SIMILAR PATTERNS OF AMINO ACIDS FOR 4N49_A_SAMA601_0

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