.9		 5x80A-1wvvA:
20.59
5x80B-1wvvA:
20.59
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.
1xc6 BETA-GALACTOSIDASE

(Penicillium sp.) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 PRO A 262
GLY A 264
TYR A 261
LEU A 319
 IOD  A9026 ( 4.4A)
IOD  A9050 ( 3.8A)
GAL  A9011 (-4.1A)
None
 0.99A 5x80A-1xc6A:
undetectable
5x80B-1xc6A:
undetectable		 5x80A-1xc6A:
9.78
5x80B-1xc6A:
9.78
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.
2ag1 BENZALDEHYDE LYASE

(Pseudomonas
fluorescens) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 PRO A 162
GLY A 100
LEU A 158
ARG A 131
 None
 0.95A 5x80A-2ag1A:
undetectable
5x80B-2ag1A:
undetectable		 5x80A-2ag1A:
16.28
5x80B-2ag1A:
16.28
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.
2az4 HYPOTHETICAL PROTEIN
EF2904

(Enterococcus
faecalis) 		PF12706
(Lactamase_B_2) 		4 GLY A 260
TYR A 261
LEU A 281
VAL A 333
 None
 0.93A 5x80A-2az4A:
undetectable
5x80B-2az4A:
undetectable		 5x80A-2az4A:
18.42
5x80B-2az4A:
18.42
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.
2b4w HYPOTHETICAL
PROTEIN, CONSERVED

(Leishmania
major) 		PF08950
(DUF1861) 		4 GLY A 207
TYR A 227
LEU A 279
VAL A 264
 None
 0.84A 5x80A-2b4wA:
undetectable
5x80B-2b4wA:
undetectable		 5x80A-2b4wA:
18.81
5x80B-2b4wA:
18.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cjl SECRETED CHITINASE

(Streptomyces
coelicolor) 		PF00182
(Glyco_hydro_19) 		4 GLY A 145
TYR A 148
LEU A 123
VAL A 134
 None
 0.77A 5x80A-2cjlA:
undetectable
5x80B-2cjlA:
undetectable		 5x80A-2cjlA:
21.89
5x80B-2cjlA:
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.
2ejb PROBABLE AROMATIC
ACID DECARBOXYLASE

(Aquifex
aeolicus) 		PF02441
(Flavoprotein) 		4 PRO A  89
GLY A  17
TYR A  16
LEU A  43
 None
 0.91A 5x80A-2ejbA:
undetectable
5x80B-2ejbA:
undetectable		 5x80A-2ejbA:
22.50
5x80B-2ejbA:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2epj GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE

(Aeropyrum
pernix) 		PF00202
(Aminotran_3) 		4 GLY A 201
TYR A 200
LEU A 232
VAL A 207
 None
 0.98A 5x80A-2epjA:
0.7
5x80B-2epjA:
undetectable		 5x80A-2epjA:
18.99
5x80B-2epjA:
18.99
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.
2f02 TAGATOSE-6-PHOSPHATE
KINASE

(Enterococcus
faecalis) 		PF00294
(PfkB) 		4 GLY A 260
TYR A 263
LEU A 161
VAL A  42
 None
 0.93A 5x80A-2f02A:
undetectable
5x80B-2f02A:
undetectable		 5x80A-2f02A:
21.43
5x80B-2f02A:
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.
2f9g MITOGEN-ACTIVATED
PROTEIN KINASE FUS3

(Saccharomyces
cerevisiae) 		PF00069
(Pkinase) 		4 PRO A 267
GLY A 240
TYR A 266
LEU A 271
 None
 0.89A 5x80A-2f9gA:
undetectable
5x80B-2f9gA:
undetectable		 5x80A-2f9gA:
18.80
5x80B-2f9gA:
18.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pt6 SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		4 PRO A 265
GLY A 267
TYR A 264
LEU A 233
 None
 0.96A 5x80A-2pt6A:
undetectable
5x80B-2pt6A:
undetectable		 5x80A-2pt6A:
19.17
5x80B-2pt6A:
19.17
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.
2q5o PHENYLPYRUVATE
DECARBOXYLASE

(Azospirillum
brasilense) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 GLY A 217
TYR A 216
LEU A 242
VAL A 222
 None
None
PPY  A5003 ( 4.7A)
None
 0.87A 5x80A-2q5oA:
undetectable
5x80B-2q5oA:
undetectable		 5x80A-2q5oA:
18.46
5x80B-2q5oA:
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.
2vgi PYRUVATE KINASE
ISOZYMES R/L

(Homo sapiens) 		PF00224
(PK)
PF02887
(PK_C) 		4 PRO A 145
GLY A 143
TYR A 148
ARG A 518
 None
 0.91A 5x80A-2vgiA:
undetectable
5x80B-2vgiA:
undetectable		 5x80A-2vgiA:
16.63
5x80B-2vgiA:
16.63
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.
2x66 PRNB

(Pseudomonas
fluorescens) 		PF08933
(DUF1864) 		4 PRO A 222
GLY A 223
LEU A 140
VAL A 117
 None
CYN  A1358 (-3.8A)
None
None
 0.83A 5x80A-2x66A:
0.8
5x80B-2x66A:
0.4		 5x80A-2x66A:
20.27
5x80B-2x66A:
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.
2zs6 HEMAGGLUTININ
COMPONENTS HA3

(Clostridium
botulinum) 		PF03505
(Clenterotox) 		4 GLY A 146
TYR A 147
LEU A  43
VAL A  56
 None
 0.92A 5x80A-2zs6A:
undetectable
5x80B-2zs6A:
undetectable		 5x80A-2zs6A:
18.69
5x80B-2zs6A:
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.
3abg BILIRUBIN OXIDASE

(Albifimbria
verrucaria) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 PRO A 210
GLY A 208
LEU A  59
VAL A  50
 None
 0.83A 5x80A-3abgA:
undetectable
5x80B-3abgA:
undetectable		 5x80A-3abgA:
15.43
5x80B-3abgA:
15.43
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.
3bwm CATECHOL
O-METHYLTRANSFERASE

(Homo sapiens) 		PF01596
(Methyltransf_3) 		4 GLY A  70
TYR A  71
LEU A  86
VAL A 108
 None
 0.88A 5x80A-3bwmA:
undetectable
5x80B-3bwmA:
undetectable		 5x80A-3bwmA:
23.85
5x80B-3bwmA:
23.85
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.
3c0b CONSERVED ARCHAEAL
PROTEIN Q6M145

(Methanococcus
maripaludis) 		PF01968
(Hydantoinase_A) 		4 GLY A 306
TYR A 305
LEU A 311
VAL A  25
 None
 0.96A 5x80A-3c0bA:
2.2
5x80B-3c0bA:
2.1		 5x80A-3c0bA:
20.27
5x80B-3c0bA:
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.
3c49 POLY(ADP-RIBOSE)
POLYMERASE 3

(Homo sapiens) 		PF00644
(PARP)
PF02877
(PARP_reg) 		4 GLY A 385
TYR A 425
LEU A 399
VAL A 390
 KU8  A 601 (-3.5A)
KU8  A 601 (-3.5A)
KU8  A 601 ( 4.5A)
None
 0.86A 5x80A-3c49A:
undetectable
5x80B-3c49A:
undetectable		 5x80A-3c49A:
20.06
5x80B-3c49A:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ca8 PROTEIN YDCF

(Escherichia
coli) 		PF02698
(DUF218) 		4 PRO A 153
GLY A 181
LEU A 199
VAL A  47
 None
MPD  A 901 (-3.5A)
MPD  A 901 ( 4.8A)
MPD  A 902 ( 4.3A)
 0.89A 5x80A-3ca8A:
undetectable
5x80B-3ca8A:
undetectable		 5x80A-3ca8A:
19.17
5x80B-3ca8A:
19.17
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.
3czm L-LACTATE
DEHYDROGENASE

(Toxoplasma
gondii) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 GLY A  37
TYR A  38
LEU A  45
VAL A  76
 None
 0.98A 5x80A-3czmA:
undetectable
5x80B-3czmA:
undetectable		 5x80A-3czmA:
21.43
5x80B-3czmA:
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.
3d6s ALLERGEN DER F I

(Dermatophagoides
farinae) 		PF00112
(Peptidase_C1) 		4 GLY A 177
LEU A  20
ARG A  18
VAL A  23
 None
 0.91A 5x80A-3d6sA:
undetectable
5x80B-3d6sA:
undetectable		 5x80A-3d6sA:
19.31
5x80B-3d6sA:
19.31
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.
3e7o MITOGEN-ACTIVATED
PROTEIN KINASE 9

(Homo sapiens) 		PF00069
(Pkinase) 		4 PRO A 267
GLY A 242
TYR A 266
LEU A 274
 None
 0.78A 5x80A-3e7oA:
undetectable
5x80B-3e7oA:
undetectable		 5x80A-3e7oA:
20.17
5x80B-3e7oA:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3edn PHENAZINE
BIOSYNTHESIS
PROTEIN, PHZF FAMILY

(Bacillus
anthracis) 		PF02567
(PhzC-PhzF) 		4 PRO A 199
GLY A 213
LEU A 172
VAL A 169
 None
 0.85A 5x80A-3ednA:
undetectable
5x80B-3ednA:
undetectable		 5x80A-3ednA:
20.98
5x80B-3ednA:
20.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3enk UDP-GLUCOSE
4-EPIMERASE

(Burkholderia
pseudomallei) 		PF16363
(GDP_Man_Dehyd) 		4 PRO A 135
GLY A 133
TYR A 132
VAL A 299
 None
 0.89A 5x80A-3enkA:
undetectable
5x80B-3enkA:
undetectable		 5x80A-3enkA:
20.17
5x80B-3enkA:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ezq PROTEIN FADD
TUMOR NECROSIS
FACTOR RECEPTOR
SUPERFAMILY MEMBER 6

(Homo sapiens) 		PF00531
(Death) 		4 GLY B  93
LEU A 336
ARG B 184
VAL B 158
 None
 0.96A 5x80A-3ezqB:
undetectable
5x80B-3ezqB:
undetectable		 5x80A-3ezqB:
20.13
5x80B-3ezqB:
20.13
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.
3fjo NADPH-CYTOCHROME
P450 REDUCTASE

(Homo sapiens;
Saccharomyces
cerevisiae) 		PF00175
(NAD_binding_1)
PF00258
(Flavodoxin_1)
PF00667
(FAD_binding_1) 		4 PRO A 513
GLY A 545
LEU A 588
VAL A 511
 None
 0.91A 5x80A-3fjoA:
undetectable
5x80B-3fjoA:
2.1		 5x80A-3fjoA:
16.40
5x80B-3fjoA:
16.40
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.
3fmf DETHIOBIOTIN
SYNTHETASE

(Mycobacterium
tuberculosis) 		PF13500
(AAA_26) 		4 PRO A  38
GLY A  64
LEU A  98
VAL A 107
 None
 0.91A 5x80A-3fmfA:
undetectable
5x80B-3fmfA:
undetectable		 5x80A-3fmfA:
24.51
5x80B-3fmfA:
24.51
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.
3hdt PUTATIVE KINASE

([Clostridium]
symbiosum) 		PF13189
(Cytidylate_kin2) 		4 GLY A  21
LEU A 202
ARG A  18
VAL A 140
 PO4  A 301 (-3.5A)
None
PO4  A 301 ( 3.9A)
None
 0.96A 5x80A-3hdtA:
undetectable
5x80B-3hdtA:
undetectable		 5x80A-3hdtA:
21.46
5x80B-3hdtA:
21.46
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.
3hfs ANTHOCYANIDIN
REDUCTASE

(Vitis vinifera) 		PF01370
(Epimerase) 		4 PRO A 208
GLY A 212
LEU A 197
VAL A  91
 None
None
None
CL  A 339 ( 4.5A)
 0.98A 5x80A-3hfsA:
undetectable
5x80B-3hfsA:
undetectable		 5x80A-3hfsA:
20.92
5x80B-3hfsA:
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.
3iwp COPPER HOMEOSTASIS
PROTEIN CUTC HOMOLOG

(Homo sapiens) 		PF03932
(CutC) 		4 GLY A 110
TYR A 109
LEU A 140
VAL A  80
 None
 0.94A 5x80A-3iwpA:
undetectable
5x80B-3iwpA:
undetectable		 5x80A-3iwpA:
23.53
5x80B-3iwpA:
23.53
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.
3ix0 BETA-MICROSEMINOPROT
EIN

(Homo sapiens) 		PF05825
(PSP94) 		4 PRO A  56
GLY A  58
ARG A  66
VAL A  77
 None
 0.84A 5x80A-3ix0A:
undetectable
5x80B-3ix0A:
undetectable		 5x80A-3ix0A:
15.24
5x80B-3ix0A:
15.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k5w CARBOHYDRATE KINASE

(Helicobacter
pylori) 		PF01256
(Carb_kinase)
PF03853
(YjeF_N) 		4 GLY A  61
LEU A  68
ARG A  66
VAL A  99
 None
 0.99A 5x80A-3k5wA:
undetectable
5x80B-3k5wA:
undetectable		 5x80A-3k5wA:
16.14
5x80B-3k5wA:
16.14
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.
3k8r UNCHARACTERIZED
PROTEIN

(Rhodospirillum
rubrum) 		PF10387
(DUF2442) 		4 GLY A  77
TYR A  76
LEU A  92
VAL A  40
 None
 0.92A 5x80A-3k8rA:
undetectable
5x80B-3k8rA:
undetectable		 5x80A-3k8rA:
27.13
5x80B-3k8rA:
27.13
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.
3om9 LACTATE
DEHYDROGENASE

(Toxoplasma
gondii) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 GLY A  37
TYR A  38
LEU A  45
VAL A  76
 None
 0.98A 5x80A-3om9A:
undetectable
5x80B-3om9A:
undetectable		 5x80A-3om9A:
20.86
5x80B-3om9A:
20.86
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.
3qfs NADPH--CYTOCHROME
P450 REDUCTASE

(Homo sapiens) 		PF00175
(NAD_binding_1)
PF00667
(FAD_binding_1) 		4 PRO A 536
GLY A 568
LEU A 611
VAL A 534
 NAP  A 753 ( 4.6A)
NAP  A 753 ( 4.7A)
None
None
 0.94A 5x80A-3qfsA:
undetectable
5x80B-3qfsA:
undetectable		 5x80A-3qfsA:
19.56
5x80B-3qfsA:
19.56
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.
3tfw PUTATIVE
O-METHYLTRANSFERASE

(Klebsiella
pneumoniae) 		PF01596
(Methyltransf_3) 		4 GLY A  73
TYR A  74
LEU A  89
VAL A 111
 None
 0.80A 5x80A-3tfwA:
undetectable
5x80B-3tfwA:
undetectable		 5x80A-3tfwA:
23.60
5x80B-3tfwA:
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.
3u4a JMB19063

(compost
metagenome) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		4 PRO A 612
GLY A 614
TYR A 615
ARG A 726
 None
 0.83A 5x80A-3u4aA:
undetectable
5x80B-3u4aA:
undetectable		 5x80A-3u4aA:
12.96
5x80B-3u4aA:
12.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3va7 KLLA0E08119P

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 PRO A1121
GLY A1188
ARG A1198
VAL A1082
 None
 0.97A 5x80A-3va7A:
undetectable
5x80B-3va7A:
undetectable		 5x80A-3va7A:
10.30
5x80B-3va7A:
10.30
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.
3vrb FLAVOPROTEIN SUBUNIT
OF COMPLEX II

(Ascaris suum) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		4 PRO A 277
LEU A 317
ARG A 320
VAL A 323
 None
None
FUM  A 701 (-3.2A)
None
 0.98A 5x80A-3vrbA:
undetectable
5x80B-3vrbA:
undetectable		 5x80A-3vrbA:
13.58
5x80B-3vrbA:
13.58
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.
3win HA3

(Clostridium
botulinum) 		PF03505
(Clenterotox) 		4 GLY D 150
TYR D 151
LEU D  47
VAL D  60
 None
 0.94A 5x80A-3winD:
undetectable
5x80B-3winD:
undetectable		 5x80A-3winD:
20.00
5x80B-3winD:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wvn NON-RIBOSOMAL
PEPTIDE SYNTHETASE

(Streptomyces
halstedii) 		PF00501
(AMP-binding) 		4 GLY A 232
TYR A 234
LEU A 246
VAL A  93
 None
 0.99A 5x80A-3wvnA:
undetectable
5x80B-3wvnA:
undetectable		 5x80A-3wvnA:
16.48
5x80B-3wvnA:
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.
3zhw NON-SYMBIOTIC
HEMOGLOBIN 1

(Arabidopsis
thaliana) 		PF00042
(Globin) 		4 GLY A 142
TYR A 145
LEU A  84
VAL A  17
 SO4  A1904 (-3.3A)
HEM  A1163 ( 4.5A)
None
None
 0.87A 5x80A-3zhwA:
undetectable
5x80B-3zhwA:
undetectable		 5x80A-3zhwA:
23.43
5x80B-3zhwA:
23.43
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.
4a8j ELONGATOR COMPLEX
PROTEIN 4

(Saccharomyces
cerevisiae) 		PF05625
(PAXNEB) 		4 PRO A 289
GLY A 123
LEU A 164
VAL A 153
 None
 0.96A 5x80A-4a8jA:
undetectable
5x80B-4a8jA:
undetectable		 5x80A-4a8jA:
20.49
5x80B-4a8jA:
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.
4aby DNA REPAIR PROTEIN
RECN

(Deinococcus
radiodurans) 		PF02463
(SMC_N) 		4 GLY A  75
LEU A  86
ARG A 113
VAL A  96
 None
 0.83A 5x80A-4abyA:
1.5
5x80B-4abyA:
undetectable		 5x80A-4abyA:
19.32
5x80B-4abyA:
19.32
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.
4ad8 DNA REPAIR PROTEIN
RECN

(Deinococcus
radiodurans) 		PF02463
(SMC_N) 		4 GLY A  75
LEU A  86
ARG A 113
VAL A  96
 None
 0.96A 5x80A-4ad8A:
undetectable
5x80B-4ad8A:
1.4		 5x80A-4ad8A:
16.99
5x80B-4ad8A:
16.99
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.
4av6 K(+)-STIMULATED
PYROPHOSPHATE-ENERGI
ZED SODIUM PUMP

(Thermotoga
maritima) 		PF03030
(H_PPase) 		4 PRO A 614
GLY A 612
TYR A 613
VAL A 192
 None
 0.89A 5x80A-4av6A:
1.1
5x80B-4av6A:
1.2		 5x80A-4av6A:
14.20
5x80B-4av6A:
14.20
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.
4c1q HISTONE-LYSINE
N-METHYLTRANSFERASE
PRDM9

(Mus musculus) 		PF00856
(SET) 		4 PRO A 243
GLY A 245
LEU A 267
VAL A 225
 None
 0.80A 5x80A-4c1qA:
undetectable
5x80B-4c1qA:
undetectable		 5x80A-4c1qA:
18.03
5x80B-4c1qA:
18.03
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.
4c2f CARBOXY-TERMINAL
PROCESSING PROTEASE
CTPB

(Bacillus
subtilis) 		PF01471
(PG_binding_1)
PF03572
(Peptidase_S41)
PF13180
(PDZ_2) 		4 GLY A 215
TYR A 216
LEU A 477
VAL A 209
 None
 0.97A 5x80A-4c2fA:
undetectable
5x80B-4c2fA:
undetectable		 5x80A-4c2fA:
16.78
5x80B-4c2fA:
16.78
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.
4cq6 ALLENE OXIDE CYCLASE
2, CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF06351
(Allene_ox_cyc) 		4 GLY A  65
TYR A  92
LEU A 157
VAL A  21
 None
 0.94A 5x80A-4cq6A:
undetectable
5x80B-4cq6A:
undetectable		 5x80A-4cq6A:
25.13
5x80B-4cq6A:
25.13
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.
4cze ROD
SHAPE-DETERMINING
PROTEIN MREB

(Caulobacter
vibrioides) 		PF06723
(MreB_Mbl) 		4 PRO A 320
GLY A 294
LEU A 302
VAL A 316
 None
 0.90A 5x80A-4czeA:
1.6
5x80B-4czeA:
1.7		 5x80A-4czeA:
18.26
5x80B-4czeA:
18.26
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.
4d5g CYCLOHEXANE-1,2-DION
E HYDROLASE

(Azoarcus sp.
BH72) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 GLY A  18
TYR A  17
LEU A  42
VAL A  72
 None
 0.98A 5x80A-4d5gA:
undetectable
5x80B-4d5gA:
undetectable		 5x80A-4d5gA:
15.08
5x80B-4d5gA:
15.08
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.
4e8d GLYCOSYL HYDROLASE,
FAMILY 35

(Streptococcus
pneumoniae) 		PF01301
(Glyco_hydro_35) 		4 PRO A 334
GLY A  45
TYR A 333
LEU A  85
 None
 0.95A 5x80A-4e8dA:
undetectable
5x80B-4e8dA:
undetectable		 5x80A-4e8dA:
14.45
5x80B-4e8dA:
14.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4frx ANAEROBICALLY-INDUCE
D OUTER MEMBRANE
PORIN OPRE

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		4 GLY A 155
TYR A 190
LEU A 118
VAL A 125
 None
 0.89A 5x80A-4frxA:
undetectable
5x80B-4frxA:
undetectable		 5x80A-4frxA:
17.22
5x80B-4frxA:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fvl COLLAGENASE 3

(Homo sapiens) 		PF00045
(Hemopexin)
PF00413
(Peptidase_M10) 		4 PRO A 376
GLY A 374
LEU A 396
VAL A 379
 PGO  A 522 ( 4.6A)
None
None
None
 0.95A 5x80A-4fvlA:
undetectable
5x80B-4fvlA:
undetectable		 5x80A-4fvlA:
19.02
5x80B-4fvlA:
19.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h3w HYPOTHETICAL PROTEIN

(Parabacteroides
distasonis) 		PF15414
(DUF4621) 		4 GLY A  47
TYR A  48
LEU A 321
VAL A 261
 None
MLY  A 337 ( 4.5A)
None
None
 0.92A 5x80A-4h3wA:
undetectable
5x80B-4h3wA:
undetectable		 5x80A-4h3wA:
21.07
5x80B-4h3wA:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ijd HISTONE-LYSINE
N-METHYLTRANSFERASE
PRDM9

(Homo sapiens) 		PF00856
(SET) 		4 PRO A 243
GLY A 245
LEU A 267
VAL A 225
 None
UNX  A 507 ( 4.0A)
None
None
 0.83A 5x80A-4ijdA:
undetectable
5x80B-4ijdA:
undetectable		 5x80A-4ijdA:
19.81
5x80B-4ijdA:
19.81
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.
4iug BETA-GALACTOSIDASE A

(Aspergillus
oryzae) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 PRO A 261
GLY A 263
TYR A 260
LEU A 318
 None
None
GAL  A1130 (-4.5A)
None
 0.95A 5x80A-4iugA:
undetectable
5x80B-4iugA:
undetectable		 5x80A-4iugA:
10.46
5x80B-4iugA:
10.46
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.
4lo6 HA-70

(Clostridium
botulinum) 		PF03505
(Clenterotox) 		4 GLY A 150
TYR A 151
LEU A  47
VAL A  60
 None
 0.90A 5x80A-4lo6A:
undetectable
5x80B-4lo6A:
undetectable		 5x80A-4lo6A:
19.10
5x80B-4lo6A:
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.
4mtn TRANSCRIPTION
TERMINATION FACTOR
NUSA

(Planctopirus
limnophila) 		PF00575
(S1)
PF08529
(NusA_N)
PF13184
(KH_5)
PF14520
(HHH_5) 		4 PRO A 219
GLY A 221
ARG A 247
VAL A 210
 None
 0.94A 5x80A-4mtnA:
undetectable
5x80B-4mtnA:
undetectable		 5x80A-4mtnA:
18.27
5x80B-4mtnA:
18.27
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.
4ofx CYSTATHIONINE
BETA-SYNTHASE

(Coxiella
burnetii) 		PF00291
(PALP) 		4 GLY A  31
TYR A  30
LEU A 263
VAL A 273
 None
 0.94A 5x80A-4ofxA:
undetectable
5x80B-4ofxA:
undetectable		 5x80A-4ofxA:
20.89
5x80B-4ofxA:
20.89
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.
4p0v FARNESYL
PYROPHOSPHATE
SYNTHASE

(Homo sapiens) 		PF00348
(polyprenyl_synt) 		4 GLY A  61
TYR A  58
LEU A 344
VAL A  66
 None
1WO  A 402 (-3.7A)
None
None
 0.96A 5x80A-4p0vA:
undetectable
5x80B-4p0vA:
undetectable		 5x80A-4p0vA:
18.60
5x80B-4p0vA:
18.60
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.
4qpc 10-FORMYLTETRAHYDROF
OLATE DEHYDROGENASE

(Danio rerio) 		PF00551
(Formyl_trans_N)
PF02911
(Formyl_trans_C) 		4 PRO A  84
TYR A 105
LEU A  19
VAL A   5
 None
 0.89A 5x80A-4qpcA:
undetectable
5x80B-4qpcA:
undetectable		 5x80A-4qpcA:
19.02
5x80B-4qpcA:
19.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w78 HYDRATASE CHSH1
HYDRATASE CHSH2

(Mycobacterium
tuberculosis) 		PF13452
(MaoC_dehydrat_N)
no annotation 		4 PRO A  60
GLY A  58
LEU B  72
VAL A  63
 None
 0.92A 5x80A-4w78A:
undetectable
5x80B-4w78A:
undetectable		 5x80A-4w78A:
22.39
5x80B-4w78A:
22.39
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.
4wop ATP-DEPENDENT
DETHIOBIOTIN
SYNTHETASE BIOD

(Mycobacterium
tuberculosis) 		PF13500
(AAA_26) 		4 PRO A  38
GLY A  64
LEU A  98
VAL A 107
 None
 0.99A 5x80A-4wopA:
undetectable
5x80B-4wopA:
undetectable		 5x80A-4wopA:
21.74
5x80B-4wopA:
21.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4x28 ACYL-COA
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 GLY A 156
TYR A 218
LEU A 172
VAL A 222
 None
 0.79A 5x80A-4x28A:
undetectable
5x80B-4x28A:
undetectable		 5x80A-4x28A:
17.88
5x80B-4x28A:
17.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xeu TRANSKETOLASE

(Pseudomonas
aeruginosa) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 GLY A 394
TYR A 404
LEU A 173
VAL A 132
 None
 0.97A 5x80A-4xeuA:
undetectable
5x80B-4xeuA:
undetectable		 5x80A-4xeuA:
13.97
5x80B-4xeuA:
13.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5azb PROLIPOPROTEIN
DIACYLGLYCERYL
TRANSFERASE

(Escherichia
coli) 		PF01790
(LGT) 		4 PRO A 194
TYR A 190
LEU A 177
VAL A 156
 None
 0.99A 5x80A-5azbA:
undetectable
5x80B-5azbA:
1.2		 5x80A-5azbA:
20.07
5x80B-5azbA:
20.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5azd BACTERIORHODOPSIN

(Thermus
thermophilus) 		PF01036
(Bac_rhodopsin) 		4 PRO A 202
GLY A 199
TYR A 201
LEU A 163
 LYR  A 233 ( 4.1A)
None
LYR  A 233 ( 3.2A)
None
 0.89A 5x80A-5azdA:
1.0
5x80B-5azdA:
0.8		 5x80A-5azdA:
18.96
5x80B-5azdA:
18.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dtp PROBABLE ENOYL-COA
HYDRATASE ECHA6

(Mycobacterium
tuberculosis) 		PF00378
(ECH_1) 		4 GLY A 166
LEU A 157
ARG A 111
VAL A 113
 None
 0.90A 5x80A-5dtpA:
undetectable
5x80B-5dtpA:
undetectable		 5x80A-5dtpA:
29.30
5x80B-5dtpA:
29.30
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.
5gn5 GLYCEROL KINASE

(Trypanosoma
brucei) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		4 GLY A 300
TYR A 310
LEU A 198
VAL A 187
 None
 0.94A 5x80A-5gn5A:
undetectable
5x80B-5gn5A:
undetectable		 5x80A-5gn5A:
16.73
5x80B-5gn5A:
16.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gtx BUCKWHEAT
GLUTAREDOXIN

(Polygonaceae) 		PF00462
(Glutaredoxin) 		4 PRO A  84
GLY A  95
TYR A  41
VAL A  33
 None
 0.96A 5x80A-5gtxA:
undetectable
5x80B-5gtxA:
undetectable		 5x80A-5gtxA:
23.84
5x80B-5gtxA:
23.84
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.
5h7j ELONGATION FACTOR 2

(Pyrococcus
horikoshii) 		no annotation 4 PRO A 628
GLY A 699
TYR A 629
VAL A 393
 None
 0.92A 5x80A-5h7jA:
undetectable
5x80B-5h7jA:
undetectable		 5x80A-5h7jA:
21.37
5x80B-5h7jA:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hjr NEUTRAL
ALPHA-GLUCOSIDASE AB

(Mus musculus) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		4 PRO A 444
TYR A 418
LEU A 730
VAL A 838
 None
 0.86A 5x80A-5hjrA:
undetectable
5x80B-5hjrA:
undetectable		 5x80A-5hjrA:
11.40
5x80B-5hjrA:
11.40
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.
5i8i UREA AMIDOLYASE

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF01425
(Amidase)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 PRO A1121
GLY A1188
ARG A1198
VAL A1082
 None
 0.96A 5x80A-5i8iA:
undetectable
5x80B-5i8iA:
undetectable		 5x80A-5i8iA:
7.09
5x80B-5i8iA:
7.09
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.
5ljy ENVELOPMENT
POLYPROTEIN

(Hantaan
orthohantavirus) 		PF01561
(Hanta_G2) 		4 PRO A 224
GLY A 225
LEU A 199
VAL A 269
 None
 0.96A 5x80A-5ljyA:
undetectable
5x80B-5ljyA:
undetectable		 5x80A-5ljyA:
15.62
5x80B-5ljyA:
15.62
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.
5n5d METHYLTRANSFERASE

(Streptomyces
regensis) 		PF01596
(Methyltransf_3) 		4 GLY A  69
TYR A  70
LEU A  85
VAL A 107
 None
 0.99A 5x80A-5n5dA:
undetectable
5x80B-5n5dA:
undetectable		 5x80A-5n5dA:
25.23
5x80B-5n5dA:
25.23
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.
5o0d PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE

(Mycobacteroides
abscessus) 		PF01467
(CTP_transf_like) 		4 GLY A 137
TYR A 136
LEU A 153
VAL A 140
 None
 0.83A 5x80A-5o0dA:
undetectable
5x80B-5o0dA:
undetectable		 5x80A-5o0dA:
28.57
5x80B-5o0dA:
28.57
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.
5xfa NAD-REDUCING
HYDROGENASE

(Hydrogenophilus
thermoluteolus) 		PF00374
(NiFeSe_Hases) 		4 GLY D 348
TYR D 349
LEU D 136
ARG D 353
 None
 0.98A 5x80A-5xfaD:
undetectable
5x80B-5xfaD:
undetectable		 5x80A-5xfaD:
17.14
5x80B-5xfaD:
17.14
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.
5xvs GDP/UDP-N,N'-DIACETY
LBACILLOSAMINE
2-EPIMERASE
(HYDROLYZING)

(Acinetobacter
baumannii) 		no annotation 4 GLY A 126
TYR A 156
LEU A 163
VAL A 170
 None
 0.85A 5x80A-5xvsA:
undetectable
5x80B-5xvsA:
undetectable		 5x80A-5xvsA:
18.52
5x80B-5xvsA:
18.52
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.
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		no annotation 4 PRO A 647
GLY A 649
TYR A 650
ARG A 761
 None
 0.84A 5x80A-5xxoA:
undetectable
5x80B-5xxoA:
undetectable		 5x80A-5xxoA:
18.87
5x80B-5xxoA:
18.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yh5 NICKEL ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN

(Staphylococcus
aureus) 		no annotation 4 GLY A 166
TYR A  38
LEU A  52
VAL A  74
 None
 0.90A 5x80A-5yh5A:
undetectable
5x80B-5yh5A:
undetectable		 5x80A-5yh5A:
18.25
5x80B-5yh5A:
18.25
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.
5yz0 SERINE/THREONINE-PRO
TEIN KINASE ATR

(Homo sapiens) 		no annotation 4 GLY A2098
TYR A2097
ARG A2148
VAL A2156
 None
 0.74A 5x80A-5yz0A:
undetectable
5x80B-5yz0A:
undetectable		 5x80A-5yz0A:
20.00
5x80B-5yz0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6ank SYNAPTOTAGMIN-7

(Rattus
norvegicus) 		PF00168
(C2) 		4 GLY A 144
TYR A 145
LEU A 219
VAL A 245
 None
 0.93A 5x80A-6ankA:
undetectable
5x80B-6ankA:
undetectable		 5x80A-6ankA:
20.21
5x80B-6ankA:
20.21
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.
6azp MYELOPEROXIDASE

(Homo sapiens) 		no annotation 4 GLY A 598
TYR A 599
LEU A 199
VAL A 493
 None
 0.98A 5x80A-6azpA:
undetectable
5x80B-6azpA:
undetectable		 5x80A-6azpA:
18.75
5x80B-6azpA:
18.75