SIMILAR PATTERNS OF AMINO ACIDS FOR 3PS9_A_SAMA670

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.
1dq3 ENDONUCLEASE

(Pyrococcus
furiosus) 		PF09061
(Stirrup)
PF09062
(Endonuc_subdom)
PF14528
(LAGLIDADG_3)
PF14890
(Intein_splicing) 		5 PHE A  56
GLY A 415
ILE A 413
GLY A 126
PHE A 451
 None
 1.22A 3ps9A-1dq3A:
2.0		 3ps9A-1dq3A:
19.80
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.
1e6y METHYL-COENZYME M
REDUCTASE I BETA
SUBUNIT
METHYL-COENZYME M
REDUCTASE SUBUNIT
GAMMA

(Methanosarcina
barkeri;
Methanosarcina
barkeri) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N)
PF02240
(MCR_gamma) 		5 GLY B2344
ASN B2301
LYS B2338
ILE C3236
GLY B2348
 None
None
None
None
SMC  A1472 ( 4.9A)
 1.22A 3ps9A-1e6yB:
2.0		 3ps9A-1e6yB:
20.95
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.
1ekq HYDROXYETHYLTHIAZOLE
KINASE

(Bacillus
subtilis) 		PF02110
(HK) 		5 GLU A 126
GLY A  97
ASN A 123
ILE A  66
GLY A  99
 None
 1.35A 3ps9A-1ekqA:
2.6		 3ps9A-1ekqA:
16.67
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.
1h3q SEDLIN

(Mus musculus) 		PF04628
(Sedlin_N) 		5 PHE A  75
ASN A 118
ASP A 104
ILE A 107
ASN A  58
 None
 1.05A 3ps9A-1h3qA:
undetectable		 3ps9A-1h3qA:
12.22
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.
1lgf P450 MONOOXYGENASE

(Amycolatopsis
orientalis) 		PF00067
(p450) 		5 GLY A 246
ASP A 138
ILE A 140
GLY A 390
PHE A 382
 None
 1.17A 3ps9A-1lgfA:
undetectable		 3ps9A-1lgfA:
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.
1rli TRP REPRESSOR
BINDING PROTEIN

(Bacillus
subtilis) 		PF03358
(FMN_red) 		5 PHE A 140
PHE A  74
ILE A  71
GLY A 149
PHE A 147
 None
 1.24A 3ps9A-1rliA:
2.9		 3ps9A-1rliA:
14.01
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.
1sa3 TYPE II RESTRICTION
ENZYME MSPI

(Moraxella sp.) 		PF09208
(Endonuc-MspI) 		5 GLU A 232
GLY A 244
PHE A 260
ILE A 183
GLY A 242
 None
 1.22A 3ps9A-1sa3A:
undetectable		 3ps9A-1sa3A:
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.
1snz ALDOSE 1-EPIMERASE

(Homo sapiens) 		PF01263
(Aldose_epim) 		5 LYS A  21
PHE A   9
ASP A  32
ILE A  33
GLY A  37
 None
 1.31A 3ps9A-1snzA:
undetectable		 3ps9A-1snzA:
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.
1u8x MALTOSE-6'-PHOSPHATE
GLUCOSIDASE

(Bacillus
subtilis) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		5 GLY X  12
ASN X  42
PHE X  17
ILE X  10
GLY X  14
 NAD  X 900 (-3.6A)
NAD  X 900 (-3.5A)
NAD  X 900 (-4.2A)
None
NAD  X 900 (-3.4A)
 1.35A 3ps9A-1u8xX:
2.6		 3ps9A-1u8xX:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uyw FAB ANTIBODY LIGHT
CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 GLY L  91
ILE L   2
GLY L  89
PHE L  98
MET L   4
 None
 1.12A 3ps9A-1uywL:
undetectable		 3ps9A-1uywL:
15.40
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.
1xfj CONSERVED
HYPOTHETICAL PROTEIN

(Caulobacter
vibrioides) 		PF02578
(Cu-oxidase_4) 		5 PHE A 209
GLY A 188
ASP A 185
GLY A 190
PHE A 192
 None
 1.21A 3ps9A-1xfjA:
undetectable		 3ps9A-1xfjA:
16.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zmb ACETYLXYLAN ESTERASE
RELATED ENZYME

(Clostridium
acetobutylicum) 		PF03629
(SASA) 		5 GLU A  43
GLY A  58
PHE A 221
ILE A  30
ASN A 244
 None
 1.33A 3ps9A-1zmbA:
2.8		 3ps9A-1zmbA:
16.67
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.
2a8x DIHYDROLIPOYL
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 PHE A 269
GLU A 201
GLY A 178
ILE A 176
GLY A 180
 None
 1.28A 3ps9A-2a8xA:
8.0		 3ps9A-2a8xA:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2evv HYPOTHETICAL PROTEIN
HP0218

(Helicobacter
pylori) 		PF01161
(PBP) 		5 GLY A  22
LYS A  19
PHE A  28
ASP A  17
GLY A 126
 None
 1.37A 3ps9A-2evvA:
undetectable		 3ps9A-2evvA:
15.03
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.
2fn9 RIBOSE ABC
TRANSPORTER,
PERIPLASMIC
RIBOSE-BINDING
PROTEIN

(Thermotoga
maritima) 		PF13407
(Peripla_BP_4) 		5 PHE A 152
GLY A 221
PHE A 117
ILE A 219
GLY A 197
 None
 1.37A 3ps9A-2fn9A:
undetectable		 3ps9A-2fn9A:
17.91
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.
2g3n ALPHA-GLUCOSIDASE

(Sulfolobus
solfataricus) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		5 PHE A 411
PHE A 177
ILE A 530
GLY A 443
PHE A 476
 None
 1.20A 3ps9A-2g3nA:
2.5		 3ps9A-2g3nA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gn1 THREONINE
DEHYDRATASE
CATABOLIC

(Salmonella
enterica) 		PF00291
(PALP) 		5 GLY A 313
ASN A  85
PHE A  48
ILE A 280
GLY A 285
 None
LLP  A  58 ( 3.8A)
None
None
LLP  A  58 ( 4.8A)
 1.23A 3ps9A-2gn1A:
4.4		 3ps9A-2gn1A:
18.17
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.
2go4 UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE

(Aquifex
aeolicus) 		PF03331
(LpxC) 		5 GLU A  22
GLY A  21
ASN A  99
GLY A  17
ASN A 214
 None
 1.25A 3ps9A-2go4A:
undetectable		 3ps9A-2go4A:
15.93
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.
2he2 DISCS LARGE HOMOLOG
2

(Homo sapiens) 		PF00595
(PDZ) 		5 GLY A 430
LYS A 488
GLY A 432
PHE A 433
ASN A 434
 None
 1.23A 3ps9A-2he2A:
undetectable		 3ps9A-2he2A:
10.57
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.
2ixl DTDP-4-DEHYDRORHAMNO
SE 3,5-EPIMERASE

(Streptococcus
suis) 		PF00908
(dTDP_sugar_isom) 		5 PHE A   5
GLY A  34
ASN A  32
GLY A  30
PHE A   6
 None
 1.21A 3ps9A-2ixlA:
undetectable		 3ps9A-2ixlA:
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.
2o61 TRANSCRIPTION FACTOR
P65/INTERFERON
REGULATORY FACTOR
7/INTERFERON
REGULATORY FACTOR 3
FUSION PROTEIN

(Homo sapiens) 		PF00554
(RHD_DNA_bind)
PF00605
(IRF)
PF16179
(RHD_dimer) 		5 GLY A 117
ASN A 115
ASP A 185
GLY A  44
MET A  32
 None
 1.40A 3ps9A-2o61A:
undetectable		 3ps9A-2o61A:
20.95
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.
2oy3 MACROPHAGE RECEPTOR
MARCO

(Mus musculus) 		PF00530
(SRCR) 		5 GLU A 435
GLY A 476
ILE A 480
GLY A 474
ASN A 510
 None
 1.39A 3ps9A-2oy3A:
undetectable		 3ps9A-2oy3A:
10.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oz8 MLL7089 PROTEIN

(Mesorhizobium
japonicum) 		PF13378
(MR_MLE_C) 		5 GLU A 222
ASN A 269
PHE A 140
ASP A 174
ILE A 193
 None
None
SO4  A 389 (-4.7A)
None
None
 1.26A 3ps9A-2oz8A:
undetectable		 3ps9A-2oz8A:
21.25
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.
2p10 MLL9387 PROTEIN

(Mesorhizobium
japonicum) 		PF09370
(PEP_hydrolase) 		5 GLU A 262
GLY A  33
ASP A  49
ILE A  48
GLY A 257
 None
None
None
None
CL  A 289 (-3.6A)
 1.28A 3ps9A-2p10A:
undetectable		 3ps9A-2p10A:
17.31
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.
2p67 LAO/AO TRANSPORT
SYSTEM KINASE

(Escherichia
coli) 		PF03308
(ArgK) 		5 GLU A  72
ASN A 109
ASP A 247
ILE A 246
GLY A  75
 None
 1.19A 3ps9A-2p67A:
undetectable		 3ps9A-2p67A:
20.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2paf LACTOSE OPERON
REPRESSOR

(Escherichia
coli) 		PF13377
(Peripla_BP_3) 		5 GLU A 217
GLY A 218
GLY A 187
ASN A 246
MET A 249
 None
None
None
NPF  A 902 (-3.7A)
None
 1.21A 3ps9A-2pafA:
4.7		 3ps9A-2pafA:
17.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qoj INTRON-ENCODED DNA
ENDONUCLEASE I-ANII

(Aspergillus
nidulans) 		PF00961
(LAGLIDADG_1) 		5 PHE Z  85
GLU Z 148
GLY Z  15
ILE Z  34
GLY Z  11
 None
MG  Z 601 ( 2.4A)
MG  Z 603 ( 3.5A)
None
None
 1.30A 3ps9A-2qojZ:
undetectable		 3ps9A-2qojZ:
15.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2qy6 UPF0209 PROTEIN YFCK

(Escherichia
coli) 		PF05430
(Methyltransf_30) 		11 PHE A  44
GLU A  84
GLY A  86
ASN A  92
LYS A 122
PHE A 123
ASP A 176
ILE A 177
GLY A 199
PHE A 200
MET A 208
 None
 0.68A 3ps9A-2qy6A:
38.0		 3ps9A-2qy6A:
43.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2qy6 UPF0209 PROTEIN YFCK

(Escherichia
coli) 		PF05430
(Methyltransf_30) 		11 PHE A  44
GLU A  84
GLY A  86
ASN A  92
PHE A 123
ASP A 176
ILE A 177
GLY A 199
PHE A 200
ASN A 205
MET A 208
 None
 0.75A 3ps9A-2qy6A:
38.0		 3ps9A-2qy6A:
43.03
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.
2rm6 GLUTATHIONE
PEROXIDASE-LIKE
PROTEIN

(Trypanosoma
brucei) 		PF00255
(GSHPx) 		5 GLU A  83
ASN A 111
PHE A  98
ILE A  90
GLY A  85
 None
 1.24A 3ps9A-2rm6A:
2.3		 3ps9A-2rm6A:
13.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v8n LACTOSE PERMEASE

(Escherichia
coli) 		PF01306
(LacY_symp) 		5 PHE A 170
PHE A  29
ILE A 157
GLY A 173
PHE A  87
 None
 1.38A 3ps9A-2v8nA:
undetectable		 3ps9A-2v8nA:
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.
2xsj SULFITE REDUCTASE
BETA SUBUNIT

(Desulfomicrobium
norvegicum) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr)
PF12838
(Fer4_7) 		5 GLY B  50
ILE B  46
GLY B 174
PHE B 173
MET B 176
 None
 1.40A 3ps9A-2xsjB:
undetectable		 3ps9A-2xsjB:
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.
2ynm LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE SUBUNIT B

(Prochlorococcus
marinus) 		PF00148
(Oxidored_nitro)
PF08369
(PCP_red) 		5 GLU D 227
GLY D 305
ASN D 130
GLY D 303
PHE D 302
 None
 1.28A 3ps9A-2ynmD:
undetectable		 3ps9A-2ynmD:
23.22
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.
3aeq LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE SUBUNIT B

(Rhodobacter
capsulatus) 		PF00148
(Oxidored_nitro) 		6 GLU B 214
GLY B 289
ASN B 130
ILE B 293
GLY B 287
PHE B 286
 None
 1.48A 3ps9A-3aeqB:
2.1		 3ps9A-3aeqB:
23.07
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.
3bus METHYLTRANSFERASE

(Lechevalieria
aerocolonigenes) 		PF08241
(Methyltransf_11) 		5 GLU A 245
GLY A 246
PHE A 231
ILE A  23
GLY A 243
 None
 1.22A 3ps9A-3busA:
11.4		 3ps9A-3busA:
17.18
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.
3c5m OLIGOGALACTURONATE
LYASE

(Vibrio
parahaemolyticus) 		PF14583
(Pectate_lyase22) 		5 ASN A  66
ASP A 381
ILE A 379
GLY A  47
ASN A 361
 None
 1.39A 3ps9A-3c5mA:
undetectable		 3ps9A-3c5mA:
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.
3cmt PROTEIN RECA

(Escherichia
coli) 		PF00154
(RecA) 		5 GLY A1052
ASP A 100
ILE A1251
GLY A1054
ASN A1332
 None
ADP  A 502 (-4.4A)
None
None
None
 1.18A 3ps9A-3cmtA:
3.2		 3ps9A-3cmtA:
17.96
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.
3cmt PROTEIN RECA

(Escherichia
coli) 		PF00154
(RecA) 		5 GLY A2052
ASP A1100
ILE A2251
GLY A2054
ASN A2332
 None
ADP  A1502 ( 4.7A)
None
None
None
 1.19A 3ps9A-3cmtA:
3.2		 3ps9A-3cmtA:
17.96
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.
3cmt PROTEIN RECA

(Escherichia
coli) 		PF00154
(RecA) 		5 GLY A3052
ASP A2100
ILE A3251
GLY A3054
ASN A3332
 None
ADP  A2502 (-4.6A)
None
None
None
 1.16A 3ps9A-3cmtA:
3.2		 3ps9A-3cmtA:
17.96
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.
3d3k ENHANCER OF
MRNA-DECAPPING
PROTEIN 3

(Homo sapiens) 		PF03853
(YjeF_N) 		5 GLY A 350
LYS A 346
ASP A 443
ILE A 442
GLY A 309
 None
 1.38A 3ps9A-3d3kA:
3.9		 3ps9A-3d3kA:
18.74
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.
3e79 HIGH AFFINITY
TRANSPORT SYSTEM
PROTEIN P37

(Mycoplasma
hyorhinis) 		PF06646
(Mycoplasma_p37) 		5 GLY A  49
ASP A 105
ILE A 103
GLY A 123
ASN A 125
 None
 1.37A 3ps9A-3e79A:
undetectable		 3ps9A-3e79A:
18.41
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.
3epm THIAMINE
BIOSYNTHESIS PROTEIN
THIC

(Caulobacter
vibrioides) 		PF01964
(ThiC_Rad_SAM)
PF13667
(ThiC-associated) 		5 PHE A 356
GLY A 373
PHE A 370
ILE A 412
GLY A 315
 None
 1.25A 3ps9A-3epmA:
undetectable		 3ps9A-3epmA:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eqn GLUCAN
1,3-BETA-GLUCOSIDASE

(Phanerochaete
chrysosporium) 		PF12708
(Pectate_lyase_3) 		5 GLY A 169
ASP A 159
GLY A 197
PHE A 213
MET A 187
 None
 1.12A 3ps9A-3eqnA:
undetectable		 3ps9A-3eqnA:
21.93
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.
3g3o VACUOLAR TRANSPORTER
CHAPERONE 2

(Saccharomyces
cerevisiae) 		PF09359
(VTC) 		5 GLU A 354
GLY A 350
PHE A 359
ILE A 352
GLY A 355
 None
 1.33A 3ps9A-3g3oA:
undetectable		 3ps9A-3g3oA:
17.75
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.
3giu PYRROLIDONE-CARBOXYL
ATE PEPTIDASE

(Staphylococcus
aureus) 		PF01470
(Peptidase_C15) 		5 GLU A  78
PHE A 139
GLY A  67
PHE A   8
ASN A  17
 None
None
ACY  A 214 (-3.6A)
ACY  A 214 (-4.2A)
ACY  A 214 (-3.2A)
 1.33A 3ps9A-3giuA:
2.8		 3ps9A-3giuA:
15.13
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.
3il4 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Enterococcus
faecalis) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 GLY A 165
ILE A 288
GLY A 163
PHE A 147
ASN A 280
 None
None
None
None
ACO  A 401 (-3.1A)
 1.22A 3ps9A-3il4A:
undetectable		 3ps9A-3il4A:
18.07
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.
3k33 DEATH ON CURING
PROTEIN

(Escherichia
virus P1) 		PF02661
(Fic) 		5 GLU A  33
ASP A  14
ILE A  10
GLY A  30
MET A  26
 None
 1.38A 3ps9A-3k33A:
undetectable		 3ps9A-3k33A:
11.46
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.
3kgb THYMIDYLATE SYNTHASE
1/2

(Encephalitozoon
cuniculi) 		PF00303
(Thymidylat_synt) 		5 PHE A  70
LYS A 109
ASP A 109
GLY A 115
PHE A  71
 None
 1.31A 3ps9A-3kgbA:
undetectable		 3ps9A-3kgbA:
20.12
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.
3ld8 BIFUNCTIONAL
ARGININE DEMETHYLASE
AND
LYSYL-HYDROXYLASE
JMJD6

(Homo sapiens) 		PF02373
(JmjC) 		5 PHE A  99
GLU A 139
GLY A 138
PHE A 175
ASP A 149
 None
 1.24A 3ps9A-3ld8A:
undetectable		 3ps9A-3ld8A:
19.47
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.
3m4r UNCHARACTERIZED
PROTEIN

(Thermoplasma
acidophilum) 		PF00596
(Aldolase_II) 		5 GLY A  20
ILE A  24
GLY A 194
PHE A 124
MET A 126
 None
 1.17A 3ps9A-3m4rA:
undetectable		 3ps9A-3m4rA:
15.17
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.
3m4r UNCHARACTERIZED
PROTEIN

(Thermoplasma
acidophilum) 		PF00596
(Aldolase_II) 		5 PHE A  72
ILE A  24
GLY A 194
PHE A 124
MET A 126
 None
 1.32A 3ps9A-3m4rA:
undetectable		 3ps9A-3m4rA:
15.17
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.
3n2l OROTATE
PHOSPHORIBOSYLTRANSF
ERASE

(Vibrio cholerae) 		PF00156
(Pribosyltran) 		5 PHE A   9
GLY A  51
PHE A  41
ILE A  78
PHE A  53
 None
 1.37A 3ps9A-3n2lA:
undetectable		 3ps9A-3n2lA:
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.
3nqx SECRETED
METALLOPROTEASE
MCP02

(Pseudoalteromonas
sp. SM9913) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		5 PHE A 371
GLU A 380
GLY A 376
ASN A 387
ILE A 288
 None
CA  A 511 (-2.3A)
None
None
None
 1.41A 3ps9A-3nqxA:
undetectable		 3ps9A-3nqxA:
18.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ps9 TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC

(Escherichia
coli) 		PF01266
(DAO)
PF05430
(Methyltransf_30) 		12 PHE A  24
GLU A  64
GLY A  66
ASN A  72
LYS A 102
PHE A 103
ASP A 156
ILE A 157
GLY A 179
PHE A 180
ASN A 185
MET A 188
 SAM  A 670 ( 4.5A)
SAM  A 670 (-4.0A)
SAM  A 670 (-3.5A)
SAM  A 670 ( 3.7A)
SAM  A 670 (-4.9A)
SAM  A 670 (-4.8A)
SAM  A 670 (-3.5A)
SAM  A 670 (-3.8A)
SAM  A 670 (-3.5A)
SAM  A 670 (-3.6A)
SAM  A 670 ( 4.1A)
SAM  A 670 ( 3.9A)
 0.00A 3ps9A-3ps9A:
67.7		 3ps9A-3ps9A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3pvc TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC

(Yersinia pestis) 		PF01266
(DAO)
PF05430
(Methyltransf_30) 		7 GLU A  64
GLY A  66
ASN A  72
ASP A 156
GLY A 179
PHE A 180
MET A 188
 None
 0.77A 3ps9A-3pvcA:
58.8		 3ps9A-3pvcA:
60.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3pvc TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC

(Yersinia pestis) 		PF01266
(DAO)
PF05430
(Methyltransf_30) 		7 GLU A  64
GLY A  66
ASN A  72
LYS A 102
ASP A 156
GLY A 179
MET A 188
 None
 0.49A 3ps9A-3pvcA:
58.8		 3ps9A-3pvcA:
60.38
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.
3qan 1-PYRROLINE-5-CARBOX
YLATE DEHYDROGENASE
1

(Bacillus
halodurans) 		PF00171
(Aldedh) 		5 GLY A 124
ASP A 364
ILE A 363
GLY A 360
PHE A 397
 None
 1.18A 3ps9A-3qanA:
4.2		 3ps9A-3qanA:
21.38
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.
3rbt GLUTATHIONE
TRANSFERASE O1

(Bombyx mori) 		PF13410
(GST_C_2)
PF13417
(GST_N_3) 		5 PHE A 131
GLU A 140
GLY A 138
PHE A 135
GLY A 126
 None
 1.32A 3ps9A-3rbtA:
undetectable		 3ps9A-3rbtA:
16.62
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.
3rjl 1-PYRROLINE-5-CARBOX
YLATE DEHYDROGENASE

(Bacillus
licheniformis) 		PF00171
(Aldedh) 		5 GLY A 125
ASP A 365
ILE A 364
GLY A 361
PHE A 398
 None
 1.14A 3ps9A-3rjlA:
2.8		 3ps9A-3rjlA:
20.23
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.
3u0o SELENIDE, WATER
DIKINASE

(Escherichia
coli) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		5 GLY A  96
ASN A 218
ASP A  51
GLY A 213
ASN A 210
 None
None
MG  A 401 (-3.0A)
None
None
 1.19A 3ps9A-3u0oA:
undetectable		 3ps9A-3u0oA:
19.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u0o SELENIDE, WATER
DIKINASE

(Escherichia
coli) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		5 GLY A  96
ASN A 218
GLY A 213
PHE A  93
ASN A 210
 None
 1.38A 3ps9A-3u0oA:
undetectable		 3ps9A-3u0oA:
19.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3uvf INTRON-ENCODED DNA
ENDONUCLEASE I-HJEMI

(Trichoderma
reesei) 		PF00961
(LAGLIDADG_1) 		5 PHE A  87
GLU A 150
GLY A  17
ILE A  36
GLY A  13
 None
CA  A 303 ( 3.2A)
CA  A 302 ( 3.6A)
None
None
 1.09A 3ps9A-3uvfA:
undetectable		 3ps9A-3uvfA:
15.59
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.
3uvf INTRON-ENCODED DNA
ENDONUCLEASE I-HJEMI

(Trichoderma
reesei) 		PF00961
(LAGLIDADG_1) 		5 PHE A  87
GLU A 150
GLY A  17
PHE A  21
ILE A  36
 None
CA  A 303 ( 3.2A)
CA  A 302 ( 3.6A)
None
None
 1.17A 3ps9A-3uvfA:
undetectable		 3ps9A-3uvfA:
15.59
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.
3vse PUTATIVE
UNCHARACTERIZED
PROTEIN

(Staphylococcus
aureus) 		PF10672
(Methyltrans_SAM) 		5 PHE A  77
GLU A 106
GLY A 111
PHE A 134
GLY A 109
 None
 1.32A 3ps9A-3vseA:
3.6		 3ps9A-3vseA:
19.36
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.
3vwa CYTOPLASMIC EXPORT
PROTEIN 1

(Saccharomyces
cerevisiae) 		no annotation 5 PHE A  98
GLU A 114
ASN A 242
ILE A 199
GLY A 116
 None
 1.28A 3ps9A-3vwaA:
undetectable		 3ps9A-3vwaA:
21.78
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.
3vyw MNMC2

(Aquifex
aeolicus) 		PF05430
(Methyltransf_30) 		5 GLY A 104
ASN A 110
ASP A 174
PHE A 195
ASN A 200
 SAM  A 501 (-3.6A)
SAM  A 501 (-3.6A)
SAM  A 501 (-3.4A)
SAM  A 501 (-3.7A)
SAM  A 501 (-3.2A)
 0.56A 3ps9A-3vywA:
22.3		 3ps9A-3vywA:
19.07
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.
4aw7 GH86A
BETA-PORPHYRANASE

(Bacteroides
plebeius) 		no annotation 5 GLY A 519
ASP A 208
ILE A 553
GLY A 556
ASN A 253
 None
 1.07A 3ps9A-4aw7A:
undetectable		 3ps9A-4aw7A:
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.
4c89 ESTERASE

(Lactobacillus
plantarum) 		PF07859
(Abhydrolase_3) 		5 GLY A 106
ASN A 117
PHE A 285
GLY A 176
ASN A 178
 None
 1.32A 3ps9A-4c89A:
undetectable		 3ps9A-4c89A:
19.82
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.
4cyv HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		5 PHE B 138
ILE B  10
GLY B  23
PHE B  24
MET B 115
 None
 1.41A 3ps9A-4cyvB:
undetectable		 3ps9A-4cyvB:
12.70
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.
4frx ANAEROBICALLY-INDUCE
D OUTER MEMBRANE
PORIN OPRE

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		5 GLY A  38
PHE A  16
ASP A 129
GLY A  63
PHE A  85
 None
 1.16A 3ps9A-4frxA:
undetectable		 3ps9A-4frxA:
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.
4m8j L-CARNITINE/GAMMA-BU
TYROBETAINE
ANTIPORTER

(Proteus
mirabilis) 		PF02028
(BCCT) 		5 GLU A 111
GLY A 108
ILE A 394
GLY A 367
ASN A 369
 None
 1.09A 3ps9A-4m8jA:
undetectable		 3ps9A-4m8jA:
21.21
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.
4mnm CHITINASE A

(Cycas revoluta) 		PF00704
(Glyco_hydro_18) 		5 GLU A  16
PHE A 270
ASP A 334
ILE A 333
ASN A 275
 None
 1.38A 3ps9A-4mnmA:
undetectable		 3ps9A-4mnmA:
20.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mt1 DRUG EFFLUX PROTEIN

(Neisseria
gonorrhoeae) 		PF00873
(ACR_tran) 		5 PHE A 935
GLY A 905
PHE A 553
ILE A 907
GLY A1017
 None
 1.34A 3ps9A-4mt1A:
undetectable		 3ps9A-4mt1A:
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.
4o6g UNCHARACTERIZED
PROTEIN

(Mycobacterium
tuberculosis) 		PF15598
(Imm61) 		5 GLU A 144
GLY A  83
ILE A 156
GLY A  86
PHE A  85
 None
 1.39A 3ps9A-4o6gA:
undetectable		 3ps9A-4o6gA:
13.64
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.
4oig NON-STRUCTURAL
PROTEIN 1, NS1

(Dengue virus) 		PF00948
(Flavi_NS1) 		5 GLU A 326
GLY A 325
PHE A 323
ASP A 276
GLY A 328
 None
 1.32A 3ps9A-4oigA:
undetectable		 3ps9A-4oigA:
14.69
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.
4q4j ABC TRANSPORTER

(Thermotoga
maritima) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane) 		5 GLU A 553
GLY A 549
PHE A 354
ILE A 537
GLY A 547
 None
 1.29A 3ps9A-4q4jA:
undetectable		 3ps9A-4q4jA:
21.48
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.
4r0m MCYG PROTEIN

(Microcystis
aeruginosa) 		no annotation 5 PHE B 300
GLU B 429
GLY B 364
ASN B 210
MET B 209
 None
 1.29A 3ps9A-4r0mB:
undetectable		 3ps9A-4r0mB:
22.03
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.
4rwr STAGE II SPORULATION
PROTEIN D

(Bacillus
anthracis) 		PF08486
(SpoIID) 		5 GLY A 294
ASN A 181
PHE A 176
ASP A 122
GLY A 292
 None
 1.39A 3ps9A-4rwrA:
undetectable		 3ps9A-4rwrA:
17.63
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.
4rzi 3-KETOACYL-ACYL
CARRIER PROTEIN
REDUCTASE

(Synechocystis
sp. PCC 6803) 		no annotation 5 LYS B 207
ASP B 181
ILE B 180
GLY B 236
PHE B 202
 None
 1.27A 3ps9A-4rziB:
2.7		 3ps9A-4rziB:
14.90
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.
4wjb PUTATIVE
AMIDOHYDROLASE/PEPTI
DASE

(Burkholderia
cenocepacia) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 GLU A 203
GLY A 384
ASP A  99
ILE A 196
GLY A 199
 None
None
ZN  A 501 (-1.8A)
None
None
 1.38A 3ps9A-4wjbA:
2.5		 3ps9A-4wjbA:
20.29
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.
4wzb NITROGENASE
MOLYBDENUM-IRON
PROTEIN ALPHA CHAIN

(Azotobacter
vinelandii) 		PF00148
(Oxidored_nitro) 		5 GLU A 261
GLY A 257
ILE A  75
GLY A 255
ASN A  98
 None
 1.24A 3ps9A-4wzbA:
undetectable		 3ps9A-4wzbA:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yai C
ALPHA-DEHYDROGENASE

(Sphingobium sp.
SYK-6) 		PF00106
(adh_short) 		5 GLY A 118
ASN A 141
ASP A  67
GLY A 122
MET A  71
 None
 1.15A 3ps9A-4yaiA:
2.6		 3ps9A-4yaiA:
18.68
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.
4yhs MONOSACCHARIDE ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN, CUT2 FAMILY

(Bradyrhizobium
sp. BTAi1) 		PF13407
(Peripla_BP_4) 		5 GLU A 100
GLY A  97
PHE A  64
ASP A  69
ASN A 148
 None
CL  A 402 ( 3.7A)
None
BTB  A 401 (-4.0A)
None
 1.39A 3ps9A-4yhsA:
2.6		 3ps9A-4yhsA:
18.65
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.
5abm RETINAL
DEHYDROGENASE 1

(Ovis aries) 		PF00171
(Aldedh) 		5 GLY A 111
ASP A 346
ILE A 345
GLY A 342
PHE A 380
 None
 1.20A 3ps9A-5abmA:
undetectable		 3ps9A-5abmA:
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.
5b8i PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Coccidioides
immitis) 		PF00254
(FKBP_C) 		5 ASN C  35
LYS C 127
ILE C 124
GLY C  87
ASN C  21
 None
 1.22A 3ps9A-5b8iC:
undetectable		 3ps9A-5b8iC:
10.18
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.
5c3j CYTOCHROME B-LARGE
SUBUNIT
SUCCINATE
DEHYDROGENASE
[UBIQUINONE]
CYTOCHROME B SMALL
SUBUNIT,
MITOCHONDRIAL

(Ascaris suum;
Ascaris suum) 		PF01127
(Sdh_cyt)
PF05328
(CybS) 		5 GLY C  92
PHE C 103
ILE C  88
GLY C  90
PHE D 139
 None
 1.28A 3ps9A-5c3jC:
undetectable		 3ps9A-5c3jC:
13.15
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.
5e5b FACT COMPLEX SUBUNIT
SPT16

(Homo sapiens) 		PF00557
(Peptidase_M24)
PF14826
(FACT-Spt16_Nlob) 		5 PHE A 356
ASN A 367
PHE A 257
ILE A 379
GLY A 351
 None
 1.13A 3ps9A-5e5bA:
undetectable		 3ps9A-5e5bA:
18.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ex6 CYTOCHROME P450

(Streptomyces
toyocaensis) 		no annotation 5 GLY C 246
ASP C 138
ILE C 140
GLY C 390
PHE C 382
 None
 1.20A 3ps9A-5ex6C:
undetectable		 3ps9A-5ex6C:
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.
5fhz ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3

(Homo sapiens) 		PF00171
(Aldedh) 		5 GLY A 123
ASP A 358
ILE A 357
GLY A 354
PHE A 392
 None
 1.17A 3ps9A-5fhzA:
undetectable		 3ps9A-5fhzA:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fwm HEAT SHOCK PROTEIN
HSP 90 BETA

(Homo sapiens) 		PF00183
(HSP90)
PF02518
(HATPase_c) 		5 GLY A 132
ASN A  46
ILE A  28
GLY A 130
PHE A 129
 ATP  A1691 (-3.7A)
MG  A1692 ( 1.9A)
None
ATP  A1691 (-3.2A)
ATP  A1691 (-4.2A)
 1.23A 3ps9A-5fwmA:
undetectable		 3ps9A-5fwmA:
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.
5m60 BETA-1,3-GLUCANASE

(Chaetomium
thermophilum) 		PF12708
(Pectate_lyase_3) 		5 GLY A 183
ASP A 172
GLY A 213
PHE A 229
MET A 201
 None
 1.08A 3ps9A-5m60A:
undetectable		 3ps9A-5m60A:
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.
5mww RNA POLYMERASE SIGMA
FACTOR SIGA

(Bacillus
subtilis) 		PF03979
(Sigma70_r1_1) 		5 PHE A  12
GLU A  36
ILE A  34
PHE A  41
MET A  48
 None
 1.34A 3ps9A-5mwwA:
undetectable		 3ps9A-5mwwA:
8.43
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.
5w94 MAU2 CHROMATID
COHESION FACTOR
HOMOLOG
SISTER CHROMATID
COHESION PROTEIN 2

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF10345
(Cohesin_load)
no annotation 		5 GLU A  35
GLY A  36
ILE A  27
GLY A  32
PHE B  92
 None
 1.24A 3ps9A-5w94A:
undetectable		 3ps9A-5w94A:
22.27
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.
5wut ULAM111

(Flavobacterium
sp.) 		no annotation 5 GLU A  40
GLY A 209
ASN A  38
ASP A 219
GLY A 214
 None
 1.34A 3ps9A-5wutA:
undetectable		 3ps9A-5wutA:
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.
5xcc PROBABLE SURFACE
PROTEIN

(Clostridium
perfringens) 		no annotation 5 GLY A 339
ASN A 464
ILE A 427
GLY A 399
ASN A 197
 None
 1.07A 3ps9A-5xccA:
undetectable		 3ps9A-5xccA:
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.
6b3e CYCLIN-DEPENDENT
KINASE 12

(Homo sapiens) 		no annotation 5 PHE A1019
GLY A 923
PHE A 930
ILE A 925
MET A 840
 None
 1.31A 3ps9A-6b3eA:
undetectable		 3ps9A-6b3eA:
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.
6b5i RETINAL
DEHYDROGENASE 2

(Homo sapiens) 		no annotation 5 GLY A 129
ASP A 364
ILE A 363
GLY A 360
PHE A 398
 None
 1.15A 3ps9A-6b5iA:
undetectable		 3ps9A-6b5iA:
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.
6fqc BIFUNCTIONAL
ARGININE DEMETHYLASE
AND
LYSYL-HYDROXYLASE
JMJD6

(Homo sapiens) 		no annotation 5 PHE A  99
GLU A 139
GLY A 138
PHE A 175
ASP A 149
 None
 1.20A 3ps9A-6fqcA:
undetectable		 3ps9A-6fqcA:
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.
6fsh OXYB PROTEIN

(Actinoplanes
teichomyceticus) 		no annotation 5 GLY A 246
ASP A 138
ILE A 140
GLY A 390
PHE A 382
 None
 1.21A 3ps9A-6fshA:
undetectable		 3ps9A-6fshA:
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.
6gbh HOPQ

(Helicobacter
pylori) 		no annotation 5 GLY C 109
ASN C 148
ILE C 152
GLY C 140
ASN C 115
 None
 1.12A 3ps9A-6gbhC:
undetectable		 3ps9A-6gbhC:
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.
1bf2 ISOAMYLASE

(Pseudomonas
amyloderamosa) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		4 TYR A 336
GLY A 387
THR A 329
LEU A 328
 None
 0.77A 3ps9A-1bf2A:
undetectable		 3ps9A-1bf2A:
22.86
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.
1fnf FIBRONECTIN

(Homo sapiens) 		PF00041
(fn3) 		4 GLY A1300
THR A1301
LEU A1298
ASP A1328
 None
 0.86A 3ps9A-1fnfA:
undetectable		 3ps9A-1fnfA:
19.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1i4w MITOCHONDRIAL
REPLICATION PROTEIN
MTF1

(Saccharomyces
cerevisiae) 		PF00398
(RrnaAD) 		4 TYR A  22
GLY A  56
GLU A  77
ASP A  52
 None
 1.04A 3ps9A-1i4wA:
6.8		 3ps9A-1i4wA:
18.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mhs PLASMA MEMBRANE
ATPASE

(Neurospora
crassa) 		PF00122
(E1-E2_ATPase)
PF00690
(Cation_ATPase_N)
PF00702
(Hydrolase) 		4 GLY A 381
THR A 382
LEU A 383
ASP A 534
 None
 1.00A 3ps9A-1mhsA:
undetectable		 3ps9A-1mhsA:
21.36
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.
1or8 PROTEIN ARGININE
N-METHYLTRANSFERASE
1

(Rattus
norvegicus) 		PF13649
(Methyltransf_25) 		4 GLY A  80
THR A  81
GLU A 100
ASP A  76
 SAH  A 354 (-3.6A)
SAH  A 354 ( 4.8A)
SAH  A 354 (-2.5A)
SAH  A 354 ( 3.9A)
 0.84A 3ps9A-1or8A:
5.6		 3ps9A-1or8A:
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.
1wy7 HYPOTHETICAL PROTEIN
PH1948

(Pyrococcus
horikoshii) 		PF05175
(MTS) 		4 GLY A  59
THR A  60
GLU A  79
ASP A  55
 SAH  A1001 (-3.3A)
SAH  A1001 (-3.6A)
SAH  A1001 (-2.8A)
SAH  A1001 ( 4.5A)
 0.89A 3ps9A-1wy7A:
10.4		 3ps9A-1wy7A:
13.99
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.
1xi8 MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN

(Pyrococcus
furiosus) 		PF00994
(MoCF_biosynth)
PF03453
(MoeA_N)
PF03454
(MoeA_C) 		4 GLY A 158
THR A 159
LEU A 155
ASP A  43
 None
 0.98A 3ps9A-1xi8A:
4.1		 3ps9A-1xi8A:
20.29
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.
1xp8 RECA PROTEIN

(Deinococcus
radiodurans) 		PF00154
(RecA) 		4 GLY A  55
THR A  54
LEU A  59
ASP A 286
 None
 0.99A 3ps9A-1xp8A:
2.3		 3ps9A-1xp8A:
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.
1yna ENDO-1,4-BETA-XYLANA
SE

(Thermomyces
lanuginosus) 		PF00457
(Glyco_hydro_11) 		4 GLY A  33
THR A  34
LEU A  30
ASP A  11
 None
 0.87A 3ps9A-1ynaA:
undetectable		 3ps9A-1ynaA:
14.24
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.
1yq6 MINOR CAPSID PROTEIN

(Salmonella
virus PRD1) 		PF08949
(DUF1860) 		4 TYR A 207
GLY A 212
THR A 211
LEU A 231
 None
 0.97A 3ps9A-1yq6A:
undetectable		 3ps9A-1yq6A:
12.39
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.
1yq8 MINOR CAPSID PROTEIN

(Salmonella
virus PRD1) 		PF08949
(DUF1860) 		4 TYR A 207
GLY A 212
THR A 211
LEU A 231
 None
 0.93A 3ps9A-1yq8A:
undetectable		 3ps9A-1yq8A:
13.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gks BIFUNCTIONAL SAT/APS
KINASE

(Aquifex
aeolicus) 		PF01583
(APS_kinase)
PF01747
(ATP-sulfurylase)
PF14306
(PUA_2) 		4 TYR A 221
THR A 230
LEU A 194
GLU A 157
 None
 0.88A 3ps9A-2gksA:
undetectable		 3ps9A-2gksA:
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.
2npl COXSACKIEVIRUS AND
ADENOVIRUS RECEPTOR

(Homo sapiens) 		PF13927
(Ig_3) 		4 GLY X  69
THR X  70
LEU X  39
ASP X  41
 None
 0.74A 3ps9A-2nplX:
undetectable		 3ps9A-2nplX:
9.61
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.
2om6 PROBABLE
PHOSPHOSERINE
PHOSPHATASE

(Pyrococcus
horikoshii) 		PF13419
(HAD_2) 		4 GLY A 103
THR A 104
LEU A 101
GLU A 106
 None
 1.00A 3ps9A-2om6A:
undetectable		 3ps9A-2om6A:
15.34
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.
2pg6 CYTOCHROME P450 2A6

(Homo sapiens) 		PF00067
(p450) 		4 GLY A 388
THR A 389
LEU A 385
ASP A 377
 None
 0.99A 3ps9A-2pg6A:
undetectable		 3ps9A-2pg6A:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qdd MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Roseovarius
nubinhibens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 GLY A 296
THR A 297
LEU A 299
ASP A 293
 None
 1.04A 3ps9A-2qddA:
undetectable		 3ps9A-2qddA:
21.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2qy6 UPF0209 PROTEIN YFCK

(Escherichia
coli) 		PF05430
(Methyltransf_30) 		6 TYR A  48
GLY A  88
THR A  89
LEU A  91
GLU A 121
ASP A 198
 None
 0.40A 3ps9A-2qy6A:
38.0		 3ps9A-2qy6A:
43.03
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.
2w01 ADENYLATE CYCLASE

(Synechocystis
sp. PCC 6803) 		PF00211
(Guanylate_cyc) 		4 GLY A 484
THR A 485
LEU A 497
ASP A 507
 None
 1.01A 3ps9A-2w01A:
undetectable		 3ps9A-2w01A:
14.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yln PUTATIVE ABC
TRANSPORTER,
PERIPLASMIC BINDING
PROTEIN, AMINO ACID

(Neisseria
gonorrhoeae) 		PF00497
(SBP_bac_3) 		4 GLY A 258
THR A 259
LEU A 263
ASP A 271
 None
 1.04A 3ps9A-2ylnA:
undetectable		 3ps9A-2ylnA:
17.75
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.
2zuc DNA REPAIR AND
RECOMBINATION
PROTEIN RADA

(Sulfolobus
solfataricus) 		PF08423
(Rad51)
PF14520
(HHH_5) 		4 GLY A  92
THR A  91
LEU A  96
ASP A 321
 None
 1.00A 3ps9A-2zucA:
2.6		 3ps9A-2zucA:
18.44
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.
3a74 LYSYL-TRNA
SYNTHETASE

(Geobacillus
stearothermophilus) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		4 TYR A 193
GLY A 192
LEU A 194
ASP A 189
 None
 0.96A 3ps9A-3a74A:
undetectable		 3ps9A-3a74A:
20.34
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.
3eqx FIC DOMAIN
CONTAINING
TRANSCRIPTIONAL
REGULATOR

(Shewanella
oneidensis) 		PF02661
(Fic)
PF13784
(Fic_N) 		4 GLY A 205
THR A 207
LEU A 211
GLU A  73
 None
 1.02A 3ps9A-3eqxA:
undetectable		 3ps9A-3eqxA:
20.64
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.
3fah ALDEHYDE
OXIDOREDUCTASE

(Desulfovibrio
gigas) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		4 GLY A 191
LEU A 193
GLU A  77
ASP A 198
 None
 0.93A 3ps9A-3fahA:
undetectable		 3ps9A-3fahA:
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.
3glq ADENOSYLHOMOCYSTEINA
SE

(Burkholderia
pseudomallei) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		4 GLY A 203
THR A 202
GLU A 198
ASP A 142
 None
NAD  A 601 (-3.8A)
None
None
 1.01A 3ps9A-3glqA:
3.7		 3ps9A-3glqA:
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.
3gpu DNA GLYCOSYLASE

(Geobacillus
stearothermophilus) 		PF01149
(Fapy_DNA_glyco)
PF06827
(zf-FPG_IleRS)
PF06831
(H2TH) 		4 GLY A 173
LEU A 163
GLU A   3
ASP A 178
 None
 0.94A 3ps9A-3gpuA:
undetectable		 3ps9A-3gpuA:
18.06
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.
3h2b SAM-DEPENDENT
METHYLTRANSFERASE

(Corynebacterium
glutamicum) 		PF13649
(Methyltransf_25) 		4 GLY A 108
THR A 109
GLU A 127
ASP A 104
 SAH  A 301 (-3.4A)
None
SAH  A 301 (-2.6A)
SAH  A 301 ( 4.4A)
 0.94A 3ps9A-3h2bA:
5.1		 3ps9A-3h2bA:
14.39
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.
3h9u ADENOSYLHOMOCYSTEINA
SE

(Trypanosoma
brucei) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		4 GLY A 159
THR A 158
GLU A 154
ASP A 133
 None
NAD  A 438 (-3.6A)
None
None
 0.91A 3ps9A-3h9uA:
5.3		 3ps9A-3h9uA:
19.82
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.
3iuz PUTATIVE GLYOXALASE
SUPERFAMILY PROTEIN

(Cupriavidus
pinatubonensis) 		PF07063
(DUF1338) 		4 THR A 188
LEU A 187
GLU A  36
ASP A 184
 PGE  A 344 ( 4.9A)
None
None
PGE  A 344 ( 3.9A)
 1.04A 3ps9A-3iuzA:
undetectable		 3ps9A-3iuzA:
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.
3k9b LIVER
CARBOXYLESTERASE 1

(Homo sapiens) 		PF00135
(COesterase) 		4 GLY A1469
LEU A1100
GLU A1471
ASP A1467
 None
 0.96A 3ps9A-3k9bA:
undetectable		 3ps9A-3k9bA:
22.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lhk PUTATIVE DNA BINDING
PROTEIN MJ0014

(Methanocaldococcus
jannaschii) 		PF00239
(Resolvase) 		4 GLY A 106
THR A 138
LEU A 137
ASP A 102
 None
 0.96A 3ps9A-3lhkA:
2.6		 3ps9A-3lhkA:
13.10
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.
3lsp DEST

(Pseudomonas
aeruginosa) 		PF00440
(TetR_N) 		4 GLY A 117
LEU A 119
GLU A 113
ASP A  57
 None
 0.91A 3ps9A-3lspA:
undetectable		 3ps9A-3lspA:
15.82
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.
3n23 SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1

(Sus scrofa) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF13246
(Cation_ATPase) 		4 GLY A 372
THR A 373
LEU A 374
ASP A 586
 PHD  A 369 ( 4.9A)
PHD  A 369 ( 3.3A)
PHD  A 369 ( 3.9A)
None
 0.98A 3ps9A-3n23A:
undetectable		 3ps9A-3n23A:
21.93
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.
3n29 CARBOXYNORSPERMIDINE
DECARBOXYLASE

(Campylobacter
jejuni) 		PF00278
(Orn_DAP_Arg_deC) 		4 TYR A 378
GLY A 352
THR A 349
LEU A 355
 None
 0.96A 3ps9A-3n29A:
undetectable		 3ps9A-3n29A:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n58 ADENOSYLHOMOCYSTEINA
SE

(Brucella
abortus) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		4 GLY A 196
THR A 195
GLU A 191
ASP A 135
 None
NAD  A 550 (-3.7A)
None
None
 1.01A 3ps9A-3n58A:
3.2		 3ps9A-3n58A:
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.
3ohm 1-PHOSPHATIDYLINOSIT
OL-4,5-BISPHOSPHATE
PHOSPHODIESTERASE
BETA-3

(Homo sapiens) 		PF00168
(C2)
PF00387
(PI-PLC-Y)
PF00388
(PI-PLC-X)
PF09279
(EF-hand_like) 		4 TYR B 279
GLY B 302
LEU B 300
GLU B 303
 None
 0.84A 3ps9A-3ohmB:
undetectable		 3ps9A-3ohmB:
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.
3one ADENOSYLHOMOCYSTEINA
SE

(Lupinus luteus) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		4 GLY A 209
THR A 208
GLU A 204
ASP A 142
 None
NAD  A 501 (-3.7A)
None
None
 1.01A 3ps9A-3oneA:
undetectable		 3ps9A-3oneA:
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.
3pih UVRABC SYSTEM
PROTEIN A

(Thermotoga
maritima) 		PF00005
(ABC_tran) 		4 TYR A 890
GLY A 888
LEU A 880
GLU A 887
 None
 1.01A 3ps9A-3pihA:
3.0		 3ps9A-3pihA:
20.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ps9 TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC

(Escherichia
coli) 		PF01266
(DAO)
PF05430
(Methyltransf_30) 		6 TYR A  28
GLY A  68
THR A  69
LEU A  71
GLU A 101
ASP A 178
 SAM  A 670 (-4.5A)
SAM  A 670 (-3.2A)
SAM  A 670 (-3.6A)
SAM  A 670 (-3.8A)
SAM  A 670 (-2.6A)
SAM  A 670 (-3.4A)
 0.03A 3ps9A-3ps9A:
67.7		 3ps9A-3ps9A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3pvc TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC

(Yersinia pestis) 		PF01266
(DAO)
PF05430
(Methyltransf_30) 		5 GLY A  68
THR A  69
LEU A  71
GLU A 101
ASP A 178
 None
 0.47A 3ps9A-3pvcA:
58.8		 3ps9A-3pvcA:
60.38
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.
3px2 N-METHYLTRANSFERASE

(Streptomyces
fradiae) 		PF13649
(Methyltransf_25) 		4 GLY A  60
THR A  61
GLU A  79
ASP A  56
 SAH  A 263 (-3.3A)
None
SAH  A 263 (-2.7A)
None
 1.01A 3ps9A-3px2A:
9.7		 3ps9A-3px2A:
17.96
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.
3ro2 G-PROTEIN-SIGNALING
MODULATOR 2

(Mus musculus) 		PF13176
(TPR_7)
PF13424
(TPR_12) 		4 GLY A 202
THR A 204
LEU A 208
ASP A 213
 None
 1.03A 3ps9A-3ro2A:
undetectable		 3ps9A-3ro2A:
17.60
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.
3ro8 ENDO-1,4-BETA-XYLANA
SE

(Paenibacillus
sp. JDR-2) 		PF00331
(Glyco_hydro_10) 		4 GLY A  28
THR A  29
LEU A  33
ASP A  25
 None
 0.95A 3ps9A-3ro8A:
undetectable		 3ps9A-3ro8A:
18.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t1w FOUR-DOMAIN
FIBRONECTIN FRAGMENT

(Homo sapiens) 		PF00041
(fn3) 		4 GLY A1422
THR A1423
LEU A1420
ASP A1450
 None
 0.81A 3ps9A-3t1wA:
undetectable		 3ps9A-3t1wA:
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.
3v4o MUCOSA-ASSOCIATED
LYMPHOID TISSUE
LYMPHOMA
TRANSLOCATION
PROTEIN 1

(Homo sapiens) 		PF00656
(Peptidase_C14) 		4 GLY A 405
THR A 454
LEU A 402
ASP A 342
 None
 1.02A 3ps9A-3v4oA:
2.8		 3ps9A-3v4oA:
16.74
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.
3vdg PROBABLE GLUCARATE
DEHYDRATASE

(Mycolicibacterium
smegmatis) 		PF13378
(MR_MLE_C) 		4 GLY A 196
THR A  26
GLU A 203
ASP A 222
 None
None
None
NA  A 502 (-2.9A)
 0.91A 3ps9A-3vdgA:
undetectable		 3ps9A-3vdgA:
23.63
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.
3vyw MNMC2

(Aquifex
aeolicus) 		PF05430
(Methyltransf_30) 		4 TYR A  67
GLY A 106
GLU A 133
ASP A 193
 SAM  A 501 (-4.5A)
SAM  A 501 (-3.3A)
SAM  A 501 (-2.3A)
SAM  A 501 (-3.8A)
 0.35A 3ps9A-3vywA:
22.3		 3ps9A-3vywA:
19.07
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.
3wst PROTEIN ARGININE
N-METHYLTRANSFERASE
7

(Caenorhabditis
elegans) 		PF13649
(Methyltransf_25) 		5 GLY A  74
THR A  75
LEU A  77
GLU A  94
ASP A  70
 SAH  A 701 ( 3.8A)
None
None
SAH  A 701 (-2.7A)
SAH  A 701 ( 4.4A)
 1.27A 3ps9A-3wstA:
4.4		 3ps9A-3wstA:
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.
3zcw KINESIN-LIKE PROTEIN
KIF11

(Homo sapiens) 		PF00225
(Kinesin) 		4 GLY A 151
THR A 152
LEU A 147
ASP A 149
 None
 0.84A 3ps9A-3zcwA:
undetectable		 3ps9A-3zcwA:
18.97
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.
3zty MANNOSYL-3-PHOSPHOGL
YCERATE PHOSPHATASE

(Thermus
thermophilus) 		PF08282
(Hydrolase_3) 		4 GLY A   9
THR A  10
LEU A  11
GLU A  14
 GD  A 262 ( 4.4A)
None
None
GD  A 262 (-3.0A)
 0.87A 3ps9A-3ztyA:
undetectable		 3ps9A-3ztyA:
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.
4c4a PROTEIN ARGININE
N-METHYLTRANSFERASE
7

(Mus musculus) 		PF06325
(PrmA) 		5 GLY A  74
THR A  75
LEU A  77
GLU A  94
ASP A  70
 SAH  A1689 ( 3.7A)
SAH  A1689 ( 4.7A)
SAH  A1689 ( 4.5A)
SAH  A1689 (-2.6A)
SAH  A1689 ( 4.4A)
 1.18A 3ps9A-4c4aA:
6.2		 3ps9A-4c4aA:
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.
4c4a PROTEIN ARGININE
N-METHYLTRANSFERASE
7

(Mus musculus) 		PF06325
(PrmA) 		5 TYR A  35
GLY A  74
THR A  75
LEU A  77
GLU A  94
 SAH  A1689 (-4.5A)
SAH  A1689 ( 3.7A)
SAH  A1689 ( 4.7A)
SAH  A1689 ( 4.5A)
SAH  A1689 (-2.6A)
 0.82A 3ps9A-4c4aA:
6.2		 3ps9A-4c4aA:
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.
4g9k ROTENONE-INSENSITIVE
NADH-UBIQUINONE
OXIDOREDUCTASE

(Saccharomyces
cerevisiae) 		PF07992
(Pyr_redox_2) 		4 TYR A 467
GLY A 469
THR A 468
LEU A 477
 TYR  A 467 ( 1.3A)
GLY  A 469 ( 0.0A)
THR  A 468 ( 0.8A)
LEU  A 477 ( 0.6A)
 0.96A 3ps9A-4g9kA:
5.9		 3ps9A-4g9kA:
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.
4gnk 1-PHOSPHATIDYLINOSIT
OL 4,5-BISPHOSPHATE
PHOSPHODIESTERASE
BETA-3

(Homo sapiens) 		PF00168
(C2)
PF00387
(PI-PLC-Y)
PF00388
(PI-PLC-X)
PF09279
(EF-hand_like) 		4 TYR B 279
GLY B 302
LEU B 300
GLU B 303
 None
 0.97A 3ps9A-4gnkB:
undetectable		 3ps9A-4gnkB:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hwg UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Rickettsia
bellii) 		PF02350
(Epimerase_2) 		4 GLY A 283
THR A 284
GLU A 304
ASP A 281
 None
 0.98A 3ps9A-4hwgA:
2.3		 3ps9A-4hwgA:
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.
4kam O-ACETYLHOMOSERINE
SULFHYDRYLASE METC

(Mycobacterium
marinum) 		PF01053
(Cys_Met_Meta_PP) 		4 TYR A 122
GLY A 124
THR A 125
LEU A 121
 SO4  A 502 (-4.5A)
None
None
None
 1.01A 3ps9A-4kamA:
undetectable		 3ps9A-4kamA:
20.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kyi VIPD

(Legionella
pneumophila) 		PF01734
(Patatin) 		4 TYR A  50
GLY A  75
THR A  78
LEU A  82
 None
 1.03A 3ps9A-4kyiA:
3.1		 3ps9A-4kyiA:
22.13
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.
4lg8 PRE-MRNA-PROCESSING
FACTOR 19

(Homo sapiens) 		PF00400
(WD40) 		4 GLY A 240
THR A 239
LEU A 216
ASP A 243
 None
 0.96A 3ps9A-4lg8A:
undetectable		 3ps9A-4lg8A:
19.24
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.
4lvc S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE
(SAHASE)

(Bradyrhizobium
elkanii) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		4 GLY A 201
THR A 200
GLU A 196
ASP A 138
 None
GOL  A 504 ( 2.9A)
None
None
 1.01A 3ps9A-4lvcA:
3.4		 3ps9A-4lvcA:
21.19
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.
4lwo ARGININE
N-METHYLTRANSFERASE,
PUTATIVE

(Trypanosoma
brucei) 		no annotation 4 GLY B  64
THR B  65
GLU B  84
ASP B  60
 None
 0.94A 3ps9A-4lwoB:
5.6		 3ps9A-4lwoB:
18.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mnr PEPTIDOGLYCAN
GLYCOSYLTRANSFERASE

(Eggerthella
lenta) 		PF00905
(Transpeptidase) 		4 GLY A 199
THR A 202
GLU A 200
ASP A 196
 None
 1.04A 3ps9A-4mnrA:
undetectable		 3ps9A-4mnrA:
22.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nk2 HEMOGLOBIN-LIKE
PROTEIN

(Methylacidiphilum
infernorum) 		PF01152
(Bac_globin) 		4 TYR A 111
GLY A 116
THR A 112
LEU A 113
 HEM  A 700 (-4.5A)
None
None
None
 0.99A 3ps9A-4nk2A:
undetectable		 3ps9A-4nk2A:
14.72
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.
4obs ALPHA-L-IDURONIDASE

(Homo sapiens) 		PF01229
(Glyco_hydro_39) 		4 TYR A  76
THR A 366
LEU A 365
GLU A 508
 None
 0.94A 3ps9A-4obsA:
undetectable		 3ps9A-4obsA:
23.52
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.
4p37 PUTATIVE POLY(A)
POLYMERASE CATALYTIC
SUBUNIT

(Megavirus
chiliensis) 		no annotation 4 GLY B 328
THR B 327
LEU B 323
GLU B 345
 PEG  B 604 ( 4.1A)
None
None
None
 0.96A 3ps9A-4p37B:
undetectable		 3ps9A-4p37B:
20.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pqi IN2-1 FAMILY
PROTEIN, GLUTATHIONE
TRANSFERASE LAMBDA3

(Populus
trichocarpa) 		PF13410
(GST_C_2)
PF13417
(GST_N_3) 		5 TYR A  79
GLY A  95
THR A  94
LEU A  87
GLU A  96
 None
None
None
None
GSH  A 301 (-3.2A)
 1.48A 3ps9A-4pqiA:
undetectable		 3ps9A-4pqiA:
15.67
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.
4qj4 1-PHOSPHATIDYLINOSIT
OL 4,5-BISPHOSPHATE
PHOSPHODIESTERASE
BETA-3

(Homo sapiens) 		PF00168
(C2)
PF00387
(PI-PLC-Y)
PF00388
(PI-PLC-X)
PF09279
(EF-hand_like) 		4 TYR B 279
GLY B 302
LEU B 300
GLU B 303
 None
 0.86A 3ps9A-4qj4B:
undetectable		 3ps9A-4qj4B:
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.
4qpp PROTEIN ARGININE
N-METHYLTRANSFERASE
6

(Homo sapiens) 		PF13649
(Methyltransf_25) 		4 GLY A  92
THR A  93
GLU A 112
ASP A  88
 SAH  A1000 ( 3.7A)
None
SAH  A1000 (-2.7A)
SAH  A1000 ( 4.2A)
 0.92A 3ps9A-4qppA:
5.3		 3ps9A-4qppA:
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.
4r42 ALR3090 PROTEIN

(Nostoc sp. PCC
7120) 		PF05067
(Mn_catalase) 		4 TYR A 115
GLY A  31
LEU A  36
GLU A  27
 None
 1.01A 3ps9A-4r42A:
undetectable		 3ps9A-4r42A:
16.44
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.
4u0z ADENOSINE
MONOPHOSPHATE-PROTEI
N TRANSFERASE FICD

(Homo sapiens) 		PF02661
(Fic) 		4 TYR A 163
GLY A 147
THR A 144
LEU A 143
 None
 0.99A 3ps9A-4u0zA:
undetectable		 3ps9A-4u0zA:
20.12
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.
4wse PUTATIVE POLY(A)
POLYMERASE CATALYTIC
SUBUNIT

(Acanthamoeba
polyphaga
mimivirus) 		no annotation 4 GLY A 328
THR A 327
LEU A 323
GLU A 345
 None
 0.96A 3ps9A-4wseA:
undetectable		 3ps9A-4wseA:
19.39
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.
4xj6 VC0179-LIKE PROTEIN

(Escherichia
coli) 		no annotation 4 GLY A 320
THR A 321
LEU A 318
ASP A   4
 None
 0.85A 3ps9A-4xj6A:
undetectable		 3ps9A-4xj6A:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xqk LLABIII

(Lactococcus
lactis) 		PF00271
(Helicase_C)
PF02384
(N6_Mtase)
PF04851
(ResIII)
PF13156
(Mrr_cat_2) 		4 GLY A 906
THR A 907
GLU A 944
ASP A 902
 None
 0.89A 3ps9A-4xqkA:
undetectable		 3ps9A-4xqkA:
17.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yn0 TUMOR NECROSIS
FACTOR RECEPTOR
SUPERFAMILY MEMBER
21

(Mus musculus) 		PF00020
(TNFR_c6) 		4 GLY A  52
THR A  53
LEU A  50
GLU A 100
 None
 0.98A 3ps9A-4yn0A:
undetectable		 3ps9A-4yn0A:
14.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yxm DNA INTEGRITY
SCANNING PROTEIN
DISA

(Thermotoga
maritima) 		PF00633
(HHH)
PF02457
(DisA_N)
PF10635
(DisA-linker) 		4 GLY A  21
THR A  22
LEU A  24
ASP A  29
 None
 1.01A 3ps9A-4yxmA:
undetectable		 3ps9A-4yxmA:
19.76
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.
5a6c G-PROTEIN-SIGNALING
MODULATOR 2, AFADIN

(Homo sapiens) 		PF13176
(TPR_7)
PF13181
(TPR_8)
PF13424
(TPR_12) 		4 GLY A 202
THR A 204
LEU A 208
ASP A 213
 None
 0.99A 3ps9A-5a6cA:
undetectable		 3ps9A-5a6cA:
20.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bsz N-METHYLTRANSFERASE

(Streptoalloteichus
sp. ATCC 53650) 		PF13649
(Methyltransf_25) 		4 GLY A  55
THR A  56
GLU A  74
ASP A  51
 SAH  A 301 ( 3.7A)
None
SAH  A 301 (-2.9A)
SAH  A 301 ( 4.7A)
 0.99A 3ps9A-5bszA:
4.7		 3ps9A-5bszA:
17.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5exk LIPOYL SYNTHASE

(Mycobacterium
tuberculosis) 		PF04055
(Radical_SAM)
PF16881
(LIAS_N) 		4 GLY A 151
THR A 150
LEU A 115
GLU A 175
 None
 1.03A 3ps9A-5exkA:
undetectable		 3ps9A-5exkA:
18.78
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.
5fg0 E3 UBIQUITIN-PROTEIN
LIGASE LISTERIN

(Saccharomyces
cerevisiae) 		no annotation 4 GLY A 139
THR A 140
LEU A 137
GLU A 142
 EDO  A 502 ( 3.9A)
None
None
EDO  A 502 (-3.9A)
 0.99A 3ps9A-5fg0A:
undetectable		 3ps9A-5fg0A:
19.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fub PROTEIN ARGININE
METHYLTRANSFERASE 2

(Danio rerio) 		PF13649
(Methyltransf_25) 		4 GLY A 125
THR A 126
GLU A 146
ASP A 121
 SAH  A 409 ( 3.7A)
None
SAH  A 409 (-2.6A)
SAH  A 409 ( 4.5A)
 0.92A 3ps9A-5fubA:
5.6		 3ps9A-5fubA:
19.01
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.
5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2

(Mus musculus) 		PF05175
(MTS) 		4 GLY A 159
THR A 160
GLU A 180
ASP A 155
 SAH  A1446 ( 3.9A)
None
SAH  A1446 (-2.7A)
SAH  A1446 ( 4.5A)
 0.96A 3ps9A-5fulA:
5.7		 3ps9A-5fulA:
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.
5h29 THIOREDOXIN
REDUCTASE/GLUTATHION
E-RELATED PROTEIN

(Enterococcus
faecalis) 		no annotation 4 GLY A 440
THR A 439
LEU A 431
GLU A 514
 None
 0.96A 3ps9A-5h29A:
undetectable		 3ps9A-5h29A:
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.
5ijg CYS/MET METABOLISM
PYRIDOXAL-PHOSPHATE-
DEPENDENT ENZYME

(Brucella
melitensis) 		PF01053
(Cys_Met_Meta_PP) 		4 TYR A 132
GLY A 134
THR A 135
LEU A 131
 PLP  A 501 (-3.5A)
None
None
None
 0.98A 3ps9A-5ijgA:
undetectable		 3ps9A-5ijgA:
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.
5k04 UNCHARACTERIZED
PROTEIN

(Candida
albicans) 		PF09797
(NatB_MDM20) 		4 TYR A 186
THR A 187
LEU A 188
GLU A 194
 None
 0.97A 3ps9A-5k04A:
undetectable		 3ps9A-5k04A:
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.
5kca CEREBELLIN-1,CEREBEL
LIN-1,CEREBELLIN-1,G
LUTAMATE RECEPTOR
IONOTROPIC, DELTA-2

(Homo sapiens) 		PF00386
(C1q)
PF01094
(ANF_receptor) 		4 GLY A 144
THR A 126
GLU A 151
ASP A 147
 None
 1.04A 3ps9A-5kcaA:
3.1		 3ps9A-5kcaA:
21.59
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.
5ltm PHENYLALANINE
AMMONIA LYASE

(Anabaena) 		no annotation 4 GLY B 458
THR B 460
LEU B 464
ASP B 373
 None
 1.01A 3ps9A-5ltmB:
undetectable		 3ps9A-5ltmB:
22.97
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.
5tu4 PAGF
PRENYLTRANSFERASE

(Planktothrix
agardhii) 		no annotation 4 GLY A 224
THR A 223
LEU A 234
GLU A 184
 None
 0.95A 3ps9A-5tu4A:
undetectable		 3ps9A-5tu4A:
17.74
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.
5v41 POLYKETIDE SYNTHASE
PKS13 (TERMINATION
POLYKETIDE SYNTHASE)

(Mycobacterium
tuberculosis) 		PF00975
(Thioesterase) 		4 GLY A1505
LEU A1638
GLU A1509
ASP A1606
 None
 1.01A 3ps9A-5v41A:
undetectable		 3ps9A-5v41A:
18.71
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.
5v96 S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE

(Naegleria
fowleri) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		4 GLY A 201
THR A 200
GLU A 196
ASP A 139
 None
NAD  A 501 (-3.6A)
None
EDO  A 512 (-3.3A)
 1.01A 3ps9A-5v96A:
3.3		 3ps9A-5v96A:
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.
5wrp PYRUVATE KINASE

(Mycobacterium
tuberculosis) 		no annotation 4 GLY A 410
THR A 411
LEU A 405
ASP A 305
 None
 1.00A 3ps9A-5wrpA:
undetectable		 3ps9A-5wrpA:
19.85
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.
5yb7 L-AMINO ACID
OXIDASE/MONOOXYGENAS
E

(Pseudomonas sp.
AIU 813) 		no annotation 4 TYR A 400
GLY A 398
THR A 399
LEU A 414
 None
 0.98A 3ps9A-5yb7A:
3.7		 3ps9A-5yb7A:
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.
5ygu DIAMINOPIMELATE
EPIMERASE

(Escherichia
coli) 		no annotation 4 TYR A 139
GLY A 151
THR A 138
LEU A 149
 None
None
None
IOD  A 306 ( 4.4A)
 1.00A 3ps9A-5yguA:
undetectable		 3ps9A-5yguA:
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.
5zgb PSAF

(Cyanidioschyzon
merolae) 		no annotation 4 TYR F 131
THR F 132
LEU F 129
GLU F 134
 None
None
CLA  F 301 (-3.9A)
None
 1.00A 3ps9A-5zgbF:
undetectable		 3ps9A-5zgbF:
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.
6c9k DARP14 - SUBUNIT A
WITH DARPIN

(synthetic
construct) 		no annotation 4 GLY A 139
THR A 133
LEU A 130
GLU A  69
 None
 1.03A 3ps9A-6c9kA:
undetectable		 3ps9A-6c9kA:
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.
6cjb CYSTATHIONINE
BETA-LYASE

(Legionella
pneumophila) 		no annotation 4 TYR A 101
GLY A 103
THR A 104
LEU A 100
 LLP  A 199 (-3.7A)
None
None
None
 1.02A 3ps9A-6cjbA:
undetectable		 3ps9A-6cjbA:
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.
6dgc ISC1926 TNPA
C-TERMINAL CATALYTIC
DOMAIN

(Sulfolobus sp.
L00 11) 		no annotation 4 GLY A 110
THR A 142
LEU A 141
ASP A 106
 None
 1.00A 3ps9A-6dgcA:
2.7		 3ps9A-6dgcA:
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.
6eno DEHYDRATASE FAMILY
PROTEIN

(Carboxydothermus
hydrogenoformans) 		no annotation 4 TYR A 376
GLY A 281
THR A 282
GLU A 306
 BJ8  A 501 (-4.8A)
None
BJ8  A 501 (-3.9A)
None
 0.80A 3ps9A-6enoA:
undetectable		 3ps9A-6enoA:
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.
6f3m -

(-) 		no annotation 4 GLY B 168
THR B 167
GLU B 163
ASP B 142
 None
NAD  B 501 (-3.8A)
None
None
 1.04A 3ps9A-6f3mB:
4.0		 3ps9A-6f3mB:
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.
6fht BACTERIOPHYTOCHROME,
ADENYLATE CYCLASE

(Synechocystis
sp. PCC 6803;
Deinococcus
radiodurans) 		no annotation 4 GLY A 585
THR A 586
LEU A 598
ASP A 608
 None
 0.97A 3ps9A-6fhtA:
undetectable		 3ps9A-6fhtA:
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.
6g42 MINOR CAPSID PROTEIN

(Cafeteriavirus-dependent
mavirus) 		no annotation 4 TYR A 211
GLY A 228
THR A 227
LEU A 213
 None
 0.73A 3ps9A-6g42A:
undetectable		 3ps9A-6g42A:
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.
6gbn -

(-) 		no annotation 4 GLY A 163
THR A 162
GLU A 158
ASP A 137
 None
NAD  A 502 (-3.7A)
None
None
 1.00A 3ps9A-6gbnA:
4.0		 3ps9A-6gbnA:
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.
6gh2 LAMINARIBIOSE
PHOSPHORYLASE

(Paenibacillus
sp. YM1) 		no annotation 4 TYR A 492
THR A 486
LEU A 485
GLU A 572
 None
 0.99A 3ps9A-6gh2A:
undetectable		 3ps9A-6gh2A:
undetectable