SIMILAR PATTERNS OF AMINO ACIDS FOR 4N49_A_SAMA601

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.
1eiz FTSJ

(Escherichia
coli) 		PF01728
(FtsJ) 		5 ALA A  35
PRO A  62
GLY A  63
LEU A  84
LEU A 143
 SAM  A 301 (-3.3A)
SAM  A 301 (-3.4A)
SAM  A 301 (-3.9A)
SAM  A 301 (-4.2A)
SAM  A 301 (-4.6A)
 0.61A 4n49A-1eizA:
17.8		 4n49A-1eizA:
17.84
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.
1gz4 NAD-DEPENDENT MALIC
ENZYME

(Homo sapiens) 		PF00390
(malic)
PF03949
(Malic_M) 		5 GLY A 465
GLY A 463
PHE A 443
ASN A 466
ILE A 319
 None
None
None
TTN  A 603 (-2.8A)
None
 1.03A 4n49A-1gz4A:
4.0		 4n49A-1gz4A:
21.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1k6d ACETATE
COA-TRANSFERASE
ALPHA SUBUNIT

(Escherichia
coli) 		PF01144
(CoA_trans) 		5 GLY A  25
GLY A  30
ASN A  52
ILE A  21
THR A  20
 None
 1.00A 4n49A-1k6dA:
undetectable		 4n49A-1k6dA:
20.70
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.
1kzh PHOSPHOFRUCTOKINASE

(Borreliella
burgdorferi) 		PF00365
(PFK) 		6 GLY A 113
PRO A 114
GLY A 145
PHE A 139
ILE A 123
LEU A 125
 None
 1.32A 4n49A-1kzhA:
undetectable		 4n49A-1kzhA:
23.25
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.
1m66 GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Leishmania
mexicana) 		PF01210
(NAD_Gly3P_dh_N)
PF07479
(NAD_Gly3P_dh_C) 		5 ALA A 152
GLY A 202
THR A 245
LEU A 248
LEU A 308
 None
 0.98A 4n49A-1m66A:
undetectable		 4n49A-1m66A:
23.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mio NITROGENASE
MOLYBDENUM IRON
PROTEIN (BETA CHAIN)

(Clostridium
pasteurianum) 		PF00148
(Oxidored_nitro) 		5 ALA B 245
GLY B 149
PHE B 150
THR B 137
ILE B 135
 None
 0.95A 4n49A-1mioB:
undetectable		 4n49A-1mioB:
22.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nsl PROBABLE
ACETYLTRANSFERASE

(Bacillus
subtilis) 		PF13302
(Acetyltransf_3) 		5 ALA A 134
PRO A 145
THR A 111
ILE A 109
LEU A  72
 None
None
CL  A 184 (-4.6A)
None
None
 1.01A 4n49A-1nslA:
undetectable		 4n49A-1nslA:
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.
1qu5 PROTEIN KINASE SPK1

(Saccharomyces
cerevisiae) 		PF00498
(FHA) 		5 CYH A 623
GLY A 653
LEU A 618
ASN A 655
ILE A 603
 None
 0.81A 4n49A-1qu5A:
undetectable		 4n49A-1qu5A:
17.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1s16 TOPOISOMERASE IV
SUBUNIT B

(Escherichia
coli) 		PF00204
(DNA_gyraseB)
PF02518
(HATPase_c) 		5 ALA A1140
GLY A1144
ASN A1143
THR A1027
LEU A1035
 None
 0.97A 4n49A-1s16A:
undetectable		 4n49A-1s16A:
22.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tqy ACTINORHODIN
POLYKETIDE PUTATIVE
BETA-KETOACYL
SYNTHASE 2

(Streptomyces
coelicolor) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 ALA B 103
GLY B 338
PRO B 339
GLY B 336
LEU B 387
 None
 1.02A 4n49A-1tqyB:
undetectable		 4n49A-1tqyB:
23.25
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.
1zel HYPOTHETICAL PROTEIN
RV2827C

(Mycobacterium
tuberculosis) 		PF09407
(AbiEi_1)
PF13338
(AbiEi_4) 		5 ALA A 172
GLY A 179
PRO A 156
ILE A 187
LEU A 200
 None
 0.87A 4n49A-1zelA:
undetectable		 4n49A-1zelA:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bcc UBIQUINOL CYTOCHROME
C OXIDOREDUCTASE

(Gallus gallus) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		5 GLY A 259
PRO A 260
GLY A 261
THR A 156
LEU A 153
 None
 0.91A 4n49A-2bccA:
undetectable		 4n49A-2bccA:
23.24
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.
2bde CYTOSOLIC IMP-GMP
SPECIFIC
5'-NUCLEOTIDASE

(Legionella
pneumophila) 		PF05761
(5_nucleotid) 		5 ALA A 427
GLY A 302
THR A  27
LEU A  28
LEU A 438
 None
 0.99A 4n49A-2bdeA:
undetectable		 4n49A-2bdeA:
20.52
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.
2e3u HYPOTHETICAL PROTEIN
PH1566

(Pyrococcus
horikoshii) 		PF00013
(KH_1) 		5 ALA A 170
GLY A 101
GLY A 103
PHE A 104
ILE A  59
 None
 1.01A 4n49A-2e3uA:
undetectable		 4n49A-2e3uA:
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.
2f2b AQUAPORIN AQPM

(Methanothermobacter
marburgensis) 		PF00230
(MIP) 		5 ALA A 111
GLY A  14
ILE A 161
THR A 160
LEU A 157
 None
None
None
None
GOL  A 501 (-4.8A)
 0.95A 4n49A-2f2bA:
undetectable		 4n49A-2f2bA:
20.14
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.
2fpg SUCCINYL-COA LIGASE
[GDP-FORMING]
ALPHA-CHAIN,
MITOCHONDRIAL
SUCCINYL-COA LIGASE
[GDP-FORMING]
BETA-CHAIN,
MITOCHONDRIAL

(Sus scrofa;
Sus scrofa) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding)
PF00549
(Ligase_CoA)
PF08442
(ATP-grasp_2) 		5 GLY B 272
GLY B 297
THR A 164
LEU A 165
LEU B 381
 PO4  A 401 (-3.3A)
None
PO4  A 401 (-3.1A)
None
None
 1.00A 4n49A-2fpgB:
undetectable		 4n49A-2fpgB:
21.68
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.
2hsz NOVEL PREDICTED
PHOSPHATASE

(Histophilus
somni) 		PF13419
(HAD_2) 		5 GLY A 175
GLY A 193
PHE A 213
THR A  14
LEU A 104
 None
 0.86A 4n49A-2hszA:
2.1		 4n49A-2hszA:
20.05
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.
2i9k MODIFICATION
METHYLASE HHAI

(Haemophilus
haemolyticus) 		PF00145
(DNA_methylase) 		5 GLY A  20
GLY A  22
PHE A  24
ILE A  61
THR A  62
 SAH  A 328 (-3.3A)
None
SAH  A 328 (-4.8A)
SAH  A 328 (-4.3A)
SAH  A 328 ( 4.3A)
 0.64A 4n49A-2i9kA:
6.9		 4n49A-2i9kA:
20.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i9k MODIFICATION
METHYLASE HHAI

(Haemophilus
haemolyticus) 		PF00145
(DNA_methylase) 		5 GLY A  22
PHE A  24
ILE A  61
THR A  62
LEU A 100
 None
SAH  A 328 (-4.8A)
SAH  A 328 (-4.3A)
SAH  A 328 ( 4.3A)
SAH  A 328 ( 4.9A)
 0.77A 4n49A-2i9kA:
6.9		 4n49A-2i9kA:
20.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ii1 ACETAMIDASE

(Bacillus
halodurans) 		PF03069
(FmdA_AmdA) 		6 GLY A 153
PRO A 148
GLY A 149
ASN A 154
ILE A  10
THR A   9
 None
None
None
CA  A 400 (-2.8A)
None
None
 1.37A 4n49A-2ii1A:
undetectable		 4n49A-2ii1A:
20.79
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.
2iuy GLYCOSYLTRANSFERASE

(Streptomyces
viridochromogenes) 		PF00534
(Glycos_transf_1) 		5 GLY A  64
GLY A  81
LEU A  18
ASN A  20
LEU A  75
 None
 0.88A 4n49A-2iuyA:
2.7		 4n49A-2iuyA:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nyu PUTATIVE RIBOSOMAL
RNA
METHYLTRANSFERASE 2

(Homo sapiens) 		PF01728
(FtsJ) 		5 PRO A  33
GLY A  34
LEU A  63
THR A  81
LEU A 123
 SAM  A 201 (-3.4A)
SAM  A 201 (-3.7A)
SAM  A 201 (-4.2A)
SAM  A 201 ( 4.1A)
None
 0.69A 4n49A-2nyuA:
15.2		 4n49A-2nyuA:
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.
2og9 MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Polaromonas sp.
JS666) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ALA A  48
GLY A  75
PRO A  74
GLY A  72
ILE A  83
 None
 1.01A 4n49A-2og9A:
undetectable		 4n49A-2og9A:
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.
2oxt NUCLEOSIDE-2'-O-METH
YLTRANSFERASE

(Meaban virus) 		PF01728
(FtsJ) 		5 GLY A  84
GLY A  86
THR A 105
LEU A 106
ILE A 133
 SAM  A 300 (-3.5A)
SAM  A 300 ( 4.6A)
SAM  A 300 (-4.6A)
SAM  A 300 (-4.2A)
SAM  A 300 (-3.8A)
 0.81A 4n49A-2oxtA:
16.5		 4n49A-2oxtA:
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.
2p4q 6-PHOSPHOGLUCONATE
DEHYDROGENASE,
DECARBOXYLATING 1

(Saccharomyces
cerevisiae) 		PF00393
(6PGD)
PF03446
(NAD_binding_2) 		5 GLY A 187
GLY A 191
THR A 265
ASN A 186
ILE A 267
 None
None
None
FLC  A 502 (-2.6A)
None
 0.97A 4n49A-2p4qA:
3.1		 4n49A-2p4qA:
22.12
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.
2rgj FLAVIN-CONTAINING
MONOOXYGENASE

(Pseudomonas
aeruginosa) 		PF01494
(FAD_binding_3) 		5 ALA A  68
GLY A  63
PRO A  64
LEU A  60
ILE A 327
 None
 0.99A 4n49A-2rgjA:
undetectable		 4n49A-2rgjA:
22.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v4j SULFITE REDUCTASE,
DISSIMILATORY-TYPE
SUBUNIT ALPHA
SULFITE REDUCTASE,
DISSIMILATORY-TYPE
SUBUNIT BETA

(Desulfovibrio
vulgaris;
Desulfovibrio
vulgaris) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr)
PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		5 GLY B 160
PRO B 161
LEU A   9
ILE A  24
LEU A  50
 None
 1.00A 4n49A-2v4jB:
undetectable		 4n49A-2v4jB:
19.46
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.
2w1q HYALURONOGLUCOSAMINI
DASE

(Clostridium
perfringens) 		PF00754
(F5_F8_type_C) 		5 GLY A 874
GLY A 872
THR A 937
LEU A 936
ILE A 868
 None
 0.94A 4n49A-2w1qA:
undetectable		 4n49A-2w1qA:
19.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w1q HYALURONOGLUCOSAMINI
DASE

(Clostridium
perfringens) 		PF00754
(F5_F8_type_C) 		5 GLY A 874
GLY A 873
THR A 937
LEU A 936
ILE A 868
 None
 0.95A 4n49A-2w1qA:
undetectable		 4n49A-2w1qA:
19.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wa2 NON-STRUCTURAL
PROTEIN 5

(Modoc virus) 		PF01728
(FtsJ) 		5 GLY A  84
GLY A  86
THR A 105
LEU A 106
THR A 134
 SAM  A1248 (-3.4A)
SAM  A1248 (-4.4A)
SAM  A1248 (-4.5A)
SAM  A1248 (-4.1A)
SAM  A1248 (-3.8A)
 0.75A 4n49A-2wa2A:
16.2		 4n49A-2wa2A:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yr0 HYPOTHETICAL PROTEIN
TTHA0223

(Thermus
thermophilus) 		PF08241
(Methyltransf_11) 		5 ALA A  54
GLY A  47
GLY A  49
PHE A  77
LEU A 100
 None
 1.01A 4n49A-2yr0A:
8.0		 4n49A-2yr0A:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ahi XYLULOSE
5-PHOSPHATE/FRUCTOSE
6-PHOSPHATE
PHOSPHOKETOLASE

(Bifidobacterium
breve) 		PF03894
(XFP)
PF09363
(XFP_C)
PF09364
(XFP_N) 		5 GLY A  94
PRO A  95
GLY A  96
PHE A 143
LEU A 161
 None
HTL  A 827 ( 4.7A)
None
None
None
 0.99A 4n49A-3ahiA:
2.3		 4n49A-3ahiA:
19.50
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.
3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE

(Bifidobacterium
longum) 		PF03894
(XFP)
PF09363
(XFP_C)
PF09364
(XFP_N) 		5 GLY A  94
PRO A  95
GLY A  96
PHE A 143
LEU A 161
 None
TPP  A 900 ( 4.6A)
None
None
None
 0.95A 4n49A-3ai7A:
undetectable		 4n49A-3ai7A:
19.64
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.
3cij UPF0100 PROTEIN
AF_0094

(Archaeoglobus
fulgidus) 		PF13531
(SBP_bac_11) 		5 PRO A 150
GLY A 156
ASN A 151
ILE A  74
THR A  78
 None
 0.98A 4n49A-3cijA:
undetectable		 4n49A-3cijA:
22.22
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.
3d5l REGULATORY PROTEIN
RECX

(Lactobacillus
reuteri) 		PF02631
(RecX) 		5 GLY A 126
PRO A 127
GLY A 128
LEU A 124
LEU A 167
 None
 0.89A 4n49A-3d5lA:
undetectable		 4n49A-3d5lA:
18.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dou RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE J

(Thermoplasma
volcanium) 		PF01728
(FtsJ) 		5 ALA A  22
PRO A  49
GLY A  50
LEU A  68
ILE A  84
 SAM  A   1 (-3.3A)
SAM  A   1 (-3.5A)
SAM  A   1 (-3.8A)
SAM  A   1 (-4.2A)
SAM  A   1 (-3.9A)
 0.63A 4n49A-3douA:
16.0		 4n49A-3douA:
19.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3elu METHYLTRANSFERASE

(Wesselsbron
virus) 		PF00972
(Flavi_NS5)
PF01728
(FtsJ) 		5 GLY A  83
GLY A  85
THR A 104
LEU A 105
THR A 134
 SAM  A4633 (-3.4A)
SAM  A4633 ( 4.3A)
SAM  A4633 (-4.5A)
SAM  A4633 (-4.1A)
None
 0.93A 4n49A-3eluA:
16.0		 4n49A-3eluA:
22.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3evc RNA-DIRECTED RNA
POLYMERASE NS5

(Yellow fever
virus) 		PF01728
(FtsJ) 		5 GLY A  83
GLY A  85
THR A 104
LEU A 105
ILE A 132
 SAH  A 901 (-3.3A)
SAH  A 901 ( 4.4A)
SAH  A 901 (-4.5A)
SAH  A 901 (-4.0A)
SAH  A 901 (-3.8A)
 0.63A 4n49A-3evcA:
15.3		 4n49A-3evcA:
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.
3fv5 DNA TOPOISOMERASE 4
SUBUNIT B

(Escherichia
coli) 		PF02518
(HATPase_c) 		5 ALA A 140
GLY A 144
ASN A 143
THR A  27
LEU A  35
 None
 1.01A 4n49A-3fv5A:
undetectable		 4n49A-3fv5A:
19.63
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.
3ghy KETOPANTOATE
REDUCTASE PROTEIN

(Ralstonia
solanacearum) 		PF02558
(ApbA)
PF08546
(ApbA_C) 		5 CYH A  97
GLY A  95
PRO A  94
GLY A  93
ILE A 180
 None
 0.98A 4n49A-3ghyA:
3.1		 4n49A-3ghyA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h0g DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1

(Schizosaccharomyces
pombe) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		5 GLY A 407
PRO A 406
ASN A 400
ILE A 411
LEU A 432
 None
 0.98A 4n49A-3h0gA:
undetectable		 4n49A-3h0gA:
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.
3h1l MITOCHONDRIAL
UBIQUINOL-CYTOCHROME
-C REDUCTASE COMPLEX
CORE PROTEIN I

(Gallus gallus) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		5 GLY A 259
PRO A 260
GLY A 261
THR A 156
LEU A 153
 None
 0.90A 4n49A-3h1lA:
undetectable		 4n49A-3h1lA:
22.06
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.
3imk PUTATIVE MOLYBDENUM
CARRIER PROTEIN

(Syntrophus
aciditrophicus) 		PF12694
(MoCo_carrier) 		6 ALA A 138
GLY A 135
PRO A 136
LEU A  77
ILE A  10
LEU A 152
 MES  A 160 (-3.6A)
GOL  A 158 (-4.1A)
None
None
None
None
 1.34A 4n49A-3imkA:
undetectable		 4n49A-3imkA:
16.59
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.
3j4j TRANSLATION
INITIATION FACTOR
IF-2

(Thermus
thermophilus) 		PF00009
(GTP_EFTU)
PF04760
(IF2_N)
PF11987
(IF-2) 		5 GLY A 305
PRO A 304
GLY A 303
PHE A 273
THR A 127
 None
 0.97A 4n49A-3j4jA:
undetectable		 4n49A-3j4jA:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3j4s FTSZ/TUBULIN-RELATED
PROTEIN

(Bacillus
thuringiensis) 		PF00091
(Tubulin) 		5 ALA A  30
GLY A 144
GLY A 140
THR A  93
LEU A 108
 None
None
GDP  A 900 (-4.2A)
None
None
 1.01A 4n49A-3j4sA:
undetectable		 4n49A-3j4sA:
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.
3jb9 PRE-MRNA-SPLICING
FACTOR CWF17

(Schizosaccharomyces
pombe) 		PF00400
(WD40) 		5 ALA L 122
GLY L  87
ASN L  78
ILE L 334
LEU L 326
 None
 0.92A 4n49A-3jb9L:
undetectable		 4n49A-3jb9L:
22.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kly PUTATIVE FORMATE
TRANSPORTER 1

(Vibrio cholerae) 		PF01226
(Form_Nir_trans) 		5 GLY A  45
PHE A  48
LEU A 121
ASN A 120
LEU A 254
 None
 1.03A 4n49A-3klyA:
undetectable		 4n49A-3klyA:
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.
3l2o F-BOX ONLY PROTEIN 4

(Homo sapiens) 		PF00646
(F-box) 		5 GLY B 183
PRO B 184
GLY B 185
LEU B 236
ILE B 233
 None
 1.02A 4n49A-3l2oB:
undetectable		 4n49A-3l2oB:
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.
3l82 F-BOX ONLY PROTEIN 4

(Homo sapiens) 		no annotation 5 GLY B 183
PRO B 184
GLY B 185
LEU B 236
ILE B 233
 None
 1.01A 4n49A-3l82B:
undetectable		 4n49A-3l82B:
19.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mc1 PREDICTED
PHOSPHATASE, HAD
FAMILY

(Clostridium
acetobutylicum) 		PF13419
(HAD_2) 		5 GLY A 164
GLY A 182
THR A  12
ILE A  89
LEU A  93
 None
 1.00A 4n49A-3mc1A:
undetectable		 4n49A-3mc1A:
19.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3or2 SULFITE REDCUTASE
SUBUNIT ALPHA
SULFITE REDCUTASE
SUBUNIT BETA

(Desulfovibrio
gigas;
Desulfovibrio
gigas) 		PF01077
(NIR_SIR)
PF00037
(Fer4)
PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		5 GLY B 160
PRO B 161
LEU A   9
ILE A  24
LEU A  50
 None
 0.95A 4n49A-3or2B:
undetectable		 4n49A-3or2B:
20.48
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.
3oyo HEMOPEXIN FOLD
PROTEIN CP4

(Vigna
unguiculata) 		PF00045
(Hemopexin) 		6 ALA A 175
PRO A   4
GLY A 190
PHE A 188
ILE A 224
LEU A  44
 CL  A 229 ( 4.1A)
None
None
None
None
None
 1.37A 4n49A-3oyoA:
undetectable		 4n49A-3oyoA:
19.77
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.
3pfr MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Actinobacillus
succinogenes) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		6 ALA A 350
GLY A 398
GLY A 400
LEU A 129
ILE A  78
LEU A  81
 None
 1.10A 4n49A-3pfrA:
undetectable		 4n49A-3pfrA:
20.38
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.
3s6j HYDROLASE, HALOACID
DEHALOGENASE-LIKE
FAMILY

(Pseudomonas
syringae group
genomosp. 3) 		PF13419
(HAD_2) 		5 GLY A 272
GLY A 290
THR A 117
LEU A 114
LEU A 201
 None
 1.01A 4n49A-3s6jA:
undetectable		 4n49A-3s6jA:
19.43
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.
3ucx SHORT CHAIN
DEHYDROGENASE

(Mycolicibacterium
smegmatis) 		PF13561
(adh_short_C2) 		5 GLY A  16
PRO A  17
ILE A  65
THR A  66
LEU A 115
 CL  A 261 (-3.2A)
CL  A 261 ( 4.7A)
None
None
None
 1.01A 4n49A-3ucxA:
7.3		 4n49A-3ucxA:
18.50
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.
3v7p AMIDOHYDROLASE
FAMILY PROTEIN

(Nitratiruptor
sp. SB155-2) 		PF01979
(Amidohydro_1) 		5 GLY A  56
PRO A  55
GLY A 356
THR A 114
ILE A 108
 None
 1.01A 4n49A-3v7pA:
undetectable		 4n49A-3v7pA:
21.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wp9 ICE-BINDING PROTEIN

(Colwellia sp.
SLW05) 		PF11999
(DUF3494) 		5 ALA A   1
GLY A 130
THR A 108
ILE A 104
LEU A  99
 None
 1.03A 4n49A-3wp9A:
undetectable		 4n49A-3wp9A:
18.93
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.
3wwp (S)-HYDROXYNITRILE
LYASE

(Baliospermum
montanum) 		PF00561
(Abhydrolase_1) 		5 GLY A  81
GLY A  83
ILE A 157
THR A 152
LEU A 148
 None
None
CL  A 309 ( 4.0A)
None
None
 0.99A 4n49A-3wwpA:
undetectable		 4n49A-3wwpA:
23.04
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.
3wxx ACRH
AOPB

(Aeromonas
hydrophila;
Aeromonas
hydrophila) 		no annotation
PF04888
(SseC) 		5 ALA B 191
GLY B 184
GLY B 186
ILE A  13
LEU A  26
 None
 1.00A 4n49A-3wxxB:
undetectable		 4n49A-3wxxB:
19.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a3r ENOLASE

(Bacillus
subtilis) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		6 GLY A 107
GLY A 104
LEU A 112
ASN A 109
ILE A 343
THR A 349
 None
 1.45A 4n49A-4a3rA:
undetectable		 4n49A-4a3rA:
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.
4a6e HYDROXYINDOLE
O-METHYLTRANSFERASE

(Homo sapiens) 		PF00891
(Methyltransf_2)
PF16864
(Dimerisation2) 		5 ALA A  55
GLY A  32
LEU A  94
THR A  87
LEU A  73
 None
GOL  A1357 ( 4.1A)
None
SO4  A1353 (-4.1A)
None
 1.03A 4n49A-4a6eA:
6.8		 4n49A-4a6eA:
23.77
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.
4ber PHOSPHOCHOLINE
TRANSFERASE ANKX

(Legionella
pneumophila) 		PF02661
(Fic)
PF12796
(Ank_2) 		5 PRO A   9
GLY A  10
ASN A   7
ILE A  59
LEU A  76
 None
 0.94A 4n49A-4berA:
undetectable		 4n49A-4berA:
22.62
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.
4c3o HYDROGENASE-1 LARGE
SUBUNIT

(Salmonella
enterica) 		PF00374
(NiFeSe_Hases) 		5 GLY A 293
GLY A 295
THR A 572
ILE A 569
LEU A 560
 None
 0.97A 4n49A-4c3oA:
undetectable		 4n49A-4c3oA:
21.81
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.
4ce5 AT-OMEGATA

(Aspergillus
terreus) 		PF01063
(Aminotran_4) 		5 GLY A 214
GLY A 216
LEU A 211
ILE A 270
LEU A 285
 None
PDG  A1181 (-3.2A)
None
None
None
 0.98A 4n49A-4ce5A:
undetectable		 4n49A-4ce5A:
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.
4cta CINA-LIKE PROTEIN

(Thermus
thermophilus) 		PF00994
(MoCF_biosynth)
PF02464
(CinA) 		5 ALA A 135
GLY A  68
GLY A 152
LEU A   7
LEU A 147
 None
ATP  A 400 (-3.2A)
ATP  A 400 (-3.4A)
None
None
 1.00A 4n49A-4ctaA:
undetectable		 4n49A-4ctaA:
23.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ewj ENOLASE 2

(Streptococcus
suis) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		6 GLY A 107
GLY A 104
LEU A 112
ASN A 109
ILE A 348
THR A 354
 None
 1.43A 4n49A-4ewjA:
undetectable		 4n49A-4ewjA:
22.74
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.
4g3t OXIDOREDUCTASE DPRE1

(Mycolicibacterium
smegmatis) 		PF01565
(FAD_binding_4)
PF04030
(ALO) 		5 GLY A 419
PHE A 417
ILE A 220
THR A 219
LEU A 216
 None
 0.96A 4n49A-4g3tA:
undetectable		 4n49A-4g3tA:
22.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4iwh 3-ISOPROPYLMALATE
DEHYDROGENASE

(Burkholderia
thailandensis) 		PF00180
(Iso_dh) 		5 ALA A  40
GLY A  12
PRO A  13
GLY A  10
LEU A 274
 None
 1.02A 4n49A-4iwhA:
undetectable		 4n49A-4iwhA:
20.97
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.
4kw5 OXIDOREDUCTASE

(Mycobacterium
tuberculosis) 		PF01565
(FAD_binding_4)
PF04030
(ALO) 		5 GLY A 412
PHE A 410
ILE A 213
THR A 212
LEU A 209
 None
 1.02A 4n49A-4kw5A:
undetectable		 4n49A-4kw5A:
22.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mfi SN-GLYCEROL-3-PHOSPH
ATE ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN USPB

(Mycobacterium
tuberculosis) 		PF13416
(SBP_bac_8) 		5 ALA A 301
GLY A 219
GLY A 218
LEU A 229
LEU A 399
 None
 0.99A 4n49A-4mfiA:
undetectable		 4n49A-4mfiA:
22.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mfi SN-GLYCEROL-3-PHOSPH
ATE ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN USPB

(Mycobacterium
tuberculosis) 		PF13416
(SBP_bac_8) 		5 ALA A 301
GLY A 219
THR A 234
LEU A 229
LEU A 399
 None
 1.02A 4n49A-4mfiA:
undetectable		 4n49A-4mfiA:
22.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mg4 PHOSPHONOMUTASE

(Burkholderia
cenocepacia) 		PF13714
(PEP_mutase) 		5 ALA A  41
PHE A  10
ILE A 100
THR A  99
LEU A  85
 None
 1.02A 4n49A-4mg4A:
undetectable		 4n49A-4mg4A:
20.80
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.
4mtl PROTEIN-LYSINE
METHYLTRANSFERASE
METTL21C

(Homo sapiens) 		PF10294
(Methyltransf_16) 		5 ALA A  95
GLY A 122
PRO A 123
GLY A 124
LEU A 142
 SAH  A1001 (-3.3A)
SAH  A1001 (-3.2A)
None
UNX  A1016 ( 2.9A)
SAH  A1001 (-4.2A)
 0.65A 4n49A-4mtlA:
9.4		 4n49A-4mtlA:
22.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mtl PROTEIN-LYSINE
METHYLTRANSFERASE
METTL21C

(Homo sapiens) 		PF10294
(Methyltransf_16) 		5 ALA A  95
GLY A 122
PRO A 123
GLY A 124
LEU A 205
 SAH  A1001 (-3.3A)
SAH  A1001 (-3.2A)
None
UNX  A1016 ( 2.9A)
None
 1.03A 4n49A-4mtlA:
9.4		 4n49A-4mtlA:
22.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4n3n EUKARYOTIC
TRANSLATION
INITIATION FACTOR
5B-LIKE PROTEIN,
EIF5B(517-C)

(Chaetomium
thermophilum) 		PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2)
PF11987
(IF-2) 		5 GLY A 836
LEU A 839
ILE A 789
THR A 791
LEU A 830
 None
 0.95A 4n49A-4n3nA:
undetectable		 4n49A-4n3nA:
22.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4n49 CAP-SPECIFIC MRNA
(NUCLEOSIDE-2'-O-)-M
ETHYLTRANSFERASE 1

(Homo sapiens) 		PF01728
(FtsJ) 		12 ALA A 236
CYH A 277
GLY A 279
PRO A 280
GLY A 281
PHE A 283
THR A 301
LEU A 302
ASN A 306
ILE A 336
THR A 337
LEU A 383
 SAM  A 601 (-3.2A)
SAM  A 601 (-3.7A)
SAM  A 601 (-3.5A)
SAM  A 601 (-3.6A)
SAM  A 601 (-3.6A)
SAM  A 601 (-3.5A)
SAM  A 601 (-4.1A)
SAM  A 601 (-4.1A)
None
SAM  A 601 (-4.1A)
SAM  A 601 ( 3.9A)
SAM  A 601 (-4.6A)
 0.00A 4n49A-4n49A:
73.4		 4n49A-4n49A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o6m AF2299, A
CDP-ALCOHOL
PHOSPHOTRANSFERASE

(Archaeoglobus
fulgidus) 		PF01066
(CDP-OH_P_transf) 		5 ALA A 271
GLY A 265
THR A 251
LEU A 254
THR A 200
 None
 0.99A 4n49A-4o6mA:
undetectable		 4n49A-4o6mA:
23.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q65 DIPEPTIDE PERMEASE D

(Escherichia
coli) 		PF00854
(PTR2) 		5 ALA A 466
GLY A 351
GLY A 353
ILE A 344
LEU A 273
 None
 0.99A 4n49A-4q65A:
undetectable		 4n49A-4q65A:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4utg SUGAR KINASE

(Burkholderia
pseudomallei) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		5 GLY A  15
GLY A 299
LEU A  35
ASN A  36
LEU A 198
 CL  A 402 ( 3.7A)
ANP  A 399 (-3.7A)
None
None
None
 1.02A 4n49A-4utgA:
undetectable		 4n49A-4utgA:
23.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uug AMINE TRANSAMINASE

(Aspergillus
fumigatus) 		PF01063
(Aminotran_4) 		5 GLY A 213
GLY A 215
LEU A 210
ILE A 269
LEU A 284
 None
PXG  A 401 (-3.3A)
None
None
None
 0.98A 4n49A-4uugA:
undetectable		 4n49A-4uugA:
22.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xk1 PHOSPHOSERINE
AMINOTRANSFERASE

(Pseudomonas
aeruginosa) 		PF00266
(Aminotran_5) 		5 GLY A 332
GLY A 331
ILE A 279
THR A 278
LEU A 275
 None
 0.78A 4n49A-4xk1A:
undetectable		 4n49A-4xk1A:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dm4 METHYLTRANSFERASE
DOMAIN FAMILY

(Bacillus
pumilus) 		PF13489
(Methyltransf_23) 		5 GLY A 133
PHE A 135
ILE A 201
THR A 202
LEU A 254
 5DA  A 302 (-3.5A)
SAH  A 300 ( 4.6A)
None
None
None
 0.96A 4n49A-5dm4A:
6.8		 4n49A-5dm4A:
20.54
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.
5fir 5'-3'
EXORIBONUCLEASE 2
HOMOLOG

(Caenorhabditis
elegans) 		PF03159
(XRN_N) 		6 GLY A 104
PRO A 202
GLY A 203
ASN A 200
ILE A 161
LEU A 171
 None
 1.49A 4n49A-5firA:
undetectable		 4n49A-5firA:
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.
5fku DNA POLYMERASE III
SUBUNIT ALPHA

(Escherichia
coli) 		PF01336
(tRNA_anti-codon)
PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6) 		5 GLY A  93
GLY A 127
ASN A  91
ILE A 101
LEU A  47
 None
 0.90A 4n49A-5fkuA:
undetectable		 4n49A-5fkuA:
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.
5jzx UDP-N-ACETYLENOLPYRU
VOYLGLUCOSAMINE
REDUCTASE

(Mycobacterium
tuberculosis) 		PF01565
(FAD_binding_4)
PF02873
(MurB_C) 		5 ALA A 133
GLY A  69
GLY A  68
THR A  26
LEU A  27
 FAD  A 401 (-3.2A)
FAD  A 401 (-3.5A)
FAD  A 401 (-3.2A)
FAD  A 401 (-3.8A)
None
 0.96A 4n49A-5jzxA:
undetectable		 4n49A-5jzxA:
19.65
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.
5k3h ACYL-COENZYME A
OXIDASE

(Caenorhabditis
elegans) 		PF01756
(ACOX)
PF02770
(Acyl-CoA_dh_M)
PF14749
(Acyl-CoA_ox_N) 		6 ALA A 427
GLY A 401
GLY A 399
LEU A 344
ILE A 348
LEU A 615
 None
 1.25A 4n49A-5k3hA:
undetectable		 4n49A-5k3hA:
21.84
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.
5m43 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Chaetomium
thermophilum) 		PF00782
(DSPc) 		5 GLY A  97
PRO A  96
GLY A  84
THR A  32
ILE A  34
 None
 1.01A 4n49A-5m43A:
undetectable		 4n49A-5m43A:
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.
5mq6 PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE-LIKE
PROTEIN

(Thermothelomyces
thermophila) 		PF07992
(Pyr_redox_2) 		5 GLY A  90
GLY A  87
PHE A 118
LEU A 220
ILE A  82
 None
FAD  A 700 (-3.5A)
None
None
None
 0.85A 4n49A-5mq6A:
undetectable		 4n49A-5mq6A:
21.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nii THIOREDOXIN
REDUCTASE

(Desulfovibrio
vulgaris) 		no annotation 5 ALA A 264
GLY A  10
GLY A  15
ILE A  92
THR A  93
 None
FAD  A 401 (-3.3A)
None
None
None
 1.03A 4n49A-5niiA:
undetectable		 4n49A-5niiA:
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.
5u6s UDP-GLYCOSYLTRANSFER
ASE 74F2

(Arabidopsis
thaliana) 		PF00201
(UDPGT) 		5 ALA A  73
GLY A  69
PHE A  70
THR A  41
LEU A 114
 None
None
LB2  A 502 (-3.7A)
None
None
 1.01A 4n49A-5u6sA:
3.1		 4n49A-5u6sA:
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.
5vdn GLUTATHIONE
OXIDOREDUCTASE

(Yersinia pestis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ALA A 142
GLY A 307
ILE A 295
THR A 289
LEU A 282
 None
 0.96A 4n49A-5vdnA:
undetectable		 4n49A-5vdnA:
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.
5xww AMPHB

(Streptomyces
nodosus) 		no annotation 5 ALA A 368
GLY A 147
THR A 103
THR A  57
LEU A 320
 None
 0.95A 4n49A-5xwwA:
4.0		 4n49A-5xwwA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y4g AMBP3

(Fischerella
ambigua) 		no annotation 5 ALA A  44
GLY A  62
GLY A  42
PHE A  43
ILE A  73
 None
 0.94A 4n49A-5y4gA:
undetectable		 4n49A-5y4gA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5z2m -

(-) 		no annotation 5 ALA A 110
CYH A  83
GLY A  80
ILE A 169
THR A 168
 None
 0.91A 4n49A-5z2mA:
undetectable		 4n49A-5z2mA:
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 MONOVALENT CATION/H+
ANTIPORTER SUBUNIT D

(Pyrococcus
furiosus) 		no annotation 5 ALA H 343
GLY H 325
GLY H 327
ILE H 219
LEU H 223
 None
 0.89A 4n49A-6cfwH:
undetectable		 4n49A-6cfwH:
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.
6en4 SPLICING FACTOR 3B
SUBUNIT 3

(Homo sapiens) 		no annotation 5 GLY A 232
PHE A 234
ASN A 254
ILE A 325
LEU A 327
 None
 0.90A 4n49A-6en4A:
undetectable		 4n49A-6en4A:
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.
6fks -

(-) 		no annotation 5 ALA A  73
GLY A  60
PHE A 289
LEU A  23
ASN A  62
 None
 0.89A 4n49A-6fksA:
undetectable		 4n49A-6fksA:
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.
6fpe TRNA
THREONYLCARBAMOYLADE
NOSINE BIOSYNTHESIS
PROTEIN TSAB

(Thermotoga
maritima) 		no annotation 5 ALA A 110
PRO A  64
GLY A  65
LEU A  91
ASN A  92
 None
 1.02A 4n49A-6fpeA:
undetectable		 4n49A-6fpeA:
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.
6g2j NADH DEHYDROGENASE
[UBIQUINONE]
FLAVOPROTEIN 1,
MITOCHONDRIAL

(Mus musculus) 		no annotation 5 ALA F 223
GLY F 121
GLY F 125
ILE F 153
LEU F 149
 FMN  F 501 ( 4.7A)
None
None
None
None
 0.98A 4n49A-6g2jF:
undetectable		 4n49A-6g2jF:
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.
6gkv COCLAURINE
N-METHYLTRANSFERASE

(Coptis japonica) 		no annotation 5 GLY A 139
GLY A 141
THR A 160
ILE A 188
THR A 189
 SAH  A 501 (-3.1A)
None
SAH  A 501 ( 4.8A)
SAH  A 501 (-3.9A)
None
 0.81A 4n49A-6gkvA:
7.1		 4n49A-6gkvA:
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.
1a88 CHLOROPEROXIDASE L

(Streptomyces
lividans) 		PF00561
(Abhydrolase_1) 		4 ASN A 169
GLY A 167
ASP A 233
ASP A 225
 None
 1.21A 4n49A-1a88A:
2.2		 4n49A-1a88A:
20.32
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.
1a8q BROMOPEROXIDASE A1

(Kitasatospora
aureofaciens) 		PF00561
(Abhydrolase_1) 		4 ASN A 166
GLY A 161
ASP A 133
ASP A 222
 None
 1.26A 4n49A-1a8qA:
1.7		 4n49A-1a8qA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1amo NADPH-CYTOCHROME
P450 REDUCTASE

(Rattus
norvegicus) 		PF00175
(NAD_binding_1)
PF00258
(Flavodoxin_1)
PF00667
(FAD_binding_1) 		4 ASN A 182
GLY A 174
ASP A 101
ASP A 215
 FMN  A 751 (-4.9A)
FMN  A 751 (-3.2A)
None
None
 1.12A 4n49A-1amoA:
2.8		 4n49A-1amoA:
20.31
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.
1b1c PROTEIN
(NADPH-CYTOCHROME
P450 REDUCTASE)

(Homo sapiens) 		PF00258
(Flavodoxin_1) 		4 ASN A 122
GLY A 114
ASP A  41
ASP A 155
 None
FMN  A 190 (-3.2A)
None
None
 1.07A 4n49A-1b1cA:
undetectable		 4n49A-1b1cA:
19.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cvr GINGIPAIN R

(Porphyromonas
gingivalis) 		PF01364
(Peptidase_C25)
PF03785
(Peptidase_C25_C) 		4 ASN A 106
GLY A  97
ASP A 248
ASP A 334
 None
 1.40A 4n49A-1cvrA:
1.6		 4n49A-1cvrA:
22.24
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.
1gqj ALPHA-D-GLUCURONIDAS
E

(Cellvibrio
japonicus) 		PF03648
(Glyco_hydro_67N)
PF07477
(Glyco_hydro_67C)
PF07488
(Glyco_hydro_67M) 		4 ASN A 361
GLY A 362
ASP A 290
ASP A 365
 None
None
None
XYP  A1719 (-3.3A)
 1.35A 4n49A-1gqjA:
undetectable		 4n49A-1gqjA:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1h54 MALTOSE
PHOSPHORYLASE

(Lactobacillus
brevis) 		PF03632
(Glyco_hydro_65m)
PF03633
(Glyco_hydro_65C)
PF03636
(Glyco_hydro_65N) 		4 ASN A 208
GLY A 211
ASP A 267
ASP A 411
 None
 1.41A 4n49A-1h54A:
undetectable		 4n49A-1h54A:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1m53 ISOMALTULOSE
SYNTHASE

(Klebsiella sp.
LX3) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		4 ASN A 100
GLY A 104
ASP A 124
ASP A  97
 None
 1.14A 4n49A-1m53A:
1.1		 4n49A-1m53A:
21.42
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.
1mqq ALPHA-D-GLUCURONIDAS
E

(Geobacillus
stearothermophilus) 		PF03648
(Glyco_hydro_67N)
PF07477
(Glyco_hydro_67C)
PF07488
(Glyco_hydro_67M) 		4 ASN A 360
GLY A 361
ASP A 283
ASP A 364
 None
None
None
GCU  A 701 ( 2.3A)
 1.35A 4n49A-1mqqA:
undetectable		 4n49A-1mqqA:
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.
1t3d SERINE
ACETYLTRANSFERASE

(Escherichia
coli) 		PF00132
(Hexapep)
PF06426
(SATase_N) 		4 ASN A 261
GLY A 262
ASP A 157
ASP A 257
 None
 1.28A 4n49A-1t3dA:
undetectable		 4n49A-1t3dA:
21.11
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.
1t6p PHENYLALANINE
AMMONIA-LYASE

(Rhodotorula
toruloides) 		PF00221
(Lyase_aromatic) 		4 ASN A 174
GLY A 391
ASP A 285
ASP A  71
 None
 1.25A 4n49A-1t6pA:
undetectable		 4n49A-1t6pA:
19.89
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.
1tnd TRANSDUCIN

(Bos taurus) 		PF00503
(G-alpha) 		4 ASN A 265
GLY A  41
ASP A 154
ASP A 146
 GSP  A 351 (-3.2A)
GSP  A 351 (-3.3A)
None
GSP  A 351 (-3.3A)
 1.31A 4n49A-1tndA:
undetectable		 4n49A-1tndA:
21.11
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.
1un1 XYLOGLUCAN
ENDOTRANSGLYCOSYLASE

(Populus tremula) 		PF00722
(Glyco_hydro_16)
PF06955
(XET_C) 		4 ASN A 175
GLY A  69
ASP A 112
ASP A 178
 None
 1.37A 4n49A-1un1A:
undetectable		 4n49A-1un1A:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ur4 GALACTANASE

(Bacillus
licheniformis) 		PF07745
(Glyco_hydro_53) 		4 ASN A 336
GLY A 328
ASP A  29
ASP A 370
 None
None
None
CA  A1398 (-2.9A)
 1.16A 4n49A-1ur4A:
undetectable		 4n49A-1ur4A:
22.06
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.
1w8a SLIT PROTEIN

(Drosophila
melanogaster) 		PF00560
(LRR_1)
PF01462
(LRRNT)
PF01463
(LRRCT)
PF13855
(LRR_8) 		4 ASN A 580
GLY A 558
ASP A 542
ASP A 555
 None
 1.28A 4n49A-1w8aA:
undetectable		 4n49A-1w8aA:
19.40
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.
1xng NH(3)-DEPENDENT
NAD(+) SYNTHETASE

(Helicobacter
pylori) 		PF02540
(NAD_synthase) 		4 ASN A 154
GLY A 157
ASP A 195
ASP A  37
 None
None
None
ATP  A 303 (-3.9A)
 1.24A 4n49A-1xngA:
undetectable		 4n49A-1xngA:
19.68
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.
1z26 ARGONAUTE

(Pyrococcus
furiosus) 		PF02171
(Piwi)
PF12212
(PAZ_siRNAbind) 		4 ASN A 672
GLY A 675
ASP A 313
ASP A 136
 None
 0.82A 4n49A-1z26A:
undetectable		 4n49A-1z26A:
20.05
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.
1z9a NAD(P)H-DEPENDENT
D-XYLOSE REDUCTASE

([Candida]
tenuis) 		PF00248
(Aldo_ket_red) 		4 ASN A  28
GLY A  53
ASP A 109
ASP A 102
 None
 1.09A 4n49A-1z9aA:
undetectable		 4n49A-1z9aA:
19.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2f7l 455AA LONG
HYPOTHETICAL
PHOSPHO-SUGAR MUTASE

(Sulfurisphaera
tokodaii) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		4 ASN A 328
GLY A 329
ASP A 112
ASP A 245
 None
 1.06A 4n49A-2f7lA:
undetectable		 4n49A-2f7lA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fm8 CELL INVASION
PROTEIN SIPA

(Salmonella
enterica) 		PF09052
(SipA) 		4 ASN C  85
GLY C  88
ASP C  72
ASP C 130
 None
 1.28A 4n49A-2fm8C:
undetectable		 4n49A-2fm8C:
23.08
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.
2fm9 CELL INVASION
PROTEIN SIPA

(Salmonella
enterica) 		PF09052
(SipA) 		4 ASN A  85
GLY A  88
ASP A  72
ASP A 130
 None
 1.26A 4n49A-2fm9A:
undetectable		 4n49A-2fm9A:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fuq HEPARINASE II
PROTEIN

(Pedobacter
heparinus) 		PF07940
(Hepar_II_III)
PF16332
(DUF4962) 		4 ASN A 637
GLY A 431
ASP A 299
ASP A 309
 None
 1.40A 4n49A-2fuqA:
undetectable		 4n49A-2fuqA:
19.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fuv PHOSPHOGLUCOMUTASE

(Salmonella
enterica) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		4 ASN A 161
GLY A 163
ASP A 175
ASP A 166
 None
 1.17A 4n49A-2fuvA:
undetectable		 4n49A-2fuvA:
21.08
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.
2gv9 DNA POLYMERASE

(Human
alphaherpesvirus
1) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		4 ASN A 518
GLY A 491
ASP A 481
ASP A 488
 None
 1.16A 4n49A-2gv9A:
undetectable		 4n49A-2gv9A:
16.61
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.
2hk7 SHIKIMATE
DEHYDROGENASE

(Aquifex
aeolicus) 		PF01488
(Shikimate_DH)
PF08501
(Shikimate_dh_N) 		4 ASN A  64
GLY A 243
ASP A  82
ASP A 106
 None
 1.23A 4n49A-2hk7A:
4.2		 4n49A-2hk7A:
20.51
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.
2hmf PROBABLE
ASPARTOKINASE

(Methanocaldococcus
jannaschii) 		PF00696
(AA_kinase)
PF01842
(ACT)
PF13840
(ACT_7) 		4 ASN A 360
GLY A 325
ASP A 371
ASP A 397
 None
 1.16A 4n49A-2hmfA:
undetectable		 4n49A-2hmfA:
22.38
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.
2hz7 GLUTAMINYL-TRNA
SYNTHETASE

(Deinococcus
radiodurans) 		PF00749
(tRNA-synt_1c)
PF03950
(tRNA-synt_1c_C) 		4 ASN A 236
GLY A 204
ASP A 142
ASP A 244
 None
 1.10A 4n49A-2hz7A:
undetectable		 4n49A-2hz7A:
19.86
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.
2ik8 GUANINE
NUCLEOTIDE-BINDING
PROTEIN G(I),
ALPHA-1 SUBUNIT

(Homo sapiens) 		PF00503
(G-alpha) 		4 ASN A 269
GLY A  45
ASP A 158
ASP A 150
 GDP  A 401 (-3.1A)
GDP  A 401 (-3.3A)
None
None
 1.12A 4n49A-2ik8A:
undetectable		 4n49A-2ik8A:
20.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2isa CATALASE

(Aliivibrio
salmonicida) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		4 ASN A 298
GLY A  62
ASP A  81
ASP A  87
 None
 1.13A 4n49A-2isaA:
undetectable		 4n49A-2isaA:
20.54
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.
2ix8 ELONGATION FACTOR 3A

(Saccharomyces
cerevisiae) 		PF00005
(ABC_tran) 		4 ASN A1702
GLY A1545
ASP A1927
ASP A1920
 None
 1.37A 4n49A-2ix8A:
undetectable		 4n49A-2ix8A:
17.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jf4 PERIPLASMIC
TREHALASE

(Escherichia
coli) 		PF01204
(Trehalase) 		4 ASN A 196
GLY A 197
ASP A 516
ASP A 160
 VDM  A1548 (-2.9A)
None
None
VDM  A1548 (-3.0A)
 1.39A 4n49A-2jf4A:
undetectable		 4n49A-2jf4A:
20.93
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.
2w61 GLYCOLIPID-ANCHORED
SURFACE PROTEIN 2

(Saccharomyces
cerevisiae) 		PF03198
(Glyco_hydro_72)
PF07983
(X8) 		4 ASN A 295
GLY A 294
ASP A  45
ASP A 344
 None
 1.12A 4n49A-2w61A:
undetectable		 4n49A-2w61A:
22.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wte CSA3

(Sulfolobus
solfataricus) 		no annotation 4 ASN A 101
GLY A  96
ASP A  28
ASP A  92
 None
 1.25A 4n49A-2wteA:
2.8		 4n49A-2wteA:
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.
2x50 TRYPANOTHIONE
REDUCTASE

(Leishmania
infantum) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 ASN A 208
GLY A 246
ASP A  84
ASP A  71
 None
 1.39A 4n49A-2x50A:
undetectable		 4n49A-2x50A:
23.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xub DNA-DIRECTED RNA
POLYMERASE III
SUBUNIT RPC3

(Homo sapiens) 		PF05645
(RNA_pol_Rpc82)
PF08221
(HTH_9) 		4 ASN A 291
GLY A 330
ASP A 318
ASP A 309
 None
 1.18A 4n49A-2xubA:
undetectable		 4n49A-2xubA:
21.08
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.
2xub DNA-DIRECTED RNA
POLYMERASE III
SUBUNIT RPC3

(Homo sapiens) 		PF05645
(RNA_pol_Rpc82)
PF08221
(HTH_9) 		4 ASN A 291
GLY A 331
ASP A 318
ASP A 309
 None
 1.00A 4n49A-2xubA:
undetectable		 4n49A-2xubA:
21.08
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.
2yil MICRONEME ANTIGEN L2

(Sarcocystis
muris) 		PF00024
(PAN_1)
PF14295
(PAN_4) 		4 ASN A  52
GLY A  70
ASP A   6
ASP A  13
 None
None
None
GOL  A1137 (-4.1A)
 1.29A 4n49A-2yilA:
undetectable		 4n49A-2yilA:
18.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zux YESW PROTEIN

(Bacillus
subtilis) 		no annotation 4 ASN A 208
GLY A 238
ASP A 153
ASP A 187
 None
RAM  A 642 (-3.5A)
CA  A 630 (-2.8A)
RAM  A 641 (-2.7A)
 1.42A 4n49A-2zuxA:
undetectable		 4n49A-2zuxA:
22.85
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.
3aib GLUCOSYLTRANSFERASE-
SI

(Streptococcus
mutans) 		PF02324
(Glyco_hydro_70) 		4 ASN A 930
GLY A 925
ASP A 468
ASP A 937
 None
 1.26A 4n49A-3aibA:
undetectable		 4n49A-3aibA:
18.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3db7 PUTATIVE
CALCIUM-REGULATED
PERIPLASMIC PROTEIN

(Bacteroides
thetaiotaomicron) 		PF11396
(PepSY_like) 		4 ASN A  68
GLY A  69
ASP A  75
ASP A  84
 None
 1.42A 4n49A-3db7A:
undetectable		 4n49A-3db7A:
14.86
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.
3dwo PROBABLE OUTER
MEMBRANE PROTEIN

(Pseudomonas
aeruginosa) 		PF03349
(Toluene_X) 		4 ASN X   9
GLY X  12
ASP X 226
ASP X 344
 None
 1.23A 4n49A-3dwoX:
undetectable		 4n49A-3dwoX:
20.30
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.
3efm FERRIC ALCALIGIN
SIDEROPHORE RECEPTOR

(Bordetella
pertussis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 ASN A 116
GLY A 118
ASP A 203
ASP A  69
 None
 1.38A 4n49A-3efmA:
undetectable		 4n49A-3efmA:
20.11
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.
3gbd SUCROSE ISOMERASE
SMUA FROM
PROTAMINOBACTER
RUBRUM

(Serratia
plymuthica) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		4 ASN A  73
GLY A  77
ASP A  97
ASP A  70
 None
 1.23A 4n49A-3gbdA:
1.1		 4n49A-3gbdA:
20.74
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.
3gdo UNCHARACTERIZED
OXIDOREDUCTASE YVAA

(Bacillus
subtilis) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 ASN A 307
GLY A 280
ASP A  37
ASP A 276
 None
 1.39A 4n49A-3gdoA:
3.1		 4n49A-3gdoA:
22.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ge4 DNA PROTECTION
DURING STARVATION
PROTEIN

(Brucella
melitensis) 		PF00210
(Ferritin) 		4 ASN A 123
GLY A 119
ASP A  68
ASP A 152
 None
 1.37A 4n49A-3ge4A:
undetectable		 4n49A-3ge4A:
17.51
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.
3lv4 GLYCOSIDE HYDROLASE
YXIA

(Bacillus
licheniformis) 		PF04616
(Glyco_hydro_43)
PF16369
(GH43_C) 		4 ASN A 304
GLY A 303
ASP A 290
ASP A 392
 None
 1.29A 4n49A-3lv4A:
undetectable		 4n49A-3lv4A:
21.81
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.
3mg9 TEG12

(uncultured soil
bacterium) 		PF00685
(Sulfotransfer_1) 		4 ASN A   2
GLY A   3
ASP A 195
ASP A 186
 None
 1.36A 4n49A-3mg9A:
undetectable		 4n49A-3mg9A:
18.85
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.
3ml5 CARBONIC ANHYDRASE 7

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		4 ASN A 243
GLY A  98
ASP A 110
ASP A 102
 None
 1.10A 4n49A-3ml5A:
undetectable		 4n49A-3ml5A:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o8l 6-PHOSPHOFRUCTOKINAS
E, MUSCLE TYPE

(Oryctolagus
cuniculus) 		PF00365
(PFK) 		4 ASN A  31
GLY A  80
ASP A 168
ASP A  26
 None
None
ATP  A 763 ( 4.7A)
None
 1.18A 4n49A-3o8lA:
undetectable		 4n49A-3o8lA:
21.11
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.
3oy2 GLYCOSYLTRANSFERASE
B736L

(Paramecium
bursaria
Chlorella virus
NY2A) 		no annotation 4 ASN A  96
GLY A  95
ASP A 330
ASP A  90
 None
 1.22A 4n49A-3oy2A:
2.5		 4n49A-3oy2A:
20.82
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.
3pyw S-LAYER PROTEIN SAP

(Bacillus
anthracis) 		PF00395
(SLH) 		4 ASN A  30
GLY A  33
ASP A  16
ASP A   7
 None
None
SO4  A 204 (-3.9A)
None
 1.32A 4n49A-3pywA:
undetectable		 4n49A-3pywA:
19.77
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.
3r79 UNCHARACTERIZED
PROTEIN

(Agrobacterium
fabrum) 		PF01168
(Ala_racemase_N) 		4 ASN A 171
GLY A 173
ASP A  17
ASP A 198
 None
 1.11A 4n49A-3r79A:
undetectable		 4n49A-3r79A:
20.10
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.
3rmj 2-ISOPROPYLMALATE
SYNTHASE

(Neisseria
meningitidis) 		PF00682
(HMGL-like) 		4 ASN A 240
GLY A  17
ASP A 137
ASP A  11
 MN  A 365 (-2.6A)
None
None
None
 1.32A 4n49A-3rmjA:
undetectable		 4n49A-3rmjA:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tqo CYSTEINYL-TRNA
SYNTHETASE

(Coxiella
burnetii) 		PF01406
(tRNA-synt_1e)
PF09190
(DALR_2) 		4 ASN A 390
GLY A 393
ASP A 349
ASP A  49
 None
 1.33A 4n49A-3tqoA:
undetectable		 4n49A-3tqoA:
23.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u4y UNCHARACTERIZED
PROTEIN

(Desulfotomaculum
acetoxidans) 		PF10282
(Lactonase) 		4 ASN A 177
GLY A 129
ASP A  92
ASP A  41
 None
 1.07A 4n49A-3u4yA:
undetectable		 4n49A-3u4yA:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ut2 CATALASE-PEROXIDASE
2

(Magnaporthe
oryzae) 		PF00141
(peroxidase) 		4 ASN A 383
GLY A 402
ASP A 411
ASP A 405
 None
 1.41A 4n49A-3ut2A:
undetectable		 4n49A-3ut2A:
20.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4av6 K(+)-STIMULATED
PYROPHOSPHATE-ENERGI
ZED SODIUM PUMP

(Thermotoga
maritima) 		PF03030
(H_PPase) 		4 ASN A 492
GLY A 491
ASP A 190
ASP A 232
 PO4  A1728 ( 2.5A)
None
None
MG  A1732 (-1.9A)
 1.15A 4n49A-4av6A:
undetectable		 4n49A-4av6A:
21.20
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.
4cak INTEGRIN ALPHA-IIB
INTEGRIN BETA-3

(Homo sapiens;
Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2)
PF00362
(Integrin_beta)
PF07965
(Integrin_B_tail)
PF07974
(EGF_2)
PF17205
(PSI_integrin) 		4 ASN B 371
GLY B 382
ASP A 554
ASP A 560
 NAG  B3371 (-1.9A)
None
None
None
 1.37A 4n49A-4cakB:
undetectable		 4n49A-4cakB:
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.
4ekd GUANINE
NUCLEOTIDE-BINDING
PROTEIN G(Q) SUBUNIT
ALPHA

(Mus musculus) 		PF00503
(G-alpha) 		4 ASN A 274
GLY A  51
ASP A 163
ASP A 155
 GDP  A 401 (-3.5A)
GDP  A 401 (-3.2A)
None
GDP  A 401 ( 4.8A)
 1.09A 4n49A-4ekdA:
undetectable		 4n49A-4ekdA:
23.95
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.
4fym OROTATE
PHOSPHORIBOSYLTRANSF
ERASE

(Plasmodium
falciparum) 		PF00156
(Pribosyltran) 		4 ASN A 104
GLY A 101
ASP A 276
ASP A 209
 None
 1.18A 4n49A-4fymA:
undetectable		 4n49A-4fymA:
19.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gvr METHENYLTETRAHYDROME
THANOPTERIN
CYCLOHYDROLASE

(Archaeoglobus
fulgidus) 		PF02289
(MCH) 		4 ASN A  31
GLY A  32
ASP A 130
ASP A 160
 None
 1.40A 4n49A-4gvrA:
undetectable		 4n49A-4gvrA:
20.19
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.
4hao PROBABLE INORGANIC
POLYPHOSPHATE/ATP-NA
D KINASE

(Yersinia pestis) 		PF01513
(NAD_kinase) 		4 ASN A  97
GLY A  96
ASP A 115
ASP A 107
 None
 1.30A 4n49A-4haoA:
undetectable		 4n49A-4haoA:
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.
4hdj OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTOR BAMB

(Pseudomonas
aeruginosa) 		PF13360
(PQQ_2) 		4 ASN A 145
GLY A 146
ASP A 117
ASP A 162
 None
 1.40A 4n49A-4hdjA:
undetectable		 4n49A-4hdjA:
20.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hoz SUCROSE ISOMERASE

(Erwinia
rhapontici) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		4 ASN A 100
GLY A 104
ASP A 124
ASP A  97
 None
 1.18A 4n49A-4hozA:
undetectable		 4n49A-4hozA:
20.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hwv PECTATE LYASE/AMB
ALLERGEN

(Acidovorax
citrulli) 		PF00544
(Pec_lyase_C) 		4 ASN A 213
GLY A 495
ASP A 262
ASP A 189
 None
 0.78A 4n49A-4hwvA:
undetectable		 4n49A-4hwvA:
21.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i4i 6-PHOSPHOFRUCTOKINAS
E

(Geobacillus
stearothermophilus) 		PF00365
(PFK) 		4 ASN A  17
GLY A  64
ASP A 129
ASP A  12
 None
 0.94A 4n49A-4i4iA:
undetectable		 4n49A-4i4iA:
22.22
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.
4izg MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME,
N-TERMINAL DOMAIN
PROTEIN

(Paracoccus
denitrificans) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 ASN A 317
GLY A 309
ASP A 247
ASP A 293
 None
None
None
4OP  A 416 ( 4.8A)
 1.02A 4n49A-4izgA:
undetectable		 4n49A-4izgA:
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.
4l7t NANU SIALIC ACID
BINDING PROTEIN

(Bacteroides
fragilis) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		4 ASN A 317
GLY A 318
ASP A 382
ASP A 283
 None
 1.20A 4n49A-4l7tA:
undetectable		 4n49A-4l7tA:
22.06
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.
4llf CAPSID PROTEIN

(Cucumber
necrosis virus) 		PF00729
(Viral_coat) 		4 ASN A 115
GLY A 232
ASP A 222
ASP A 178
 None
 1.08A 4n49A-4llfA:
undetectable		 4n49A-4llfA:
22.41
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.
4n14 CELL DIVISION CYCLE
PROTEIN 20 HOMOLOG

(Homo sapiens) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		4 ASN A 334
GLY A 307
ASP A 184
ASP A 330
 None
 1.26A 4n49A-4n14A:
undetectable		 4n49A-4n14A:
20.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4n49 CAP-SPECIFIC MRNA
(NUCLEOSIDE-2'-O-)-M
ETHYLTRANSFERASE 1

(Homo sapiens) 		PF01728
(FtsJ) 		4 ASN A 234
GLY A 282
ASP A 335
ASP A 364
 SAM  A 601 (-3.3A)
SAM  A 601 (-3.1A)
SAM  A 601 (-3.6A)
SAM  A 601 (-3.6A)
 0.01A 4n49A-4n49A:
73.4		 4n49A-4n49A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o9x TCDB2, TCCC3

(Photorhabdus
luminescens) 		PF03534
(SpvB)
PF12255
(TcdB_toxin_midC)
PF12256
(TcdB_toxin_midN) 		4 ASN A  99
GLY A 103
ASP A  68
ASP A 107
 None
 1.29A 4n49A-4o9xA:
undetectable		 4n49A-4o9xA:
11.38
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.
4pdx PUTATIVE
ALKYL/ARYL-SULFATASE
YJCS

(Escherichia
coli) 		PF00753
(Lactamase_B)
PF14863
(Alkyl_sulf_dimr)
PF14864
(Alkyl_sulf_C) 		4 ASN A 248
GLY A 251
ASP A  72
ASP A 132
 None
 1.25A 4n49A-4pdxA:
undetectable		 4n49A-4pdxA:
20.80
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.
4q2b ENDO-1,4-BETA-D-GLUC
ANASE

(Pseudomonas
putida) 		PF01270
(Glyco_hydro_8) 		4 ASN A 113
GLY A 166
ASP A 189
ASP A 116
 None
None
None
TRS  A 402 (-2.8A)
 1.23A 4n49A-4q2bA:
undetectable		 4n49A-4q2bA:
21.87
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.
4ruh CYTOSOLIC
NON-SPECIFIC
DIPEPTIDASE

(Homo sapiens) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 ASN A 455
GLY A 438
ASP A 112
ASP A 441
 None
 1.11A 4n49A-4ruhA:
undetectable		 4n49A-4ruhA:
22.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tvc DEXTRANSUCRASE

(Leuconostoc
mesenteroides) 		PF02324
(Glyco_hydro_70) 		4 ASN A1946
GLY A1933
ASP A1888
ASP A1960
 None
 1.20A 4n49A-4tvcA:
undetectable		 4n49A-4tvcA:
16.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4upi SULFATASE FAMILY
PROTEIN

(Ruegeria
pomeroyi) 		PF00884
(Sulfatase) 		4 ASN A  74
GLY A  54
ASP A 135
ASP A  13
 DDZ  A  53 ( 4.2A)
DDZ  A  53 ( 2.4A)
None
ZN  A1576 (-2.1A)
 1.06A 4n49A-4upiA:
undetectable		 4n49A-4upiA:
21.87
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.
4y9v PARTICLE-ASSOCIATED
LYASE

(Acinetobacter
virus AP22) 		no annotation 4 ASN A 441
GLY A 407
ASP A 448
ASP A 437
 49S  A 814 (-3.6A)
49S  A 814 (-3.5A)
None
SO4  A 809 ( 4.7A)
 1.12A 4n49A-4y9vA:
undetectable		 4n49A-4y9vA:
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.
4yzt CELLULOSE HYDROLASE

(Bacillus
licheniformis) 		PF00150
(Cellulase)
PF03442
(CBM_X2) 		4 ASN A 361
GLY A 418
ASP A 340
ASP A 285
 None
 1.39A 4n49A-4yztA:
undetectable		 4n49A-4yztA:
21.61
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.
4z0n PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR

(Streptobacillus
moniliformis) 		PF13407
(Peripla_BP_4) 		4 ASN A  39
GLY A 238
ASP A  94
ASP A 209
 None
 1.30A 4n49A-4z0nA:
undetectable		 4n49A-4z0nA:
21.52
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.
4zzq CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Dictyostelium
discoideum) 		PF00840
(Glyco_hydro_7) 		4 ASN A 204
GLY A 203
ASP A 230
ASP A 240
 None
 1.37A 4n49A-4zzqA:
undetectable		 4n49A-4zzqA:
20.93
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.
5a22 VESICULAR STOMATITIS
VIRUS L POLYMERASE

(Vesicular
stomatitis
virus) 		PF00946
(Mononeg_RNA_pol)
PF14314
(Methyltrans_Mon)
PF14318
(Mononeg_mRNAcap) 		4 ASN A 136
GLY A 135
ASP A1137
ASP A1285
 None
 1.37A 4n49A-5a22A:
16.5		 4n49A-5a22A:
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.
5bxp LACTO-N-BIOSIDASE

(Bifidobacterium
bifidum) 		PF00728
(Glyco_hydro_20)
PF02838
(Glyco_hydro_20b)
PF14200
(RicinB_lectin_2) 		4 ASN A 259
GLY A 318
ASP A 350
ASP A 375
 GAL  A 701 (-4.0A)
None
None
None
 1.33A 4n49A-5bxpA:
undetectable		 4n49A-5bxpA:
21.81
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.
5c69 FUSION GLYCOPROTEIN
F0,FIBRITIN

(Enterobacteria
phage Ox2;
Human
orthopneumovirus) 		PF00523
(Fusion_gly) 		4 ASN A 410
GLY A 411
ASP A 452
ASP A 374
 None
 1.42A 4n49A-5c69A:
undetectable		 4n49A-5c69A:
22.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dmy BETA-GALACTOSIDASE

(Bifidobacterium
bifidum) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		4 ASN A 510
GLY A 482
ASP A 329
ASP A 385
 None
 1.38A 4n49A-5dmyA:
undetectable		 4n49A-5dmyA:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5iva LPS-ASSEMBLY PROTEIN
LPTD
LPS-ASSEMBLY
LIPOPROTEIN LPTE

(Pseudomonas
aeruginosa;
Pseudomonas
aeruginosa) 		PF04453
(OstA_C)
PF04390
(LptE) 		4 ASN B 114
GLY B 117
ASP A 398
ASP A 394
 None
 1.18A 4n49A-5ivaB:
undetectable		 4n49A-5ivaB:
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.
5j04 ENOLASE

(Synechococcus
elongatus) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		4 ASN A 162
GLY A 156
ASP A 276
ASP A 165
 None
 1.03A 4n49A-5j04A:
undetectable		 4n49A-5j04A:
25.05
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.
5j55 CAROTENOID OXYGENASE

(Novosphingobium
aromaticivorans) 		PF03055
(RPE65) 		4 ASN A 287
GLY A 363
ASP A 427
ASP A 359
 None
 1.23A 4n49A-5j55A:
undetectable		 4n49A-5j55A:
22.22
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.
5jbe INACTIVE
GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF02324
(Glyco_hydro_70) 		4 ASN A1287
GLY A1289
ASP A1380
ASP A1254
 None
 1.14A 4n49A-5jbeA:
undetectable		 4n49A-5jbeA:
18.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jk7 PROTEIN VPRBP

(Homo sapiens) 		no annotation 4 ASN C1269
GLY C1270
ASP C1256
ASP C1281
 None
 1.31A 4n49A-5jk7C:
undetectable		 4n49A-5jk7C:
22.42
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.
5kk5 CRISPR-ASSOCIATED
ENDONUCLEASE CPF1

(Acidaminococcus
sp. BV3L6) 		no annotation 4 ASN A1122
GLY A1100
ASP A1107
ASP A1102
 None
 1.13A 4n49A-5kk5A:
undetectable		 4n49A-5kk5A:
15.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ngy DSR-M GLUCANSUCRASE
INACTIVE MUTANT
E715Q

(Leuconostoc
citreum) 		no annotation 4 ASN A1125
GLY A1126
ASP A 680
ASP A1178
 None
 1.40A 4n49A-5ngyA:
undetectable		 4n49A-5ngyA:
15.37
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.
5nxn PORIN 1

(Providencia
stuartii) 		no annotation 4 ASN A 284
GLY A 115
ASP A  34
ASP A 321
 None
 1.07A 4n49A-5nxnA:
undetectable		 4n49A-5nxnA:
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.
5u24 PUTATIVE
AMINOTRANSFERASE

(Campylobacter
jejuni) 		PF01041
(DegT_DnrJ_EryC1) 		4 ASN A 248
GLY A 161
ASP A 104
ASP A 275
 None
 1.13A 4n49A-5u24A:
undetectable		 4n49A-5u24A:
23.03
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.
5vjw RHIZOBIALES-LIKE
PHOSPHATASE 2

(Arabidopsis
thaliana) 		no annotation 4 ASN A  80
GLY A  79
ASP A 287
ASP A  50
 WO4  A 403 ( 2.3A)
None
None
None
 1.38A 4n49A-5vjwA:
undetectable		 4n49A-5vjwA:
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.
5x8z PENICILLIN V
ACYLASE-LIKE PROTEIN

(Shewanella
loihica) 		no annotation 4 ASN A 103
GLY A 134
ASP A 159
ASP A 132
 None
 1.31A 4n49A-5x8zA:
undetectable		 4n49A-5x8zA:
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.
5z06 BDI_3064 PROTEIN

(Parabacteroides
distasonis) 		no annotation 4 ASN A 591
GLY A 594
ASP A 667
ASP A 624
 None
 1.28A 4n49A-5z06A:
undetectable		 4n49A-5z06A:
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.
6ape BIFUNCTIONAL PROTEIN
FOLD

(Helicobacter
pylori) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		4 ASN A 236
GLY A 245
ASP A 198
ASP A 217
 GOL  A 303 ( 4.6A)
None
None
None
 1.26A 4n49A-6apeA:
undetectable		 4n49A-6apeA:
22.07
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.
6btm ALTERNATIVE COMPLEX
III SUBUNIT B

(Flavobacterium
johnsoniae) 		no annotation 4 ASN B 187
GLY B 102
ASP B 145
ASP B 566
 None
 1.22A 4n49A-6btmB:
undetectable		 4n49A-6btmB:
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.
6cza -

(-) 		no annotation 4 ASN A 728
GLY A 803
ASP A 832
ASP A 722
 MGD  A 902 (-4.8A)
None
None
MGD  A 903 ( 2.1A)
 1.36A 4n49A-6czaA:
undetectable		 4n49A-6czaA:
undetectable