SIMILAR PATTERNS OF AMINO ACIDS FOR 4DF3_A_SAMA301_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.
1ak6 DESTRIN

(Homo sapiens;
Sus scrofa) 		PF00241
(Cofilin_ADF) 		5 GLY A   4
ALA A   2
ALA A 118
ALA A 123
VAL A   5
 None
 1.19A 4df3A-1ak6A:
undetectable		 4df3A-1ak6A:
23.50
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.
1buc BUTYRYL-COA
DEHYDROGENASE

(Megasphaera
elsdenii) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 GLY A 246
THR A  93
ALA A 252
VAL A  76
ALA A 320
 None
 1.29A 4df3A-1bucA:
undetectable		 4df3A-1bucA:
22.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bvu PROTEIN (GLUTAMATE
DEHYDROGENASE)

(Thermococcus
litoralis) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 GLY A 346
ALA A 344
ALA A 194
ASP A 188
VAL A 349
 None
 0.99A 4df3A-1bvuA:
3.9		 4df3A-1bvuA:
21.79
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.
1evq SERINE HYDROLASE

(Alicyclobacillus
acidocaldarius) 		PF07859
(Abhydrolase_3) 		5 ALA A  76
PHE A 142
VAL A 107
ASP A 141
ALA A 140
 None
 1.48A 4df3A-1evqA:
2.5		 4df3A-1evqA:
23.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1fbn MJ FIBRILLARIN
HOMOLOGUE

(Methanocaldococcus
jannaschii) 		PF01269
(Fibrillarin) 		6 LYS A  58
GLY A  82
ALA A 107
ASP A 130
ALA A 131
ASP A 150
 None
 0.67A 4df3A-1fbnA:
31.8		 4df3A-1fbnA:
48.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1fbn MJ FIBRILLARIN
HOMOLOGUE

(Methanocaldococcus
jannaschii) 		PF01269
(Fibrillarin) 		6 LYS A  58
GLY A  82
THR A  87
ALA A 131
ASP A 150
VAL A 151
 None
 0.68A 4df3A-1fbnA:
31.8		 4df3A-1fbnA:
48.07
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.
1i7o 4-HYDROXYPHENYLACETA
TE DEGRADATION
BIFUNCTIONAL
ISOMERASE/DECARBOXYL
ASE

(Escherichia
coli) 		PF01557
(FAA_hydrolase) 		5 ALA A 287
ALA A 295
VAL A 290
ALA A 300
ASP A 389
 None
 1.28A 4df3A-1i7oA:
undetectable		 4df3A-1i7oA:
23.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1iwp GLYCEROL DEHYDRATASE
ALPHA SUBUNIT
GLYCEROL DEHYDRATASE
GAMMA SUBUNIT

(Klebsiella
pneumoniae;
Klebsiella
pneumoniae) 		PF02286
(Dehydratase_LU)
PF02287
(Dehydratase_SU) 		5 GLY A 292
ALA G  68
ALA G  61
VAL A 293
GLN A 294
 None
 1.28A 4df3A-1iwpA:
undetectable		 4df3A-1iwpA:
18.48
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.
1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		5 THR A 403
ALA A 444
VAL A 442
ALA A 233
VAL A 228
 None
 1.45A 4df3A-1kqfA:
3.0		 4df3A-1kqfA:
11.68
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.
1mor GLUCOSAMINE
6-PHOSPHATE SYNTHASE

(Escherichia
coli) 		PF01380
(SIS) 		5 GLY A 482
ALA A 479
VAL A 519
ALA A 584
GLN A 581
 None
 0.92A 4df3A-1morA:
undetectable		 4df3A-1morA:
20.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1nt2 FIBRILLARIN-LIKE
PRE-RRNA PROCESSING
PROTEIN

(Archaeoglobus
fulgidus) 		PF01269
(Fibrillarin) 		6 GLY A  65
ALA A  67
THR A  70
ASP A 113
ALA A 114
ASP A 133
 SAM  A 301 ( 3.8A)
SAM  A 301 (-3.1A)
SAM  A 301 (-3.1A)
SAM  A 301 (-3.6A)
SAM  A 301 (-3.4A)
SAM  A 301 (-3.7A)
 0.50A 4df3A-1nt2A:
26.1		 4df3A-1nt2A:
44.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1nt2 FIBRILLARIN-LIKE
PRE-RRNA PROCESSING
PROTEIN

(Archaeoglobus
fulgidus) 		PF01269
(Fibrillarin) 		6 GLY A  65
ALA A  67
THR A  70
ASP A 113
ALA A 114
GLN A 136
 SAM  A 301 ( 3.8A)
SAM  A 301 (-3.1A)
SAM  A 301 (-3.1A)
SAM  A 301 (-3.6A)
SAM  A 301 (-3.4A)
SAM  A 301 (-3.4A)
 0.69A 4df3A-1nt2A:
26.1		 4df3A-1nt2A:
44.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1nt2 FIBRILLARIN-LIKE
PRE-RRNA PROCESSING
PROTEIN

(Archaeoglobus
fulgidus) 		PF01269
(Fibrillarin) 		6 LYS A  42
GLY A  65
ALA A  67
ASP A 113
ALA A 114
ASP A 133
 SAM  A 301 (-3.0A)
SAM  A 301 ( 3.8A)
SAM  A 301 (-3.1A)
SAM  A 301 (-3.6A)
SAM  A 301 (-3.4A)
SAM  A 301 (-3.7A)
 0.64A 4df3A-1nt2A:
26.1		 4df3A-1nt2A:
44.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1q3x MANNAN-BINDING
LECTIN SERINE
PROTEASE 2

(Homo sapiens) 		PF00084
(Sushi)
PF00089
(Trypsin) 		5 GLY A 634
ALA A 484
THR A 466
ALA A 534
ALA A 636
 None
 1.26A 4df3A-1q3xA:
undetectable		 4df3A-1q3xA:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1txk GLUCANS BIOSYNTHESIS
PROTEIN G

(Escherichia
coli) 		PF04349
(MdoG) 		5 ALA A 491
THR A 449
ALA A 400
ASP A 398
GLN A 497
 None
 1.49A 4df3A-1txkA:
undetectable		 4df3A-1txkA:
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.
1vpk DNA POLYMERASE III,
BETA SUBUNIT

(Thermotoga
maritima) 		PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3) 		5 ALA A  55
PHE A  33
ALA A  46
VAL A  53
ASP A  12
 None
 1.29A 4df3A-1vpkA:
undetectable		 4df3A-1vpkA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w52 PANCREATIC LIPASE
RELATED PROTEIN 2

(Equus caballus) 		PF00151
(Lipase)
PF01477
(PLAT) 		5 GLY X 156
ALA X 160
THR X 130
VAL X 174
ASP X 178
 None
 1.37A 4df3A-1w52X:
undetectable		 4df3A-1w52X:
17.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xfj CONSERVED
HYPOTHETICAL PROTEIN

(Caulobacter
vibrioides) 		PF02578
(Cu-oxidase_4) 		5 ALA A  81
ALA A 128
VAL A  99
ALA A 132
VAL A 142
 None
 1.29A 4df3A-1xfjA:
undetectable		 4df3A-1xfjA:
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.
2bcc UBIQUINOL CYTOCHROME
C OXIDOREDUCTASE

(Gallus gallus) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		5 GLY A  38
THR A  95
ALA A 114
VAL A 117
VAL A  37
 None
 1.49A 4df3A-2bccA:
undetectable		 4df3A-2bccA:
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.
2h88 SUCCINATE
DEHYDROGENASE
FLAVOPROTEIN SUBUNIT

(Gallus gallus) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		5 ALA A  26
THR A  53
ALA A 212
ALA A 178
VAL A  47
 FAD  A1001 (-3.8A)
None
None
FAD  A1001 (-3.5A)
None
 1.07A 4df3A-2h88A:
2.7		 4df3A-2h88A:
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.
2hg4 6-DEOXYERYTHRONOLIDE
B SYNTHASE

(Saccharopolyspora
erythraea) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF08990
(Docking)
PF16197
(KAsynt_C_assoc) 		5 GLY A 148
ALA A 266
ALA A 178
ASP A 196
VAL A 149
 None
 1.36A 4df3A-2hg4A:
undetectable		 4df3A-2hg4A:
14.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hj9 AUTOINDUCER
2-BINDING
PERIPLASMIC PROTEIN
LUXP

(Vibrio harveyi) 		PF13407
(Peripla_BP_4) 		5 THR A 138
VAL A 164
ASP A 179
ASP A 213
VAL A 214
 None
 1.46A 4df3A-2hj9A:
4.4		 4df3A-2hj9A:
23.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ipx RRNA
2'-O-METHYLTRANSFERA
SE FIBRILLARIN

(Homo sapiens) 		PF01269
(Fibrillarin) 		5 ALA A 170
THR A 174
PHE A 193
ASP A 217
GLN A 240
 MTA  A4001 (-3.6A)
None
MTA  A4001 (-3.5A)
MTA  A4001 (-3.4A)
MTA  A4001 (-4.0A)
 1.30A 4df3A-2ipxA:
28.1		 4df3A-2ipxA:
45.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ipx RRNA
2'-O-METHYLTRANSFERA
SE FIBRILLARIN

(Homo sapiens) 		PF01269
(Fibrillarin) 		9 GLY A 168
ALA A 170
THR A 173
PHE A 193
ASP A 217
ALA A 218
ASP A 237
VAL A 238
GLN A 240
 MTA  A4001 (-3.3A)
MTA  A4001 (-3.6A)
None
MTA  A4001 (-3.5A)
MTA  A4001 (-3.4A)
MTA  A4001 (-3.4A)
MTA  A4001 (-4.3A)
MTA  A4001 (-4.1A)
MTA  A4001 (-4.0A)
 0.48A 4df3A-2ipxA:
28.1		 4df3A-2ipxA:
45.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2kep GENERAL SECRETION
PATHWAY PROTEIN G

(Pseudomonas
aeruginosa) 		PF08334
(T2SSG) 		5 GLY A 144
ALA A  58
ASP A  53
ALA A  50
ASP A 142
 None
 1.44A 4df3A-2kepA:
undetectable		 4df3A-2kepA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2okc TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF02384
(N6_Mtase)
PF12161
(HsdM_N) 		5 ALA A 302
ALA A 258
VAL A 304
ALA A 188
VAL A 174
 None
 1.05A 4df3A-2okcA:
10.7		 4df3A-2okcA:
18.61
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.
2ozo TYROSINE-PROTEIN
KINASE ZAP-70

(Homo sapiens) 		PF00017
(SH2)
PF07714
(Pkinase_Tyr) 		5 GLY A 536
ALA A 532
THR A 528
VAL A 438
VAL A 427
 None
 1.30A 4df3A-2ozoA:
2.4		 4df3A-2ozoA:
18.24
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.
2p2w CITRATE SYNTHASE

(Thermotoga
maritima) 		PF00285
(Citrate_synt) 		5 GLY A 201
ALA A 184
ALA A 189
ASP A 194
VAL A 200
 None
 1.32A 4df3A-2p2wA:
undetectable		 4df3A-2p2wA:
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.
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli) 		PF01979
(Amidohydro_1) 		5 GLY A  62
ALA A 274
THR A 312
PHE A 287
ASP A  70
 None
 1.46A 4df3A-2p50A:
undetectable		 4df3A-2p50A:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q1y CELL DIVISION
PROTEIN FTSZ

(Mycobacterium
tuberculosis) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 GLY A  15
VAL A  96
ASP A  53
ALA A  52
VAL A  24
 None
 1.35A 4df3A-2q1yA:
4.6		 4df3A-2q1yA:
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.
2qa1 POLYKETIDE OXYGENASE
PGAE

(Streptomyces
sp. PGA64) 		PF01494
(FAD_binding_3) 		5 GLY A  14
ALA A  18
THR A 108
VAL A  28
ALA A 273
 None
 1.45A 4df3A-2qa1A:
3.5		 4df3A-2qa1A:
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.
2rci TYPE-2BA CYTOLYTIC
DELTA-ENDOTOXIN

(Bacillus
thuringiensis) 		PF01338
(Bac_thur_toxin) 		5 GLY A  94
ALA A 185
VAL A 223
ALA A 219
VAL A 121
 GLY  A  94 ( 0.0A)
ALA  A 185 ( 0.0A)
VAL  A 223 ( 0.6A)
ALA  A 219 ( 0.0A)
VAL  A 121 ( 0.6A)
 0.94A 4df3A-2rciA:
undetectable		 4df3A-2rciA:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vou 2,6-DIHYDROXYPYRIDIN
E HYDROXYLASE

(Paenarthrobacter
nicotinovorans) 		PF00070
(Pyr_redox) 		5 GLY A  17
ALA A  21
ALA A 330
ASP A 325
ALA A 322
 None
None
None
None
FAD  A1395 ( 3.9A)
 1.25A 4df3A-2vouA:
3.8		 4df3A-2vouA:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w4i GLUTAMATE RACEMASE

(Helicobacter
pylori) 		PF01177
(Asp_Glu_race) 		5 THR A 182
PHE A  25
VAL A   5
ALA A  22
VAL A 215
 DGL  A1256 (-3.1A)
None
None
None
None
 1.14A 4df3A-2w4iA:
3.3		 4df3A-2w4iA:
21.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x3n PROBABLE
FAD-DEPENDENT
MONOOXYGENASE

(Pseudomonas
aeruginosa) 		PF01494
(FAD_binding_3) 		5 GLY A  17
ALA A  21
ALA A 316
ASP A 311
ALA A 308
 None
None
None
None
FAD  A1371 (-3.6A)
 1.15A 4df3A-2x3nA:
5.0		 4df3A-2x3nA:
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.
3afe HYDROXYLASE,
PUTATIVE

(Mycobacterium
tuberculosis) 		PF02771
(Acyl-CoA_dh_N)
PF08028
(Acyl-CoA_dh_2) 		5 GLY A 219
ALA A 222
ASP A 215
ALA A 212
ASP A 100
 None
 0.97A 4df3A-3afeA:
undetectable		 4df3A-3afeA:
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.
3b4w ALDEHYDE
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF00171
(Aldedh) 		5 GLY A 211
ALA A  43
THR A  22
VAL A  48
ALA A 182
 None
None
None
None
NAD  A 500 (-4.0A)
 1.45A 4df3A-3b4wA:
3.5		 4df3A-3b4wA:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bm1 PROTEIN YDJA

(Escherichia
coli) 		PF00881
(Nitroreductase) 		5 GLY A 161
ALA A  20
THR A  22
ALA A  13
GLN A 164
 None
 1.16A 4df3A-3bm1A:
undetectable		 4df3A-3bm1A:
24.19
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.
3cty THIOREDOXIN
REDUCTASE

(Thermoplasma
acidophilum) 		PF07992
(Pyr_redox_2) 		5 GLY A  28
ALA A  32
ALA A 308
ASP A 303
ALA A 300
 None
None
None
None
FAD  A1000 ( 4.0A)
 1.33A 4df3A-3ctyA:
4.0		 4df3A-3ctyA:
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.
3cvz S-LAYER PROTEIN

(Clostridioides
difficile) 		PF12211
(LMWSLP_N) 		5 GLY A 178
THR A 220
ALA A 188
ASP A 175
ASP A 182
 None
 0.96A 4df3A-3cvzA:
undetectable		 4df3A-3cvzA:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d6n DIHYDROOROTASE

(Aquifex
aeolicus) 		PF01979
(Amidohydro_1) 		5 GLY A 125
ALA A 149
VAL A 175
ASP A 138
ALA A 137
 None
 1.43A 4df3A-3d6nA:
undetectable		 4df3A-3d6nA:
18.08
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.
3e6e ALANINE RACEMASE

(Enterococcus
faecalis) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		5 GLY A 186
THR A 178
PHE A 188
VAL A 216
ALA A 190
 None
 1.49A 4df3A-3e6eA:
undetectable		 4df3A-3e6eA:
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.
3gbp GALACTOSE-BINDING
PROTEIN

(Salmonella
enterica) 		PF13407
(Peripla_BP_4) 		5 LYS A 125
GLY A 297
ALA A 237
ASP A 299
VAL A 298
 None
 1.41A 4df3A-3gbpA:
2.3		 4df3A-3gbpA:
23.05
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.
3gjy SPERMIDINE SYNTHASE

(Corynebacterium
glutamicum) 		no annotation 5 GLY A  94
THR A  99
ALA A 145
ASP A 163
VAL A 164
 None
 0.65A 4df3A-3gjyA:
12.5		 4df3A-3gjyA:
25.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gjy SPERMIDINE SYNTHASE

(Corynebacterium
glutamicum) 		no annotation 5 GLY A  94
THR A  99
ASP A 144
ALA A 145
ASP A 163
 None
 0.82A 4df3A-3gjyA:
12.5		 4df3A-3gjyA:
25.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3goc ENDONUCLEASE V

(Streptomyces
avermitilis) 		PF04493
(Endonuclease_5) 		5 GLY A  44
THR A 138
ALA A  58
VAL A  97
VAL A  61
 None
 1.31A 4df3A-3gocA:
undetectable		 4df3A-3gocA:
22.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gs6 BETA-HEXOSAMINIDASE

(Vibrio cholerae) 		PF00933
(Glyco_hydro_3) 		5 GLY A  98
ALA A 102
ALA A 152
VAL A 153
ALA A 145
 None
None
None
GOL  A 342 (-4.5A)
None
 1.29A 4df3A-3gs6A:
undetectable		 4df3A-3gs6A:
23.48
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.
3gs6 BETA-HEXOSAMINIDASE

(Vibrio cholerae) 		PF00933
(Glyco_hydro_3) 		5 GLY A  98
ALA A 102
VAL A 153
ALA A 145
GLN A  96
 None
None
GOL  A 342 (-4.5A)
None
None
 1.37A 4df3A-3gs6A:
undetectable		 4df3A-3gs6A:
23.48
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.
3pbl D(3) DOPAMINE
RECEPTOR, LYSOZYME
CHIMERA

(Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		5 GLY A  48
ALA A  42
ASP A  75
ALA A  72
VAL A  50
 None
 1.28A 4df3A-3pblA:
undetectable		 4df3A-3pblA:
18.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q1y LIN2199 PROTEIN

(Listeria
innocua) 		PF00294
(PfkB) 		5 GLY A 276
ALA A 279
ALA A 249
VAL A 282
ALA A 256
 None
 0.93A 4df3A-3q1yA:
3.8		 4df3A-3q1yA:
20.76
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.
3qh4 ESTERASE LIPW

(Mycobacterium
marinum) 		PF07859
(Abhydrolase_3) 		5 GLY A 164
THR A  99
ALA A 135
VAL A 118
ALA A 169
 None
 1.28A 4df3A-3qh4A:
2.4		 4df3A-3qh4A:
20.50
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.
3r9s CARNITINYL-COA
DEHYDRATASE

(Mycobacterium
avium) 		PF00378
(ECH_1) 		5 GLY A 111
ALA A 143
ALA A 118
VAL A  92
ALA A 108
 BEZ  A 264 ( 4.4A)
BEZ  A 264 (-3.5A)
EDO  A 265 (-4.5A)
None
None
 1.38A 4df3A-3r9sA:
undetectable		 4df3A-3r9sA:
23.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3uho GLUTAMATE RACEMASE

(Campylobacter
jejuni) 		PF01177
(Asp_Glu_race) 		5 THR A 181
PHE A  25
VAL A   5
ALA A  22
VAL A 208
 DGL  A 260 (-3.0A)
None
None
None
None
 1.15A 4df3A-3uhoA:
undetectable		 4df3A-3uhoA:
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.
3wy7 8-AMINO-7-OXONONANOA
TE SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00155
(Aminotran_1_2) 		5 GLY A  47
ALA A 359
ALA A 357
VAL A 292
ASP A  39
 None
 1.47A 4df3A-3wy7A:
3.2		 4df3A-3wy7A:
21.22
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.
4ab5 TRANSCRIPTIONAL
REGULATOR, LYSR
FAMILY

(Neisseria
meningitidis) 		PF03466
(LysR_substrate) 		5 GLY A 171
ALA A 241
THR A 197
VAL A 234
VAL A 170
 None
 1.43A 4df3A-4ab5A:
undetectable		 4df3A-4ab5A:
24.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aut DECAPRENYL-PHOSPHORY
L-BETA-D-RIBOFURANOS
E-2-OXIDOREDUCTASE

(Mycolicibacterium
smegmatis) 		PF01565
(FAD_binding_4)
PF04030
(ALO) 		5 GLY A 163
ALA A 161
ALA A  50
VAL A 456
VAL A  44
 None
 1.19A 4df3A-4autA:
undetectable		 4df3A-4autA:
20.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4by9 FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE

(Pyrococcus
furiosus) 		PF01269
(Fibrillarin) 		6 GLY E  81
ALA E  83
ASP E 130
ALA E 131
VAL E 151
GLN E 153
 None
C  X   5 ( 2.4A)
None
None
None
G  A  24 ( 3.0A)
 0.79A 4df3A-4by9E:
29.5		 4df3A-4by9E:
54.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4by9 FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE

(Pyrococcus
furiosus) 		PF01269
(Fibrillarin) 		6 GLY E  81
THR E  86
VAL E 110
ALA E 131
VAL E 151
GLN E 153
 None
A  X   7 ( 3.5A)
G  A  21 ( 4.3A)
None
None
G  A  24 ( 3.0A)
 0.70A 4df3A-4by9E:
29.5		 4df3A-4by9E:
54.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4by9 FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE

(Pyrococcus
furiosus) 		PF01269
(Fibrillarin) 		7 LYS E  57
GLY E  81
ASP E 130
ALA E 131
ASP E 150
VAL E 151
GLN E 153
 C  X   5 ( 2.7A)
None
None
None
C  X   5 ( 3.2A)
None
G  A  24 ( 3.0A)
 1.11A 4df3A-4by9E:
29.5		 4df3A-4by9E:
54.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4by9 FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE

(Pyrococcus
furiosus) 		PF01269
(Fibrillarin) 		6 LYS E  57
GLY E  81
VAL E 110
ALA E 131
VAL E 151
GLN E 153
 C  X   5 ( 2.7A)
None
G  A  21 ( 4.3A)
None
None
G  A  24 ( 3.0A)
 0.90A 4df3A-4by9E:
29.5		 4df3A-4by9E:
54.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4df3 FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE

(Aeropyrum
pernix) 		PF01269
(Fibrillarin) 		5 ALA A  87
THR A  91
PHE A 110
ASP A 134
GLN A 157
 SAM  A 301 (-3.4A)
SAM  A 301 (-3.3A)
SAM  A 301 (-3.4A)
SAM  A 301 (-3.3A)
SAM  A 301 (-3.8A)
 1.32A 4df3A-4df3A:
44.5		 4df3A-4df3A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4df3 FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE

(Aeropyrum
pernix) 		PF01269
(Fibrillarin) 		12 LYS A  61
GLY A  85
ALA A  87
THR A  90
PHE A 110
ALA A 111
VAL A 114
ASP A 134
ALA A 135
ASP A 154
VAL A 155
GLN A 157
 SAM  A 301 ( 3.9A)
SAM  A 301 (-3.4A)
SAM  A 301 (-3.4A)
SAM  A 301 (-3.9A)
SAM  A 301 (-3.4A)
SAM  A 301 ( 3.9A)
SAM  A 301 ( 4.9A)
SAM  A 301 (-3.3A)
SAM  A 301 (-3.5A)
SAM  A 301 (-3.6A)
SAM  A 301 (-4.3A)
SAM  A 301 (-3.8A)
 0.00A 4df3A-4df3A:
44.5		 4df3A-4df3A:
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.
4gci GLUTATHIONE
S-TRANSFERASE

(Yersinia pestis) 		PF00043
(GST_C)
PF02798
(GST_N) 		5 GLY A  67
ALA A 157
VAL A  18
ALA A 103
VAL A  68
 GSH  A 302 (-4.0A)
None
None
None
None
 1.25A 4df3A-4gciA:
undetectable		 4df3A-4gciA:
24.41
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.
4gcm THIOREDOXIN
REDUCTASE

(Staphylococcus
aureus) 		PF07992
(Pyr_redox_2) 		5 GLY A  17
ALA A  21
ALA A 297
ASP A 292
ALA A 289
 None
None
None
None
FAD  A 401 (-3.5A)
 1.34A 4df3A-4gcmA:
4.0		 4df3A-4gcmA:
21.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hds ARSA

(Sporomusa ovata) 		PF02277
(DBI_PRT) 		5 GLY A  70
ALA A  72
VAL A  75
ALA A 144
ASP A  68
 None
 1.19A 4df3A-4hdsA:
undetectable		 4df3A-4hdsA:
22.68
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.
4iin 3-KETOACYL-ACYL
CARRIER PROTEIN
REDUCTASE (FABG)

(Helicobacter
pylori) 		PF13561
(adh_short_C2) 		5 LYS A  31
GLY A  83
ASP A  81
VAL A  78
GLN A  79
 None
 1.31A 4df3A-4iinA:
9.2		 4df3A-4iinA:
24.75
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.
4kkm POLYPRENYL
SYNTHETASE

(Zymomonas
mobilis) 		PF00348
(polyprenyl_synt) 		5 ALA A 290
ALA A 220
VAL A 294
ALA A 212
GLN A 271
 None
 1.21A 4df3A-4kkmA:
undetectable		 4df3A-4kkmA:
21.62
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.
4mi2 PUTATIVE ENOYL-COA
HYDRATASE/ISOMERASE

(Mycobacteroides
abscessus) 		PF00378
(ECH_1) 		5 ALA A  20
ALA A  55
VAL A  18
ASP A 127
ALA A 126
 None
 1.42A 4df3A-4mi2A:
undetectable		 4df3A-4mi2A:
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.
4nbv 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
REDUCTASE PUTATIVE
SHORT-CHAIN
DEHYDROGENASES/REDUC
TASES (SDR) FAMILY
PROTEIN

(Cupriavidus
taiwanensis) 		PF13561
(adh_short_C2) 		5 GLY A  29
ALA A  26
THR A  52
ALA A   8
VAL A  32
 None
 0.98A 4df3A-4nbvA:
9.1		 4df3A-4nbvA:
19.70
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.
4nnq PUTATIVE ENOYL-COA
HYDRATASE

(Streptomyces
atroolivaceus) 		PF00378
(ECH_1) 		5 GLY A 121
ALA A 124
THR A 159
ALA A 109
VAL A 129
 None
 1.36A 4df3A-4nnqA:
undetectable		 4df3A-4nnqA:
24.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oqa POLY [ADP-RIBOSE]
POLYMERASE 1

(Homo sapiens) 		PF00644
(PARP)
PF02877
(PARP_reg)
PF05406
(WGR) 		5 LYS C1004
THR C 866
ASP C 791
VAL C 669
GLN C 670
 None
 1.07A 4df3A-4oqaC:
undetectable		 4df3A-4oqaC:
17.68
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.
4p52 HOMOSERINE KINASE

(Cytophaga
hutchinsonii) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		5 GLY A 130
ALA A 127
ALA A 100
VAL A 143
ALA A 134
 None
 1.24A 4df3A-4p52A:
undetectable		 4df3A-4p52A:
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.
4pev MEMBRANE LIPOPROTEIN
FAMILY PROTEIN

(Aeropyrum
pernix) 		PF02608
(Bmp) 		5 GLY A 278
PHE A 226
ALA A 188
VAL A 191
ALA A 216
 None
ADN  A 501 (-4.7A)
None
None
None
 1.29A 4df3A-4pevA:
2.9		 4df3A-4pevA:
20.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w1w ADENOSYLMETHIONINE-8
-AMINO-7-OXONONANOAT
E AMINOTRANSFERASE

(Mycobacterium
tuberculosis) 		PF00202
(Aminotran_3) 		5 ALA A 257
PHE A 267
ASP A 270
ALA A 269
ASP A 254
 PLP  A 501 (-3.2A)
None
None
None
PLP  A 501 (-2.8A)
 1.24A 4df3A-4w1wA:
undetectable		 4df3A-4w1wA:
21.06
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.
4x8f RIBOKINASE

(Vibrio cholerae) 		PF00294
(PfkB) 		5 GLY A  56
ALA A  59
ASP A 125
ALA A 128
VAL A   5
 None
 1.37A 4df3A-4x8fA:
4.3		 4df3A-4x8fA:
20.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zo3 ACYLHOMOSERINE
LACTONASE

(Chryseobacterium
sp. StRB126) 		PF00753
(Lactamase_B) 		5 GLY A 273
ALA A  69
ALA A 190
ASP A 279
ALA A 283
 None
 1.12A 4df3A-4zo3A:
undetectable		 4df3A-4zo3A:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5b3v BILIVERDIN REDUCTASE

(Synechocystis
sp. PCC 6803) 		no annotation 5 GLY B  14
THR B  18
ASP B  73
VAL B  38
GLN B  36
 None
NAP  B 401 (-3.5A)
None
None
None
 1.38A 4df3A-5b3vB:
7.0		 4df3A-5b3vB:
23.33
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.
5bmo PUTATIVE
UNCHARACTERIZED
PROTEIN LNMX

(Streptomyces
atroolivaceus) 		PF02585
(PIG-L) 		5 GLY A 139
PHE A 119
ALA A 174
ASP A  24
ALA A  20
 None
None
None
K  A 300 (-2.2A)
K  A 300 ( 4.8A)
 1.09A 4df3A-5bmoA:
4.1		 4df3A-5bmoA:
23.79
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.
5bn4 V-TYPE ATP SYNTHASE
ALPHA CHAIN

(Nanoarchaeum
equitans) 		PF00006
(ATP-synt_ab)
PF02874
(ATP-synt_ab_N)
PF16886
(ATP-synt_ab_Xtn) 		5 GLY A 228
ALA A 378
VAL A 221
VAL A 231
GLN A 234
 ANP  A 601 (-3.2A)
None
None
ANP  A 601 (-4.1A)
None
 1.38A 4df3A-5bn4A:
undetectable		 4df3A-5bn4A:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5g2x GROUP II
INTRON-ENCODED
PROTEIN LTRA

(Lactococcus
lactis) 		PF00078
(RVT_1)
PF01348
(Intron_maturas2) 		5 GLY C  53
ALA C  59
ASP C 107
ASP C  57
GLN C 111
 None
 1.28A 4df3A-5g2xC:
undetectable		 4df3A-5g2xC:
17.20
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.
5gha SULFUR TRANSFERASE
TTUA

(Thermus
thermophilus) 		PF01171
(ATP_bind_3) 		5 ALA A 154
ALA A  74
VAL A  50
ASP A  65
ALA A  62
 None
 1.18A 4df3A-5ghaA:
undetectable		 4df3A-5ghaA:
26.02
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5gin FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE

(Sulfolobus
solfataricus) 		PF01269
(Fibrillarin) 		7 GLY E  84
ALA E  86
PHE E 109
ASP E 133
ALA E 134
ASP E 153
GLN E 156
 SAH  E 301 (-3.8A)
SAH  E 301 ( 3.7A)
SAH  E 301 (-3.6A)
SAH  E 301 (-3.5A)
SAH  E 301 (-3.6A)
SAH  E 301 (-3.7A)
SAH  E 301 (-3.8A)
 0.53A 4df3A-5ginE:
33.5		 4df3A-5ginE:
53.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5gin FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE

(Sulfolobus
solfataricus) 		PF01269
(Fibrillarin) 		8 GLY E  84
ALA E  86
THR E  89
PHE E 109
VAL E 113
ASP E 133
ALA E 134
ASP E 153
 SAH  E 301 (-3.8A)
SAH  E 301 ( 3.7A)
A  I   6 ( 3.5A)
SAH  E 301 (-3.6A)
None
SAH  E 301 (-3.5A)
SAH  E 301 (-3.6A)
SAH  E 301 (-3.7A)
 0.40A 4df3A-5ginE:
33.5		 4df3A-5ginE:
53.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5gin FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE

(Sulfolobus
solfataricus) 		PF01269
(Fibrillarin) 		6 LYS E  60
ALA E  86
THR E  89
VAL E 113
ALA E 134
ASP E 153
 U  I   4 ( 3.9A)
SAH  E 301 ( 3.7A)
A  I   6 ( 3.5A)
None
SAH  E 301 (-3.6A)
SAH  E 301 (-3.7A)
 0.56A 4df3A-5ginE:
33.5		 4df3A-5ginE:
53.22
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.
5jfc NADH-DEPENDENT
FERREDOXIN:NADP
OXIDOREDUCTASE
SUBUNIT ALPHA

(Pyrococcus
furiosus) 		PF07992
(Pyr_redox_2)
PF14691
(Fer4_20) 		5 GLY L 166
ALA L 170
ALA L 463
ASP L 458
ALA L 455
 None
None
None
None
FAD  L 503 (-3.5A)
 1.24A 4df3A-5jfcL:
undetectable		 4df3A-5jfcL:
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.
5kf7 BIFUNCTIONAL PROTEIN
PUTA

(Sinorhizobium
meliloti) 		PF00171
(Aldedh)
PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		5 ALA A 276
ALA A  22
ASP A 877
ASP A 882
VAL A 881
 None
 1.21A 4df3A-5kf7A:
3.1		 4df3A-5kf7A:
12.27
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.
5kws GALACTOSE-BINDING
PROTEIN

(Yersinia pestis) 		PF13407
(Peripla_BP_4) 		5 LYS A 125
GLY A 297
ALA A 237
ASP A 299
VAL A 298
 None
 1.41A 4df3A-5kwsA:
3.7		 4df3A-5kwsA:
21.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l16 PUTATIVE
SELENOPHOSPHATE
SYNTHETASE

(Leishmania
major) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		5 GLY A 147
ALA A 151
THR A 186
ALA A 252
ASP A 258
 None
 1.43A 4df3A-5l16A:
undetectable		 4df3A-5l16A:
19.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5log PUTATIVE
O-METHYLTRANSFERASE

(Myxococcus
xanthus) 		PF01596
(Methyltransf_3) 		5 GLY A  67
VAL A  97
ASP A 119
ALA A 120
ASP A 142
 SAH  A1001 (-3.5A)
None
SAH  A1001 (-3.8A)
SAH  A1001 (-3.4A)
MG  A1002 (-2.5A)
 1.36A 4df3A-5logA:
14.9		 4df3A-5logA:
24.22
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.
5nag KYNURENINE
3-MONOOXYGENASE

(Pseudomonas
fluorescens) 		PF01494
(FAD_binding_3) 		5 GLY A  19
ALA A  23
ALA A 335
ASP A 330
ALA A 327
 None
None
None
None
FAD  A 501 (-3.6A)
 1.20A 4df3A-5nagA:
2.7		 4df3A-5nagA:
18.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tzy FREE FATTY ACID
RECEPTOR
1,ENDOLYSIN,FREE
FATTY ACID RECEPTOR
1

(Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		5 PHE A  96
ALA A  92
VAL A 134
ALA A  99
VAL A 126
 None
None
7OS  A2403 (-4.6A)
7OS  A2403 (-3.3A)
None
 1.21A 4df3A-5tzyA:
undetectable		 4df3A-5tzyA:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uao TRYPTOPHANE-5-HALOGE
NASE

(Microbispora
sp. ATCC
PTA-5024) 		PF04820
(Trp_halogenase) 		5 GLY A 296
ALA A 259
THR A 256
ALA A 324
VAL A 326
 None
FAD  A 601 ( 4.0A)
None
None
None
 1.40A 4df3A-5uaoA:
4.3		 4df3A-5uaoA:
19.22
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.
5ur2 BIFUNCTIONAL PROTEIN
PUTA

(Bdellovibrio
bacteriovorus) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		5 GLY A 648
ALA A 652
ALA A 603
VAL A 655
ALA A 595
 None
 1.34A 4df3A-5ur2A:
5.0		 4df3A-5ur2A:
13.54
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.
5vhi 26S PROTEASOME
NON-ATPASE
REGULATORY SUBUNIT 6

(Homo sapiens) 		PF01399
(PCI)
PF10602
(RPN7) 		5 THR Y 218
ALA Y 190
ASP Y 193
ALA Y 197
VAL Y 226
 None
 1.44A 4df3A-5vhiY:
undetectable		 4df3A-5vhiY:
19.95
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.
5vj7 OXIDOREDUCTASE

(Pyrococcus
furiosus) 		PF07992
(Pyr_redox_2)
PF14691
(Fer4_20) 		5 GLY A 166
ALA A 170
ALA A 464
ASP A 459
ALA A 456
 None
None
None
None
FAD  A 503 (-2.7A)
 1.28A 4df3A-5vj7A:
4.5		 4df3A-5vj7A:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vpr CYSTEINE DESULFURASE

(Elizabethkingia
anophelis) 		PF00266
(Aminotran_5) 		5 GLY A 176
THR A 149
ALA A 203
ALA A  29
VAL A 333
 None
 1.19A 4df3A-5vprA:
3.6		 4df3A-5vprA:
17.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5zw4 PUTATIVE
O-METHYLTRANSFERASE
YRRM

(Bacillus
subtilis) 		no annotation 5 GLY A  62
ALA A  64
ASP A 113
ALA A 114
ASP A 133
 SAM  A 302 (-3.4A)
SAM  A 302 (-3.6A)
SAM  A 302 (-3.3A)
SAM  A 302 (-3.7A)
SAM  A 302 (-3.6A)
 0.47A 4df3A-5zw4A:
16.3		 4df3A-5zw4A:
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.
6bvg PROTEIN-N(PI)-PHOSPH
OHISTIDINE-SUGAR
PHOSPHOTRANSFERASE
(ENZYME II OF THE
PHOSPHOTRANSFERASE
SYSTEM) (PTS SYSTEM
GLUCOSE-SPECIFIC
IIBC COMPONENT)

(Bacillus cereus) 		no annotation 5 THR A 250
PHE A 393
VAL A  20
ALA A 392
GLN A 310
 None
MAL  A 501 (-4.6A)
None
None
MAL  A 501 (-4.1A)
 1.07A 4df3A-6bvgA:
undetectable		 4df3A-6bvgA:
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.
6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE

(Rhodothermus
marinus) 		no annotation 5 GLY B 540
ALA B 100
ASP B 471
ASP B 539
VAL B 536
 None
 1.02A 4df3A-6f0kB:
2.0		 4df3A-6f0kB:
undetectable