SIMILAR PATTERNS OF AMINO ACIDS FOR 3JAY_A_SAMA1102

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.
1cqj SUCCINYL-COA
SYNTHETASE ALPHA
CHAIN

(Escherichia
coli) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		5 ILE A 177
GLY A 178
GLY A 179
ALA A 247
PRO A 124
 None
None
None
None
COA  A 901 (-4.1A)
 1.05A 3jayA-1cqjA:
0.0		 3jayA-1cqjA:
14.94
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.
1dms DMSO REDUCTASE

(Rhodobacter
capsulatus) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		5 GLY A 364
GLY A 363
PRO A 366
PHE A 578
PRO A 172
 None
 0.92A 3jayA-1dmsA:
2.7		 3jayA-1dmsA:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ecg GLUTAMINE
PHOSPHORIBOSYLPYROPH
OSPHATE
AMIDOTRANSFERASE

(Escherichia
coli) 		PF00156
(Pribosyltran)
PF13522
(GATase_6) 		5 ILE A  69
GLY A  70
ALA A  19
ALA A  31
ILE A   6
 None
 0.97A 3jayA-1ecgA:
0.0		 3jayA-1ecgA:
19.59
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.
1gff BACTERIOPHAGE G4
CAPSID PROTEINS GPF,
GPG, GPJ

(Escherichia
virus G4) 		PF02305
(Phage_F) 		5 ILE 1 283
GLY 1 281
ALA 1  37
PHE 1  41
ILE 1  71
 None
 0.92A 3jayA-1gff1:
0.0		 3jayA-1gff1:
16.24
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.
1jnf SEROTRANSFERRIN

(Oryctolagus
cuniculus) 		PF00405
(Transferrin) 		5 TYR A 395
ILE A 461
GLY A 458
ALA A 452
ALA A 528
 None
None
CO3  A 701 (-4.0A)
None
None
 1.06A 3jayA-1jnfA:
0.0		 3jayA-1jnfA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jqe HISTAMINE
N-METHYLTRANSFERASE

(Homo sapiens) 		PF13489
(Methyltransf_23) 		5 ILE A  59
GLY A  60
GLY A  61
PRO A  90
ILE A 142
 None
SAH  A 400 (-3.3A)
SAH  A 400 ( 4.1A)
SAH  A 400 (-4.3A)
SAH  A 400 (-4.1A)
 0.63A 3jayA-1jqeA:
9.6		 3jayA-1jqeA:
14.46
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.
1jtd BETA-LACTAMASE
INHIBITOR PROTEIN II

(Streptomyces
exfoliatus) 		PF13540
(RCC1_2) 		5 TYR B 270
GLY B  72
GLY B  71
ALA B 301
ALA B 109
 None
 0.92A 3jayA-1jtdB:
0.0		 3jayA-1jtdB:
13.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mns MANDELATE RACEMASE

(Pseudomonas
putida) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A 274
GLY A 275
GLY A 276
ALA A 104
ILE A 281
 None
 0.93A 3jayA-1mnsA:
0.0		 3jayA-1mnsA:
16.21
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.
1nst HEPARAN SULFATE
N-DEACETYLASE/N-SULF
OTRANSFERASE

(Homo sapiens) 		PF00685
(Sulfotransfer_1) 		5 ILE A 704
GLY A 616
ALA A 619
PRO A 612
ALA A 678
 None
A3P  A 301 (-3.2A)
A3P  A 301 ( 3.7A)
None
None
 1.03A 3jayA-1nstA:
0.0		 3jayA-1nstA:
14.63
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.
1ouv CONSERVED
HYPOTHETICAL
SECRETED PROTEIN

(Helicobacter
pylori) 		PF08238
(Sel1) 		5 GLY A  34
ALA A  37
PRO A  29
ALA A  55
TYR A  96
 None
 1.11A 3jayA-1ouvA:
undetectable		 3jayA-1ouvA:
12.94
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.
1suv SEROTRANSFERRIN,
C-LOBE

(Homo sapiens) 		PF00405
(Transferrin) 		5 TYR E 395
ILE E 461
GLY E 458
ALA E 452
ALA E 528
 None
None
CO3  E 701 (-4.0A)
None
None
 1.06A 3jayA-1suvE:
undetectable		 3jayA-1suvE:
14.99
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.
1t90 PROBABLE
METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE

(Bacillus
subtilis) 		PF00171
(Aldedh) 		5 ILE A 149
GLY A 148
GLY A 147
ALA A 223
PRO A 159
 NAD  A1490 (-4.9A)
None
None
None
None
 0.97A 3jayA-1t90A:
undetectable		 3jayA-1t90A:
17.97
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.
1ven BETA-AMYLASE

(Bacillus cereus) 		PF00686
(CBM_20)
PF01373
(Glyco_hydro_14) 		6 GLY A 168
GLY A 167
ALA A 286
ALA A 170
PRO A 176
TYR A 310
 None
None
None
GLC  A 900 ( 4.0A)
None
None
 1.18A 3jayA-1venA:
undetectable		 3jayA-1venA:
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.
1xc3 PUTATIVE
FRUCTOKINASE

(Bacillus
subtilis) 		PF00480
(ROK) 		6 TYR A  44
ILE A  55
GLY A  54
GLY A   4
ALA A  15
PHE A 100
 None
 1.35A 3jayA-1xc3A:
undetectable		 3jayA-1xc3A:
14.43
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.
1xdq BACTERIAL SULFITE
OXIDASE

(Escherichia
coli) 		PF00174
(Oxidored_molyb) 		5 GLY A 232
ALA A 235
PRO A 228
ALA A 227
TYR A 160
 None
None
None
None
MTE  A 301 (-3.6A)
 0.81A 3jayA-1xdqA:
undetectable		 3jayA-1xdqA:
13.26
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.
1xdz METHYLTRANSFERASE
GIDB

(Bacillus
subtilis) 		PF02527
(GidB) 		5 ILE A  98
GLY A  77
ALA A 148
ALA A 128
PHE A 123
 None
 1.06A 3jayA-1xdzA:
8.0		 3jayA-1xdzA:
13.26
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.
1xi6 EXTRAGENIC
SUPPRESSOR

(Pyrococcus
furiosus) 		PF00459
(Inositol_P) 		5 ILE A 128
GLY A 127
ALA A 205
ALA A 213
ILE A 115
 None
 1.04A 3jayA-1xi6A:
0.8		 3jayA-1xi6A:
13.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bfu COWPEA MOSAIC VIRUS,
SMALL (S) SUBUNIT

(Cowpea mosaic
virus) 		PF02248
(Como_SCP) 		5 ILE S  39
GLY S  37
ALA S 134
ILE S  35
PRO S 179
 None
 0.84A 3jayA-2bfuS:
undetectable		 3jayA-2bfuS:
11.22
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.
2bwp 5-AMINOLEVULINATE
SYNTHASE

(Rhodobacter
capsulatus) 		PF00155
(Aminotran_1_2) 		5 TYR A 212
ILE A 100
GLY A 244
ALA A 247
ILE A 257
 None
None
None
PLG  A 500 ( 4.0A)
None
 0.85A 3jayA-2bwpA:
3.4		 3jayA-2bwpA:
17.42
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.
2dv6 NITRITE REDUCTASE

(Hyphomicrobium
denitrificans) 		PF07732
(Cu-oxidase_3) 		5 ILE A 269
GLY A 357
GLY A 297
PRO A 395
ILE A 299
 None
 1.05A 3jayA-2dv6A:
undetectable		 3jayA-2dv6A:
17.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ece 462AA LONG
HYPOTHETICAL
SELENIUM-BINDING
PROTEIN

(Sulfurisphaera
tokodaii) 		PF05694
(SBP56) 		5 TYR A 410
GLY A 343
ALA A 382
ILE A 367
PRO A 301
 None
 1.08A 3jayA-2eceA:
undetectable		 3jayA-2eceA:
17.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fpg SUCCINYL-COA LIGASE
[GDP-FORMING]
ALPHA-CHAIN,
MITOCHONDRIAL

(Sus scrofa) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		5 ILE A 186
GLY A 187
GLY A 188
ALA A 260
PRO A 133
 None
 1.08A 3jayA-2fpgA:
3.7		 3jayA-2fpgA:
13.14
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.
2hnh DNA POLYMERASE III
ALPHA SUBUNIT

(Escherichia
coli) 		PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6) 		5 ILE A 816
GLY A 819
PRO A 814
PHE A 888
ILE A 850
 None
 1.08A 3jayA-2hnhA:
undetectable		 3jayA-2hnhA:
22.08
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.
2or0 HYDROXYLASE

(Rhodococcus
jostii) 		PF08028
(Acyl-CoA_dh_2) 		5 GLY A 316
ALA A 323
ALA A 295
ILE A 321
PRO A 228
 None
 1.02A 3jayA-2or0A:
1.5		 3jayA-2or0A:
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.
2p0l LIPOATE-PROTEIN
LIGASE A

(Streptococcus
agalactiae) 		PF03099
(BPL_LplA_LipB) 		5 TYR A 197
GLY A  90
GLY A  91
ALA A 166
PHE A  89
 None
 1.05A 3jayA-2p0lA:
1.6		 3jayA-2p0lA:
14.41
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.
2r4j AEROBIC
GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Escherichia
coli) 		PF01266
(DAO)
PF16901
(DAO_C) 		5 ILE A 391
GLY A 389
GLY A 388
ALA A 154
ILE A  81
 None
 1.10A 3jayA-2r4jA:
undetectable		 3jayA-2r4jA:
17.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2uv8 FATTY ACID SYNTHASE
SUBUNIT BETA (FAS1)

(Saccharomyces
cerevisiae) 		PF00698
(Acyl_transf_1)
PF01575
(MaoC_dehydratas)
PF08354
(DUF1729)
PF13452
(MaoC_dehydrat_N)
PF16073
(SAT) 		5 GLY G 841
GLY G 842
ALA G 858
ALA G1060
PRO G 828
 None
 1.02A 3jayA-2uv8G:
undetectable		 3jayA-2uv8G:
20.03
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.
2uv8 FATTY ACID SYNTHASE
SUBUNIT BETA (FAS1)

(Saccharomyces
cerevisiae) 		PF00698
(Acyl_transf_1)
PF01575
(MaoC_dehydratas)
PF08354
(DUF1729)
PF13452
(MaoC_dehydrat_N)
PF16073
(SAT) 		5 LYS G 866
GLY G 841
GLY G 842
ALA G 858
ALA G1060
 None
 1.09A 3jayA-2uv8G:
undetectable		 3jayA-2uv8G:
20.03
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.
2v6g PROGESTERONE
5-BETA-REDUCTASE

(Digitalis
lanata) 		PF01370
(Epimerase) 		5 ILE A  37
GLY A  36
GLY A  39
ALA A  43
ALA A  62
 NAP  A1390 (-4.0A)
NAP  A1390 (-3.1A)
None
None
NAP  A1390 (-3.6A)
 1.10A 3jayA-2v6gA:
undetectable		 3jayA-2v6gA:
15.89
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.
2vdc GLUTAMATE SYNTHASE
[NADPH] LARGE CHAIN

(Azospirillum
brasilense) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		5 TYR A 696
ILE A 659
ALA A 668
ALA A 620
ILE A 700
 None
 1.09A 3jayA-2vdcA:
undetectable		 3jayA-2vdcA:
21.30
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.
2wdw PUTATIVE HEXOSE
OXIDASE

(Nonomuraea
gerenzanensis) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 GLY A 217
GLY A 216
ALA A 416
PRO A 474
TYR A 370
 None
 1.12A 3jayA-2wdwA:
undetectable		 3jayA-2wdwA:
18.53
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.
2wdw PUTATIVE HEXOSE
OXIDASE

(Nonomuraea
gerenzanensis) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 ILE A 471
GLY A 217
GLY A 216
ALA A 212
ILE A 521
 None
 0.95A 3jayA-2wdwA:
undetectable		 3jayA-2wdwA:
18.53
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.
2wqq ALPHA-2,3-/2,8-SIALY
LTRANSFERASE

(Campylobacter
jejuni) 		PF06002
(CST-I) 		5 GLY A 152
GLY A   8
PRO A  11
ALA A 163
ILE A   6
 None
CSF  A1259 (-2.9A)
None
None
None
 1.10A 3jayA-2wqqA:
undetectable		 3jayA-2wqqA:
13.73
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.
2wqq ALPHA-2,3-/2,8-SIALY
LTRANSFERASE

(Campylobacter
jejuni) 		PF06002
(CST-I) 		6 ILE A 153
GLY A 152
GLY A   8
PRO A  11
ALA A 163
TYR A  18
 CSF  A1259 (-4.4A)
None
CSF  A1259 (-2.9A)
None
None
None
 1.21A 3jayA-2wqqA:
undetectable		 3jayA-2wqqA:
13.73
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.
2x63 ALPHA-2,3-/2,8-SIALY
LTRANSFERASE

(Campylobacter
jejuni) 		PF06002
(CST-I) 		6 ILE A 153
GLY A 152
GLY A   8
PRO A  11
ALA A 163
TYR A  18
 C  A1261 (-4.3A)
None
C  A1261 (-3.0A)
C  A1261 (-4.8A)
None
None
 1.25A 3jayA-2x63A:
undetectable		 3jayA-2x63A:
13.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3aty PROSTAGLANDIN F2A
SYNTHASE

(Trypanosoma
cruzi) 		PF00724
(Oxidored_FMN) 		5 TYR A 157
GLY A  70
ALA A 110
ALA A  61
ILE A 144
 None
None
None
FMN  A 500 (-3.1A)
None
 1.07A 3jayA-3atyA:
undetectable		 3jayA-3atyA:
17.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b4w ALDEHYDE
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF00171
(Aldedh) 		5 GLY A 148
PRO A 146
ALA A 173
ILE A 225
PRO A  65
 None
 1.12A 3jayA-3b4wA:
undetectable		 3jayA-3b4wA:
18.53
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.
3bpt 3-HYDROXYISOBUTYRYL-
COA HYDROLASE

(Homo sapiens) 		PF16113
(ECH_2) 		5 TYR A 135
GLY A  88
ALA A  93
ILE A  49
PRO A  54
 None
 1.00A 3jayA-3bptA:
undetectable		 3jayA-3bptA:
15.86
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.
3cgg SAM-DEPENDENT
METHYLTRANSFERASE

(Corynebacterium
glutamicum) 		PF13649
(Methyltransf_25) 		5 GLY A  61
GLY A  60
ALA A  83
ILE A  49
PRO A  88
 None
 1.07A 3jayA-3cggA:
undetectable		 3jayA-3cggA:
10.49
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.
3da1 GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Bacillus
halodurans) 		PF01266
(DAO)
PF16901
(DAO_C) 		5 ILE A 176
GLY A  32
GLY A  30
ALA A 227
ALA A  37
 None
 1.11A 3jayA-3da1A:
undetectable		 3jayA-3da1A:
19.34
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.
3dkn PREPROTEIN
TRANSLOCASE SUBUNIT
SECY

(Canis lupus) 		PF00344
(SecY) 		5 TYR A  37
ILE A  67
ALA A  64
ALA A 267
ILE A  71
 None
 1.00A 3jayA-3dknA:
undetectable		 3jayA-3dknA:
16.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3euw MYO-INOSITOL
DEHYDROGENASE

(Corynebacterium
glutamicum) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 GLY A 166
GLY A 167
ALA A 315
ILE A 162
PRO A  95
 None
 1.07A 3jayA-3euwA:
undetectable		 3jayA-3euwA:
15.41
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.
3fj4 MUCONATE
CYCLOISOMERASE

(Pseudomonas
protegens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A 222
GLY A 218
GLY A 219
ILE A 216
PRO A 247
 None
 0.89A 3jayA-3fj4A:
undetectable		 3jayA-3fj4A:
17.62
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.
3hvd PROTECTIVE ANTIGEN

(Bacillus
anthracis) 		PF03495
(Binary_toxB)
PF17475
(Binary_toxB_2)
PF17476
(Binary_toxB_3) 		5 ILE A 261
GLY A 370
ALA A 406
ILE A 374
TYR A 233
 None
 1.11A 3jayA-3hvdA:
undetectable		 3jayA-3hvdA:
21.32
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.
3k1u BETA-XYLOSIDASE,
FAMILY 43 GLYCOSYL
HYDROLASE

(Clostridium
acetobutylicum) 		PF04616
(Glyco_hydro_43) 		5 ILE A 274
PRO A 258
ALA A 278
PHE A 311
ILE A   6
 None
 1.11A 3jayA-3k1uA:
undetectable		 3jayA-3k1uA:
14.85
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.
3l8k DIHYDROLIPOYL
DEHYDROGENASE

(Sulfolobus
solfataricus) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLY A 309
ALA A 316
PRO A 270
ALA A 140
TYR A 180
 None
 1.11A 3jayA-3l8kA:
undetectable		 3jayA-3l8kA:
19.73
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.
3lkv UNCHARACTERIZED
CONSERVED DOMAIN
PROTEIN

(Vibrio cholerae) 		PF04392
(ABC_sub_bind) 		5 ILE A 162
GLY A 163
ALA A 194
ALA A 210
PRO A 241
 None
 0.99A 3jayA-3lkvA:
undetectable		 3jayA-3lkvA:
15.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nek NITROGEN
REPRESSOR-LIKE
PROTEIN MJ0159

(Methanocaldococcus
jannaschii) 		PF01995
(DUF128) 		5 TYR A 433
ILE A 376
GLY A 508
GLY A 507
PRO A 511
 None
None
GOL  A   1 (-3.8A)
GOL  A   1 ( 4.3A)
None
 1.10A 3jayA-3nekA:
undetectable		 3jayA-3nekA:
12.24
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.
3p8k HYDROLASE,
CARBON-NITROGEN
FAMILY

(Staphylococcus
aureus) 		PF00795
(CN_hydrolase) 		5 ILE A 196
GLY A 197
ALA A 170
PHE A 167
ILE A 216
 None
 1.11A 3jayA-3p8kA:
undetectable		 3jayA-3p8kA:
13.56
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.
3pop GILR OXIDASE

(Streptomyces
griseoflavus) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 ILE A 446
GLY A 191
GLY A 190
ALA A 186
ILE A 496
 None
 0.97A 3jayA-3popA:
undetectable		 3jayA-3popA:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3scy HYPOTHETICAL
BACTERIAL
6-PHOSPHOGLUCONOLACT
ONASE

(Bacteroides
fragilis) 		PF10282
(Lactonase) 		5 ILE A 254
GLY A 255
GLY A 256
ALA A 276
ILE A 251
 None
 1.02A 3jayA-3scyA:
undetectable		 3jayA-3scyA:
16.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sgz HYDROXYACID OXIDASE
2

(Rattus
norvegicus) 		PF01070
(FMN_dh) 		5 ILE A  38
GLY A 280
GLY A 279
PRO A 303
ILE A 259
 None
FMN  A 401 (-3.8A)
FMN  A 401 (-3.4A)
FMN  A 401 (-4.8A)
None
 1.11A 3jayA-3sgzA:
undetectable		 3jayA-3sgzA:
15.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sql GLYCOSYL HYDROLASE
FAMILY 3

(Synechococcus
sp. PCC 7002) 		PF00933
(Glyco_hydro_3) 		5 TYR A 481
ILE A 386
ALA A 415
ILE A 479
PRO A 443
 None
 1.09A 3jayA-3sqlA:
undetectable		 3jayA-3sqlA:
18.89
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.
3u37 ACETYL-XYLAN
ESTERASE EST2A

(Butyrivibrio
proteoclasticus) 		PF13472
(Lipase_GDSL_2) 		5 GLY A  37
GLY A  38
PHE A  34
ILE A  19
TYR A 132
 None
 1.09A 3jayA-3u37A:
undetectable		 3jayA-3u37A:
17.59
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.
3u7v BETA-GALACTOSIDASE

(Caulobacter
vibrioides) 		PF02449
(Glyco_hydro_42) 		5 GLY A 297
GLY A 298
ALA A 281
PRO A 165
TYR A 161
 None
 1.09A 3jayA-3u7vA:
undetectable		 3jayA-3u7vA:
19.15
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.
3uca GERANYLTRANSTRANSFER
ASE

(Clostridium
perfringens) 		PF00348
(polyprenyl_synt) 		5 ILE A 196
GLY A 199
ALA A 203
ALA A  77
ILE A  65
 None
 1.06A 3jayA-3ucaA:
undetectable		 3jayA-3ucaA:
15.20
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.
3v9f TWO-COMPONENT SYSTEM
SENSOR HISTIDINE
KINASE/RESPONSE
REGULATOR, HYBRID
(ONE-COMPONENT
SYSTEM)

(Bacteroides
thetaiotaomicron) 		PF07494
(Reg_prop)
PF07495
(Y_Y_Y) 		5 GLY A 201
GLY A 200
PHE A 215
PRO A 226
TYR A 276
 None
 0.96A 3jayA-3v9fA:
undetectable		 3jayA-3v9fA:
21.86
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.
3wwh (R)-AMINE
TRANSAMINASE

(Arthrobacter
sp. KNK168) 		PF01063
(Aminotran_4) 		5 ILE A  10
GLY A  36
GLY A  37
ALA A 151
TYR A 330
 None
 1.04A 3jayA-3wwhA:
undetectable		 3jayA-3wwhA:
15.02
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.
4d0y DACB

(Streptococcus
pneumoniae) 		PF02557
(VanY) 		5 TYR A 229
GLY A 186
GLY A 212
ALA A  94
ILE A 218
 None
 1.11A 3jayA-4d0yA:
undetectable		 3jayA-4d0yA:
11.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ds3 PHOSPHORIBOSYLGLYCIN
AMIDE
FORMYLTRANSFERASE

(Brucella
melitensis) 		PF00551
(Formyl_trans_N) 		5 ILE A  85
ALA A  35
ALA A  24
PHE A 187
PRO A  30
 None
 1.07A 3jayA-4ds3A:
undetectable		 3jayA-4ds3A:
11.89
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.
4eye PROBABLE
OXIDOREDUCTASE

(Mycobacteroides
abscessus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A  92
GLY A  91
ALA A   3
ILE A  63
PRO A 321
 None
None
None
MPD  A 401 (-4.3A)
None
 1.09A 3jayA-4eyeA:
undetectable		 3jayA-4eyeA:
15.85
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.
4fim LACTOTRANSFERRIN

(Bos taurus) 		PF00405
(Transferrin) 		5 ILE A 474
GLY A 472
ALA A 668
PHE A 486
ILE A 469
 None
NAG  A 707 ( 4.0A)
NAG  A 707 ( 3.8A)
GOL  A 712 (-4.8A)
None
 1.05A 3jayA-4fimA:
undetectable		 3jayA-4fimA:
16.43
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.
4gri GLUTAMATE--TRNA
LIGASE

(Borreliella
burgdorferi) 		PF00749
(tRNA-synt_1c) 		5 ILE A  18
GLY A  19
GLY A  20
ALA A 215
PHE A 314
 None
 0.99A 3jayA-4griA:
undetectable		 3jayA-4griA:
19.55
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.
4hbk ALDO-KETO REDUCTASE
FAMILY 1, MEMBER B4
(ALDOSE REDUCTASE)

(Schistosoma
japonicum) 		PF00248
(Aldo_ket_red) 		5 ILE A 253
PRO A 209
ALA A 208
PRO A 256
TYR A  48
 None
 1.09A 3jayA-4hbkA:
undetectable		 3jayA-4hbkA:
15.64
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.
4hds ARSB

(Sporomusa ovata) 		PF02277
(DBI_PRT) 		5 ILE B 149
GLY B 234
ALA B 257
ALA B 239
ILE B 229
 None
 1.06A 3jayA-4hdsB:
undetectable		 3jayA-4hdsB:
15.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i59 CYCLOHEXYLAMINE
OXIDASE

(Microbacterium
oxydans) 		PF01593
(Amino_oxidase) 		5 ILE A  41
GLY A  40
GLY A  43
ALA A  47
ILE A 248
 FAD  A 501 (-4.5A)
FAD  A 501 (-3.5A)
None
None
None
 1.02A 3jayA-4i59A:
undetectable		 3jayA-4i59A:
18.39
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.
4jbh ALCOHOL
DEHYDROGENASE (ZINC)

(Pyrobaculum
aerophilum) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A  60
GLY A 120
ALA A 125
ALA A   4
ILE A 113
 None
 0.98A 3jayA-4jbhA:
undetectable		 3jayA-4jbhA:
17.45
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.
4jga 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Rickettsia
rickettsii) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 ILE A 184
GLY A 202
ALA A 250
PHE A 365
ILE A 117
 None
 1.03A 3jayA-4jgaA:
undetectable		 3jayA-4jgaA:
18.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4moz FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Slackia
heliotrinireducens) 		PF01791
(DeoC) 		5 GLY A 262
GLY A 263
ALA A 229
ILE A 259
PRO A 214
 None
 1.00A 3jayA-4mozA:
undetectable		 3jayA-4mozA:
15.68
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.
4moz FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Slackia
heliotrinireducens) 		PF01791
(DeoC) 		5 ILE A 261
GLY A 262
GLY A 263
ALA A 229
ILE A 259
 None
 0.80A 3jayA-4mozA:
undetectable		 3jayA-4mozA:
15.68
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.
4mzd NISIN LEADER
PEPTIDE-PROCESSING
SERINE PROTEASE NISP

(Lactococcus
lactis) 		PF00082
(Peptidase_S8) 		5 GLY A 449
GLY A 448
ALA A 466
PRO A 470
ILE A 462
 None
 1.10A 3jayA-4mzdA:
undetectable		 3jayA-4mzdA:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pz7 MRNA-CAPPING ENZYME
SUBUNIT ALPHA

(Schizosaccharomyces
pombe) 		PF01331
(mRNA_cap_enzyme)
PF03919
(mRNA_cap_C) 		5 ILE A 203
GLY A 202
GLY A 200
PHE A 207
ILE A 363
 None
 1.09A 3jayA-4pz7A:
undetectable		 3jayA-4pz7A:
16.49
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.
4rvh D-MYCAROSE
3-C-METHYLTRANSFERAS
E

(Streptomyces
argillaceus) 		PF08421
(Methyltransf_13)
PF08484
(Methyltransf_14)
PF13489
(Methyltransf_23) 		5 ILE A 113
GLY A 114
PRO A 136
ALA A 137
PHE A 156
 SAH  A 502 (-4.7A)
SAH  A 502 (-3.5A)
SAH  A 502 (-4.0A)
SAH  A 502 ( 3.8A)
None
 0.70A 3jayA-4rvhA:
undetectable		 3jayA-4rvhA:
16.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rzi 3-KETOACYL-ACYL
CARRIER PROTEIN
REDUCTASE

(Synechocystis
sp. PCC 6803) 		no annotation 5 GLY B  15
GLY B  16
ALA B  22
ALA B  41
ILE B  20
 None
 0.95A 3jayA-4rziB:
undetectable		 3jayA-4rziB:
13.03
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.
4s38 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE

(Thermus
thermophilus) 		PF04551
(GcpE) 		5 GLY A 114
ALA A 185
PRO A 151
ALA A 152
ILE A 111
 None
 0.99A 3jayA-4s38A:
undetectable		 3jayA-4s38A:
17.64
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.
4x0o 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 2

(Vibrio cholerae) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 ILE A 289
GLY A 163
GLY A 139
ALA A  80
ALA A  60
 None
 1.09A 3jayA-4x0oA:
undetectable		 3jayA-4x0oA:
17.40
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.
4xvx ACYL-[ACYL-CARRIER-P
ROTEIN]
DEHYDROGENASE MBTN

(Mycobacterium
tuberculosis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 GLY A  44
GLY A  47
ALA A  51
ALA A  17
ILE A 110
 None
 0.98A 3jayA-4xvxA:
undetectable		 3jayA-4xvxA:
16.43
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.
4zr5 NEPRILYSIN

(Oryctolagus
cuniculus) 		PF01431
(Peptidase_M13)
PF05649
(Peptidase_M13_N) 		5 ILE A 447
GLY A 583
ALA A 544
ALA A 650
ILE A 578
 None
None
RDF  A 802 (-4.1A)
ZN  A 801 ( 4.9A)
None
 0.96A 3jayA-4zr5A:
undetectable		 3jayA-4zr5A:
21.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ax0 RHODOPSIN I

(Acetabularia
acetabulum) 		PF01036
(Bac_rhodopsin) 		5 TYR A  87
GLY A 195
GLY A 197
ALA A 130
PRO A   4
 None
 1.11A 3jayA-5ax0A:
undetectable		 3jayA-5ax0A:
12.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dcz TANKYRASE-2

(Homo sapiens) 		PF00644
(PARP) 		5 TYR A1071
ILE A1051
GLY A1052
GLY A1053
ILE A1075
 59B  A1203 (-3.3A)
None
None
None
59B  A1203 (-4.8A)
 1.04A 3jayA-5dczA:
undetectable		 3jayA-5dczA:
12.04
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.
5f84 O-GLUCOSYLTRANSFERAS
E RUMI

(Drosophila
melanogaster) 		PF05686
(Glyco_transf_90) 		5 ILE A 200
GLY A 190
GLY A 189
ALA A 124
ALA A 183
 UDP  A 501 (-4.5A)
None
None
None
None
 1.08A 3jayA-5f84A:
undetectable		 3jayA-5f84A:
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.
5guf CDP-ARCHAEOL
SYNTHASE

(Aeropyrum
pernix) 		no annotation 5 ILE A  19
ALA A 152
PRO A  23
ALA A  24
ILE A  14
 None
 1.11A 3jayA-5gufA:
undetectable		 3jayA-5gufA:
10.86
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.
5hci GPN-LOOP GTPASE 1

(Saccharomyces
cerevisiae) 		PF03029
(ATP_bind_1) 		5 GLY A 109
ALA A  12
PRO A  41
ALA A  42
ILE A 111
 GDP  A 301 ( 4.4A)
GDP  A 301 ( 4.8A)
None
None
None
 0.93A 3jayA-5hciA:
undetectable		 3jayA-5hciA:
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.
5i1w CRMK

(Actinoalloteichus
sp. WH1-2216-6) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 ILE A 447
GLY A 190
GLY A 189
ALA A 185
ILE A 497
 None
 1.00A 3jayA-5i1wA:
undetectable		 3jayA-5i1wA:
19.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5i2h O-METHYLTRANSFERASE
FAMILY 2

(Planctopirus
limnophila) 		PF00891
(Methyltransf_2)
PF16864
(Dimerisation2) 		5 ILE A 222
GLY A 205
ALA A 163
ALA A 210
ILE A 231
 None
 1.00A 3jayA-5i2hA:
undetectable		 3jayA-5i2hA:
16.92
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.
5lc5 NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
2

(Bos taurus) 		PF00361
(Proton_antipo_M)
PF06444
(NADH_dehy_S2_C) 		5 ILE N 164
GLY N 165
GLY N 166
ILE N 162
PRO N 116
 None
 1.09A 3jayA-5lc5N:
undetectable		 3jayA-5lc5N:
16.60
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.
5mlh -

(-) 		no annotation 5 ILE A  37
GLY A  36
GLY A  39
ALA A  43
ALA A  62
 NAP  A 404 (-4.0A)
NAP  A 404 (-3.1A)
None
None
NAP  A 404 (-3.5A)
 1.12A 3jayA-5mlhA:
undetectable		 3jayA-5mlhA:
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.
5n28 METHYL-COENZYME M
REDUCTASE SUBUNIT
ALPHA

(Methanotorris
formicicus) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		5 TYR A 317
GLY A 287
ALA A 491
ILE A 284
PRO A 509
 None
 1.11A 3jayA-5n28A:
undetectable		 3jayA-5n28A:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n6u BETA-MANNOSIDASE

(Dictyoglomus
thermophilum) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		5 TYR A 390
ILE A 362
GLY A 361
GLY A 360
ALA A 386
 None
 0.77A 3jayA-5n6uA:
undetectable		 3jayA-5n6uA:
20.87
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.
5ui2 ORANGE
CAROTENOID-BINDING
PROTEIN

(Arthrospira
maxima) 		PF02136
(NTF2)
PF09150
(Carot_N) 		5 ILE A 151
GLY A 148
ALA A  18
PHE A 280
ILE A 145
 EQ3  A 403 (-3.9A)
None
None
EQ3  A 403 ( 4.7A)
None
 0.90A 3jayA-5ui2A:
undetectable		 3jayA-5ui2A:
15.07
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.
5w19 TRYPTOPHANASE

(Proteus
vulgaris) 		no annotation 5 ILE A 329
GLY A 352
PRO A 200
ILE A 417
PRO A 349
 None
 1.10A 3jayA-5w19A:
undetectable		 3jayA-5w19A:
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.
5w7q CONSENSUS ELONGATION
FACTOR

(synthetic
construct) 		no annotation 5 ILE A  15
GLY A 101
ALA A 123
ILE A 131
PRO A 203
 None
 1.04A 3jayA-5w7qA:
undetectable		 3jayA-5w7qA:
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.
5x1y MERCURIC REDUCTASE

(Lysinibacillus
sphaericus) 		no annotation 5 GLY B 403
GLY B 402
ALA B 385
ALA B 103
ILE B 417
 None
 1.11A 3jayA-5x1yB:
undetectable		 3jayA-5x1yB:
18.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6ane POLY(ETHYLENE
TEREPHTHALATE)
HYDROLASE

(Ideonella
sakaiensis) 		no annotation 5 GLY A 135
ALA A  62
PRO A 157
ALA A 156
PRO A 154
 None
 0.93A 3jayA-6aneA:
undetectable		 3jayA-6aneA:
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.
6apx MALTOSE-BINDING
PERIPLASMIC
PROTEIN,DUAL
SPECIFICITY PROTEIN
PHOSPHATASE 1
MONOBODY YSX1

(Escherichia
coli;
Homo sapiens;
synthetic
construct) 		no annotation
no annotation 		5 TYR B  77
ILE A 329
GLY A 260
ALA A 109
PRO A 107
 None
 0.88A 3jayA-6apxB:
undetectable		 3jayA-6apxB:
7.18
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.
6avo PROTEASOME SUBUNIT
BETA TYPE-10

(Homo sapiens) 		no annotation 5 ILE B 178
GLY B 102
GLY B 101
PRO B 108
ILE B  37
 None
 1.09A 3jayA-6avoB:
undetectable		 3jayA-6avoB:
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.
6bk6 HENDRA VIRUS MATRIX
PROTEIN

(Hendra
henipavirus) 		no annotation 5 ILE A 271
GLY A 272
GLY A 273
PRO A  93
ALA A  91
 None
 0.99A 3jayA-6bk6A:
undetectable		 3jayA-6bk6A:
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.
6c0d AMIDASE,
HYDANTOINASE/CARBAMO
YLASE FAMILY

(Paraburkholderia
phymatum) 		no annotation 5 GLY A  89
ALA A  94
ALA A  25
ILE A 189
PRO A  28
 None
 1.03A 3jayA-6c0dA:
undetectable		 3jayA-6c0dA:
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.
6c49 ALCOHOL
DEHYDROGENASE

(Acinetobacter
baumannii) 		no annotation 5 ILE A 118
GLY A 123
GLY A 124
ALA A   8
ILE A  89
 None
 1.11A 3jayA-6c49A:
undetectable		 3jayA-6c49A:
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.
6eu6 AMMONIUM TRANSPORTER

(Candidatus
Kuenenia
stuttgartiensis) 		no annotation 5 ILE A 173
GLY A 174
GLY A 175
ALA A 322
ALA A 180
 None
 1.07A 3jayA-6eu6A:
undetectable		 3jayA-6eu6A:
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.
1anu COHESIN-2

(Ruminiclostridium
thermocellum) 		PF00963
(Cohesin) 		3 ARG A  38
ASP A 133
ASP A 114
 None
 0.88A 3jayA-1anuA:
0.0		 3jayA-1anuA:
7.46
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.
1b79 DNAB HELICASE

(Escherichia
coli) 		PF00772
(DnaB) 		3 ARG A  53
ASP A  58
ASP A 123
 None
 0.48A 3jayA-1b79A:
undetectable		 3jayA-1b79A:
7.81
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.
1d2n N-ETHYLMALEIMIDE-SEN
SITIVE FUSION
PROTEIN

(Cricetulus
griseus) 		PF00004
(AAA) 		3 ARG A 615
ASP A 579
ASP A 612
 None
None
ANP  A   1 ( 4.3A)
 0.81A 3jayA-1d2nA:
0.0		 3jayA-1d2nA:
13.37
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.
1dab P.69 PERTACTIN

(Bordetella
pertussis) 		PF03212
(Pertactin) 		3 ARG A 451
ASP A 462
ASP A 426
 None
 0.87A 3jayA-1dabA:
0.0		 3jayA-1dabA:
20.43
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.
1drt CLAVAMINATE SYNTHASE
1

(Streptomyces
clavuligerus) 		PF02668
(TauD) 		3 ARG A 276
ASP A  60
ASP A 273
 None
 0.69A 3jayA-1drtA:
0.0		 3jayA-1drtA:
16.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gpe PROTEIN (GLUCOSE
OXIDASE)

(Penicillium
amagasakiense) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		3 ARG A 234
ASP A 113
ASP A 231
 None
 0.79A 3jayA-1gpeA:
0.0		 3jayA-1gpeA:
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.
1hyh L-2-HYDROXYISOCAPROA
TE DEHYDROGENASE

(Weissella
confusa) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		3 ARG A 315
ASP A 323
ASP A 316
 None
 0.87A 3jayA-1hyhA:
0.0		 3jayA-1hyhA:
15.42
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.
1ig8 HEXOKINASE PII

(Saccharomyces
cerevisiae) 		PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2) 		3 ARG A 199
ASP A 140
ASP A 133
 None
 0.90A 3jayA-1ig8A:
0.0		 3jayA-1ig8A:
18.88
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.
1mtp SERINE PROTEINASE
INHIBITOR (SERPIN),
CHAIN A
SERINE PROTEINASE
INHIBITOR (SERPIN),
CHAIN B

(Thermobifida
fusca;
Thermobifida
fusca) 		PF00079
(Serpin)
no annotation 		3 ARG A 306
ASP B 363
ASP A 308
 None
 0.86A 3jayA-1mtpA:
0.0		 3jayA-1mtpA:
15.48
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.
1nne DNA MISMATCH REPAIR
PROTEIN MUTS

(Thermus
aquaticus) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		3 ARG A 334
ASP A 348
ASP A 331
 None
 0.86A 3jayA-1nneA:
undetectable		 3jayA-1nneA:
21.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1og6 HYPOTHETICAL
OXIDOREDUCTASE YDHF

(Escherichia
coli) 		PF00248
(Aldo_ket_red) 		3 ARG A 103
ASP A 135
ASP A 141
 None
 0.79A 3jayA-1og6A:
undetectable		 3jayA-1og6A:
15.18
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.
1p27 MAGO NASHI PROTEIN
HOMOLOG

(Homo sapiens) 		PF02792
(Mago_nashi) 		3 ARG A  27
ASP A   4
ASP A  29
 None
 0.83A 3jayA-1p27A:
undetectable		 3jayA-1p27A:
10.61
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.
1pgw BEAN POD MOTTLE
VIRUS LARGE (L)
SUBUNIT

(Bean pod mottle
virus) 		PF02247
(Como_LCP) 		3 ARG 2  57
ASP 2  61
ASP 2  22
 None
 0.66A 3jayA-1pgw2:
undetectable		 3jayA-1pgw2:
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.
1rdr POLIOVIRUS 3D
POLYMERASE

(Enterovirus C) 		PF00680
(RdRP_1) 		3 ARG A 408
ASP A 412
ASP A 406
 None
 0.78A 3jayA-1rdrA:
undetectable		 3jayA-1rdrA:
20.18
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.
1tj7 ARGININOSUCCINATE
LYASE

(Escherichia
coli) 		PF00206
(Lyase_1)
PF14698
(ASL_C2) 		3 ARG A 109
ASP A 116
ASP A  83
 PO4  A 601 (-3.7A)
None
None
 0.81A 3jayA-1tj7A:
undetectable		 3jayA-1tj7A:
17.83
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.
1yfz HYPOXANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE

(Caldanaerobacter
subterraneus) 		PF00156
(Pribosyltran) 		3 ARG A 136
ASP A 132
ASP A 105
 None
None
IMP  A1210 (-4.2A)
 0.85A 3jayA-1yfzA:
3.0		 3jayA-1yfzA:
12.04
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.
2bco SUCCINYLGLUTAMATE
DESUCCINYLASE

(Vibrio
parahaemolyticus) 		PF04952
(AstE_AspA) 		3 ARG A 138
ASP A 143
ASP A 139
 None
 0.89A 3jayA-2bcoA:
undetectable		 3jayA-2bcoA:
16.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d1p HYPOTHETICAL PROTEIN
YHEL

(Escherichia
coli) 		PF04077
(DsrH) 		3 ARG C  48
ASP C  39
ASP C  73
 None
 0.55A 3jayA-2d1pC:
undetectable		 3jayA-2d1pC:
6.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dbr GLYOXYLATE REDUCTASE

(Pyrococcus
horikoshii) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		3 ARG A 160
ASP A 102
ASP A  98
 SO4  A 501 ( 2.7A)
None
None
 0.87A 3jayA-2dbrA:
2.7		 3jayA-2dbrA:
15.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gi7 GPVI PROTEIN

(Homo sapiens) 		PF13895
(Ig_2) 		3 ARG A 166
ASP A 121
ASP A 167
 None
 0.87A 3jayA-2gi7A:
undetectable		 3jayA-2gi7A:
10.49
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.
2hdi COLICIN I RECEPTOR

(Escherichia
coli) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 ARG A 180
ASP A 182
ASP A 179
 None
 0.85A 3jayA-2hdiA:
undetectable		 3jayA-2hdiA:
21.27
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.
2poi BACULOVIRAL IAP
REPEAT-CONTAINING
PROTEIN 4

(Homo sapiens) 		PF00653
(BIR) 		3 ARG A  72
ASP A  77
ASP A  71
 None
 0.72A 3jayA-2poiA:
undetectable		 3jayA-2poiA:
6.30
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.
2rgj FLAVIN-CONTAINING
MONOOXYGENASE

(Pseudomonas
aeruginosa) 		PF01494
(FAD_binding_3) 		3 ARG A 255
ASP A 261
ASP A 248
 None
 0.67A 3jayA-2rgjA:
undetectable		 3jayA-2rgjA:
17.70
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.
2ro1 TRANSCRIPTION
INTERMEDIARY FACTOR
1-BETA

(Homo sapiens) 		PF00628
(PHD) 		3 ARG A 767
ASP A 739
ASP A 764
 None
 0.67A 3jayA-2ro1A:
undetectable		 3jayA-2ro1A:
10.34
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.
2v7z HEAT SHOCK COGNATE
71 KDA PROTEIN

(Rattus
norvegicus) 		PF00012
(HSP70) 		3 ARG A  72
ASP A  80
ASP A  86
 None
 0.73A 3jayA-2v7zA:
undetectable		 3jayA-2v7zA:
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.
2wan PULLULANASE

(Bacillus
acidopullulyticus) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		3 ARG A 330
ASP A 605
ASP A 317
 None
 0.79A 3jayA-2wanA:
undetectable		 3jayA-2wanA:
21.69
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.
2ylz PHENYLACETONE
MONOOXYGENASE

(Thermobifida
fusca) 		PF13738
(Pyr_redox_3) 		3 ARG A 525
ASP A 459
ASP A 529
 None
 0.90A 3jayA-2ylzA:
undetectable		 3jayA-2ylzA:
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.
2yyb HYPOTHETICAL PROTEIN
TTHA1606

(Thermus
thermophilus) 		PF01784
(NIF3) 		3 ARG A   3
ASP A  11
ASP A   4
 None
 0.87A 3jayA-2yybA:
undetectable		 3jayA-2yybA:
12.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zf5 GLYCEROL KINASE

(Thermococcus
kodakarensis) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		3 ARG O  82
ASP O 236
ASP O 239
 None
 0.85A 3jayA-2zf5O:
undetectable		 3jayA-2zf5O:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a0x SENSOR PROTEIN

(Thermotoga
maritima) 		PF02518
(HATPase_c) 		3 ARG A 643
ASP A 678
ASP A 641
 None
 0.83A 3jayA-3a0xA:
undetectable		 3jayA-3a0xA:
9.63
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.
3act CELLOBIOSE
PHOSPHORYLASE

(Cellulomonas
gilvus) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		3 ARG A   2
ASP A 701
ASP A 698
 None
 0.90A 3jayA-3actA:
undetectable		 3jayA-3actA:
23.35
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.
3beo UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Bacillus
anthracis) 		PF02350
(Epimerase_2) 		3 ARG A  69
ASP A  74
ASP A  68
 None
None
UD1  A 372 (-4.7A)
 0.70A 3jayA-3beoA:
undetectable		 3jayA-3beoA:
17.46
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.
3d3r HYDROGENASE ASSEMBLY
CHAPERONE HYPC/HUPF

(Shewanella
oneidensis) 		PF01455
(HupF_HypC) 		3 ARG A  16
ASP A  29
ASP A  13
 None
 0.66A 3jayA-3d3rA:
undetectable		 3jayA-3d3rA:
6.52
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.
3dlj BETA-ALA-HIS
DIPEPTIDASE

(Homo sapiens) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		3 ARG A 342
ASP A 233
ASP A 231
 None
None
UNX  A2010 ( 4.8A)
 0.69A 3jayA-3dljA:
undetectable		 3jayA-3dljA:
17.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eex OUTER SURFACE
PROTEIN A

(Borreliella
burgdorferi) 		PF00820
(Lipoprotein_1) 		3 ARG A 208
ASP A 187
ASP A 210
 None
 0.86A 3jayA-3eexA:
undetectable		 3jayA-3eexA:
14.50
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.
3f2v GENERAL STRESS
PROTEIN 14

(Treponema
denticola) 		PF02525
(Flavodoxin_2) 		3 ARG A 145
ASP A  60
ASP A 143
 None
 0.74A 3jayA-3f2vA:
undetectable		 3jayA-3f2vA:
11.24
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.
3h2u RAVER-1

(Homo sapiens) 		PF00076
(RRM_1) 		3 ARG B 227
ASP B 283
ASP B 226
 None
 0.90A 3jayA-3h2uB:
undetectable		 3jayA-3h2uB:
12.92
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.
3k0s DNA MISMATCH REPAIR
PROTEIN MUTS

(Escherichia
coli) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		3 ARG A 350
ASP A 364
ASP A 347
 None
 0.73A 3jayA-3k0sA:
3.6		 3jayA-3k0sA:
23.49
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.
3mam OSMOPROTECTION
PROTEIN (PROX)

(Archaeoglobus
fulgidus) 		PF04069
(OpuAC) 		3 ARG A 108
ASP A 239
ASP A 215
 None
 0.90A 3jayA-3mamA:
undetectable		 3jayA-3mamA:
14.00
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.
3mez MANNOSE-SPECIFIC
LECTIN 3 CHAIN 2

(Crocus vernus) 		PF01453
(B_lectin) 		3 ARG B  31
ASP B  17
ASP B  33
 None
 0.81A 3jayA-3mezB:
undetectable		 3jayA-3mezB:
7.74
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.
3ml0 PENICILLIN G
ACYLASE, ALPHA
SUBUNIT
PENICILLIN G
ACYLASE, BETA
SUBUNIT

(Alcaligenes
faecalis;
Alcaligenes
faecalis) 		PF01804
(Penicil_amidase)
PF01804
(Penicil_amidase) 		3 ARG B 141
ASP B  73
ASP A 149
 None
CA  B 552 (-2.7A)
None
 0.80A 3jayA-3ml0B:
undetectable		 3jayA-3ml0B:
19.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n7k BOTULINUM NEUROTOXIN
TYPE C1

(Clostridium
botulinum) 		PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N) 		3 ARG A1161
ASP A1166
ASP A1159
 None
 0.83A 3jayA-3n7kA:
undetectable		 3jayA-3n7kA:
16.51
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.
3net HISTIDYL-TRNA
SYNTHETASE

(Nostoc sp. PCC
7120) 		PF03129
(HGTP_anticodon)
PF13393
(tRNA-synt_His) 		3 ARG A 420
ASP A 415
ASP A 439
 None
 0.67A 3jayA-3netA:
undetectable		 3jayA-3netA:
18.10
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.
3or5 THIOL:DISULFIDE
INTERCHANGE PROTEIN,
THIOREDOXIN FAMILY
PROTEIN

(Chlorobaculum
tepidum) 		PF08534
(Redoxin) 		3 ARG A 158
ASP A  76
ASP A 162
 None
 0.90A 3jayA-3or5A:
undetectable		 3jayA-3or5A:
9.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r79 UNCHARACTERIZED
PROTEIN

(Agrobacterium
fabrum) 		PF01168
(Ala_racemase_N) 		3 ARG A  52
ASP A  97
ASP A  75
 None
 0.84A 3jayA-3r79A:
undetectable		 3jayA-3r79A:
12.52
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.
3ry7 RIBOKINASE

(Staphylococcus
aureus) 		PF00294
(PfkB) 		3 ARG A 263
ASP A 269
ASP A 273
 None
 0.78A 3jayA-3ry7A:
2.7		 3jayA-3ry7A:
15.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tsc PUTATIVE
OXIDOREDUCTASE

(Mycobacterium
avium) 		PF13561
(adh_short_C2) 		3 ARG A 148
ASP A 254
ASP A  99
 None
 0.73A 3jayA-3tscA:
undetectable		 3jayA-3tscA:
14.97
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.
3ufb TYPE I
RESTRICTION-MODIFICA
TION SYSTEM
METHYLTRANSFERASE
SUBUNIT

(Vibrio
vulnificus) 		PF02384
(N6_Mtase)
PF12161
(HsdM_N) 		3 ARG A 150
ASP A  36
ASP A  44
 None
 0.72A 3jayA-3ufbA:
7.4		 3jayA-3ufbA:
19.45
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.
3ufg GLYCYL-TRNA
SYNTHETASE ALPHA
SUBUNIT

(Campylobacter
jejuni) 		PF02091
(tRNA-synt_2e) 		3 ARG A  58
ASP A 251
ASP A  61
 ATP  A 288 (-2.9A)
None
ATP  A 288 (-3.7A)
 0.80A 3jayA-3ufgA:
undetectable		 3jayA-3ufgA:
15.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ulx STRESS-INDUCED
TRANSCRIPTION FACTOR
NAC1

(Oryza sativa) 		PF02365
(NAM) 		3 ARG A  76
ASP A 157
ASP A  77
 None
 0.79A 3jayA-3ulxA:
undetectable		 3jayA-3ulxA:
9.68
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.
4as5 INOSITOL
MONOPHOSPHATASE 1

(Mus musculus) 		PF00459
(Inositol_P) 		3 ARG A 248
ASP A 244
ASP A 274
 None
 0.89A 3jayA-4as5A:
undetectable		 3jayA-4as5A:
12.62
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.
4c3h DNA-DIRECTED RNA
POLYMERASE I SUBUNIT
RPA190

(Saccharomyces
cerevisiae) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		3 ARG A1295
ASP A1298
ASP A1268
 None
 0.86A 3jayA-4c3hA:
undetectable		 3jayA-4c3hA:
21.27
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.
4i9f GLYCEROL 3-PHOSPHATE
PHOSPHATASE

(Mycobacterium
tuberculosis) 		PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6) 		3 ARG A 210
ASP A 237
ASP A 212
 None
 0.75A 3jayA-4i9fA:
1.8		 3jayA-4i9fA:
16.06
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.
4j7q PHOSPHATIDYLINOSITOL
TRANSFER PROTEIN
PDR16

(Saccharomyces
cerevisiae) 		PF00650
(CRAL_TRIO)
PF03765
(CRAL_TRIO_N) 		3 ARG A 309
ASP A 186
ASP A 313
 None
 0.78A 3jayA-4j7qA:
undetectable		 3jayA-4j7qA:
16.00
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.
4j8f HEAT SHOCK 70 KDA
PROTEIN 1A/1B,
HSC70-INTERACTING
PROTEIN

(Homo sapiens;
Rattus
norvegicus) 		PF00012
(HSP70) 		3 ARG A  72
ASP A  80
ASP A  86
 None
 0.88A 3jayA-4j8fA:
undetectable		 3jayA-4j8fA:
19.55
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.
4lq1 1,4-ALPHA-GLUCAN
BRANCHING ENZYME
GLGB

(Escherichia
coli) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C)
PF02922
(CBM_48) 		3 ARG A 315
ASP A 323
ASP A 316
 None
 0.76A 3jayA-4lq1A:
undetectable		 3jayA-4lq1A:
18.40
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.
4nv0 7-METHYLGUANOSINE
PHOSPHATE-SPECIFIC
5'-NUCLEOTIDASE

(Drosophila
melanogaster) 		PF05822
(UMPH-1) 		3 ARG A  64
ASP A 270
ASP A 289
 None
 0.89A 3jayA-4nv0A:
undetectable		 3jayA-4nv0A:
15.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ow2 YOP EFFECTOR YOPM

(Yersinia
enterocolitica) 		PF12468
(TTSSLRR) 		3 ARG A 402
ASP A 419
ASP A 422
 None
 0.83A 3jayA-4ow2A:
undetectable		 3jayA-4ow2A:
17.13
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.
4oxc E3 UBIQUITIN-PROTEIN
LIGASE XIAP

(Homo sapiens) 		PF00653
(BIR) 		3 ARG A  72
ASP A  77
ASP A  71
 None
 0.77A 3jayA-4oxcA:
undetectable		 3jayA-4oxcA:
7.32
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.
4ozy POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE

(Pseudomonas
syringae group
genomosp. 3) 		PF13229
(Beta_helix) 		3 ARG A 369
ASP A 317
ASP A 368
 None
 0.81A 3jayA-4ozyA:
undetectable		 3jayA-4ozyA:
17.04
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.
4pht GENERAL SECRETORY
PATHWAY PROTEIN E
TYPE II SECRETION
SYSTEM PROTEIN L

(Vibrio
vulnificus;
Vibrio
vulnificus) 		PF00437
(T2SSE)
PF05134
(T2SSL) 		3 ARG X 116
ASP X 123
ASP A 289
 None
 0.80A 3jayA-4phtX:
2.0		 3jayA-4phtX:
12.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pmd ENDO-1,4-BETA-XYLANA
SE

(Caldicellulosiruptor
bescii) 		PF00331
(Glyco_hydro_10) 		3 ARG A 259
ASP A 316
ASP A 257
 None
 0.73A 3jayA-4pmdA:
undetectable		 3jayA-4pmdA:
16.02
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.
4u3a ENDOGLUCANASE H

(Ruminiclostridium
thermocellum) 		PF00150
(Cellulase) 		3 ARG A 340
ASP A 304
ASP A 297
 None
 0.89A 3jayA-4u3aA:
undetectable		 3jayA-4u3aA:
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.
4uym 14-ALPHA STEROL
DEMETHYLASE

(Aspergillus
fumigatus) 		PF00067
(p450) 		3 ARG A 160
ASP A 273
ASP A 157
 None
 0.65A 3jayA-4uymA:
undetectable		 3jayA-4uymA:
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.
4wgx MOLINATE HYDROLASE

(Gulosibacter
molinativorax) 		PF01979
(Amidohydro_1) 		3 ARG A 183
ASP A 174
ASP A 153
 None
 0.78A 3jayA-4wgxA:
undetectable		 3jayA-4wgxA:
19.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yai C
ALPHA-DEHYDROGENASE

(Sphingobium sp.
SYK-6) 		PF00106
(adh_short) 		3 ARG A 135
ASP A   2
ASP A  86
 None
 0.87A 3jayA-4yaiA:
undetectable		 3jayA-4yaiA:
13.60
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.
5bp1 MYCOCEROSIC ACID
SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		3 ARG A 599
ASP A 729
ASP A 598
 None
 0.88A 3jayA-5bp1A:
2.7		 3jayA-5bp1A:
22.60
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.
5cb7 OUTER CAPSID PROTEIN
VP4

(Rotavirus A) 		no annotation 3 ARG A 170
ASP A 195
ASP A 171
 None
 0.82A 3jayA-5cb7A:
undetectable		 3jayA-5cb7A:
10.77
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.
5ce9 POLYPHENOL OXIDASE

(Juglans regia) 		PF00264
(Tyrosinase)
PF12142
(PPO1_DWL) 		3 ARG A 314
ASP A 319
ASP A  35
 None
 0.89A 3jayA-5ce9A:
undetectable		 3jayA-5ce9A:
15.41
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.
5cgz 4-OXALMESACONATE
HYDRATASE

(Pseudomonas
putida) 		PF02585
(PIG-L) 		3 ARG A  46
ASP A  86
ASP A  89
 None
GOL  A 308 (-3.3A)
None
 0.88A 3jayA-5cgzA:
2.7		 3jayA-5cgzA:
12.52
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.
5dan 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE

(Thermotoga
maritima) 		PF00248
(Aldo_ket_red) 		3 ARG A 151
ASP A 168
ASP A 182
 None
 0.73A 3jayA-5danA:
undetectable		 3jayA-5danA:
13.89
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.
5dux GALECTIN-4

(Homo sapiens) 		no annotation 3 ARG B  67
ASP B 141
ASP B  69
 LAT  B 201 (-2.6A)
None
None
 0.73A 3jayA-5duxB:
undetectable		 3jayA-5duxB:
9.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ggg PROTEIN
O-LINKED-MANNOSE
BETA-1,2-N-ACETYLGLU
COSAMINYLTRANSFERASE
1

(Homo sapiens) 		PF03071
(GNT-I)
PF15711
(ILEI) 		3 ARG A 129
ASP A 122
ASP A 179
 None
 0.73A 3jayA-5gggA:
undetectable		 3jayA-5gggA:
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.
5ggk PROTEIN
O-LINKED-MANNOSE
BETA-1,2-N-ACETYLGLU
COSAMINYLTRANSFERASE
1

(Homo sapiens) 		PF15711
(ILEI) 		3 ARG A 129
ASP A 122
ASP A 179
 EDO  A 305 ( 3.6A)
None
MBE  A 301 ( 3.0A)
 0.76A 3jayA-5ggkA:
undetectable		 3jayA-5ggkA:
10.26
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.
5gju ATP-DEPENDENT RNA
HELICASE DEAD

(Escherichia
coli) 		PF00270
(DEAD) 		3 ARG A 135
ASP A 169
ASP A 138
 None
 0.86A 3jayA-5gjuA:
undetectable		 3jayA-5gjuA:
11.17
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.
5hcd RHIPICEPHALUS
MICROPLUS RACI2

(Rhipicephalus
microplus) 		no annotation 3 ARG D  29
ASP D  24
ASP D  49
 None
 0.88A 3jayA-5hcdD:
undetectable		 3jayA-5hcdD:
6.45
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.
5hqb ALPHA-GLUCOSIDASE

(Pseudoalteromonas
sp. K8) 		PF10566
(Glyco_hydro_97)
PF14508
(GH97_N)
PF14509
(GH97_C) 		3 ARG A 594
ASP A 597
ASP A 572
 None
 0.76A 3jayA-5hqbA:
undetectable		 3jayA-5hqbA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ijg CYS/MET METABOLISM
PYRIDOXAL-PHOSPHATE-
DEPENDENT ENZYME

(Brucella
melitensis) 		PF01053
(Cys_Met_Meta_PP) 		3 ARG A 326
ASP A 328
ASP A 324
 None
 0.84A 3jayA-5ijgA:
3.3		 3jayA-5ijgA:
18.32
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.
5ivl DEAD-BOX
ATP-DEPENDENT RNA
HELICASE CSHA

(Geobacillus
stearothermophilus) 		no annotation 3 ARG B 130
ASP B 164
ASP B 133
 None
 0.83A 3jayA-5ivlB:
2.0		 3jayA-5ivlB:
16.92
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.
5jju UNCHARACTERIZED
PROTEIN RV2837C

(Mycobacterium
tuberculosis) 		PF01368
(DHH)
PF02272
(DHHA1) 		3 ARG A 112
ASP A 136
ASP A 111
 A  C1003 ( 3.4A)
None
None
 0.86A 3jayA-5jjuA:
undetectable		 3jayA-5jjuA:
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.
5jxu DYP-TYPE PEROXIDASE
FAMILY

(Thermomonospora
curvata) 		PF04261
(Dyp_perox) 		3 ARG A  97
ASP A 185
ASP A  93
 None
 0.84A 3jayA-5jxuA:
undetectable		 3jayA-5jxuA:
16.97
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.
5kd0 AROMATIC
PRENYLTRANSFERASE

(Aspergillus
terreus) 		PF11991
(Trp_DMAT) 		3 ARG A 104
ASP A 182
ASP A 179
 GST  A 502 ( 3.4A)
None
GST  A 502 ( 4.4A)
 0.72A 3jayA-5kd0A:
undetectable		 3jayA-5kd0A:
17.73
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.
5mqm GLYCOSYL HYDROLASES
FAMILY 2, SUGAR
BINDING DOMAIN

(Bacteroides
thetaiotaomicron) 		PF17132
(Glyco_hydro_106) 		3 ARG A 637
ASP A 653
ASP A 636
 None
 0.85A 3jayA-5mqmA:
undetectable		 3jayA-5mqmA:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mzn HELICASE
SEN1,HELICASE SEN1

(Saccharomyces
cerevisiae) 		PF13086
(AAA_11)
PF13087
(AAA_12) 		3 ARG A1841
ASP A1849
ASP A1842
 None
GOL  A2049 ( 4.6A)
None
 0.62A 3jayA-5mznA:
undetectable		 3jayA-5mznA:
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.
5ols RHAMNOGALACTURONAN
LYASE

(Bacteroides
thetaiotaomicron) 		no annotation 3 ARG A 174
ASP A 177
ASP A 142
 None
 0.76A 3jayA-5olsA:
undetectable		 3jayA-5olsA:
19.59
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.
5op0 DNA POLYMERASE LIGD,
POLYMERASE DOMAIN

(Mycolicibacterium
smegmatis) 		no annotation 3 ARG B  55
ASP B 135
ASP B  56
 None
 0.90A 3jayA-5op0B:
undetectable		 3jayA-5op0B:
16.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5oyd CELLULASE, PUTATIVE,
CEL5D

(Cellvibrio
japonicus) 		no annotation 3 ARG A 425
ASP A 381
ASP A 373
 None
 0.62A 3jayA-5oydA:
undetectable		 3jayA-5oydA:
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.
5v2d DIOXYGENASE

(Pseudomonas
brassicacearum) 		no annotation 3 ARG A 454
ASP A 405
ASP A 452
 None
 0.84A 3jayA-5v2dA:
undetectable		 3jayA-5v2dA:
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.
5w4a P-GRANULE SCAFFOLD

(Caenorhabditis
japonica) 		no annotation 3 ARG A 194
ASP A 202
ASP A 195
 None
 0.89A 3jayA-5w4aA:
undetectable		 3jayA-5w4aA:
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.
5wm9 RV0078

(Mycobacterium
tuberculosis) 		no annotation 3 ARG A 192
ASP A  91
ASP A 196
 ARG  A 192 ( 0.6A)
ASP  A  91 ( 0.6A)
ASP  A 196 ( 0.6A)
 0.90A 3jayA-5wm9A:
undetectable		 3jayA-5wm9A:
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.
5x6a ENDOGLUCANASE,
PUTATIVE

(Aspergillus
fumigatus) 		no annotation 3 ARG A  58
ASP A  45
ASP A  53
 None
 0.68A 3jayA-5x6aA:
undetectable		 3jayA-5x6aA:
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.
5x9w DNA MISMATCH REPAIR
PROTEIN MUTS

(Neisseria
gonorrhoeae) 		no annotation 3 ARG A 346
ASP A 360
ASP A 343
 None
 0.88A 3jayA-5x9wA:
undetectable		 3jayA-5x9wA:
23.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xjv DUAL SPECIFICITY
PROTEIN PHOSPHATASE
13 ISOFORM A

(Homo sapiens) 		no annotation 3 ARG A  37
ASP A  39
ASP A  49
 None
 0.89A 3jayA-5xjvA:
undetectable		 3jayA-5xjvA:
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.
5xox TRNA(HIS)
GUANYLYLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF04446
(Thg1)
PF14413
(Thg1C) 		3 ARG A 133
ASP A  77
ASP A 131
 None
GTP  A 301 (-2.4A)
None
 0.67A 3jayA-5xoxA:
undetectable		 3jayA-5xoxA:
12.21
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.
5xyf TERF1-INTERACTING
NUCLEAR FACTOR 2

(Homo sapiens) 		no annotation 3 ARG A  52
ASP A  96
ASP A 103
 None
 0.68A 3jayA-5xyfA:
undetectable		 3jayA-5xyfA:
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.
5y3x BETA-XYLANASE

(Caldicellulosiruptor
owensensis) 		no annotation 3 ARG A 259
ASP A 316
ASP A 257
 None
 0.71A 3jayA-5y3xA:
undetectable		 3jayA-5y3xA:
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.
6c1q SOLUBLE CYTOCHROME
B562, C5A
ANAPHYLATOXIN
CHEMOTACTIC RECEPTOR
1 CHIMERA

(Escherichia
coli;
Homo sapiens) 		no annotation 3 ARG B 284
ASP B 277
ASP B 281
 None
 0.86A 3jayA-6c1qB:
undetectable		 3jayA-6c1qB:
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.
6cfw MEMBRANE-BOUND
HYDROGENASE SUBUNIT
ALPHA

(Pyrococcus
furiosus) 		no annotation 3 ARG L 201
ASP L 263
ASP L 202
 None
 0.88A 3jayA-6cfwL:
undetectable		 3jayA-6cfwL:
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.
6fnw VOLUME-REGULATED
ANION CHANNEL
SUBUNIT LRRC8A

(Mus musculus) 		no annotation 3 ARG A 600
ASP A 620
ASP A 623
 None
 0.85A 3jayA-6fnwA:
undetectable		 3jayA-6fnwA:
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.
6g72 NADH DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR PROTEIN
7, MITOCHONDRIAL
NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
1

(Mus musculus;
Mus musculus) 		no annotation
no annotation 		3 ARG B  51
ASP H  51
ASP B  94
 None
 0.88A 3jayA-6g72B:
undetectable		 3jayA-6g72B:
undetectable