SIMILAR PATTERNS OF AMINO ACIDS FOR 1FXH_B_PACB1001

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.
1cmx PROTEIN (UBIQUITIN
YUH1-UBAL)

(Saccharomyces
cerevisiae) 		PF01088
(Peptidase_C12) 		4 PHE A 115
SER A 124
PHE A 129
SER A 120
 None
 0.84A 1fxhA-1cmxA:
0.0
1fxhB-1cmxA:
0.0		 1fxhA-1cmxA:
19.43
1fxhB-1cmxA:
16.37
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.
1cp9 PENICILLIN G AMIDASE

(Providencia
rettgeri) 		PF01804
(Penicil_amidase) 		5 SER B   1
PHE B  24
SER B  67
ALA B  69
ILE B 177
 None
 0.59A 1fxhA-1cp9B:
0.0
1fxhB-1cp9B:
57.9		 1fxhA-1cp9B:
18.70
1fxhB-1cp9B:
64.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1cp9 PENICILLIN G AMIDASE
PENICILLIN G AMIDASE

(Providencia
rettgeri;
Providencia
rettgeri) 		PF01804
(Penicil_amidase)
PF01804
(Penicil_amidase) 		5 PHE A 144
SER B   1
PHE B  24
ALA B  69
ILE B 177
 None
 0.62A 1fxhA-1cp9A:
23.4
1fxhB-1cp9A:
undetectable		 1fxhA-1cp9A:
64.25
1fxhB-1cp9A:
16.55
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.
1dpp DIPEPTIDE BINDING
PROTEIN

(Escherichia
coli) 		PF00496
(SBP_bac_5) 		4 PHE A 137
SER A  93
ALA A 155
ILE A 157
 None
 1.05A 1fxhA-1dppA:
undetectable
1fxhB-1dppA:
0.0		 1fxhA-1dppA:
18.00
1fxhB-1dppA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ft9 CARBON MONOXIDE
OXIDATION SYSTEM
TRANSCRIPTION
REGULATOR

(Rhodospirillum
rubrum) 		PF13545
(HTH_Crp_2) 		4 MET A 108
PHE A  19
PHE A  98
ILE A   7
 None
None
HEM  A 300 (-4.8A)
None
 1.04A 1fxhA-1ft9A:
0.0
1fxhB-1ft9A:
0.0		 1fxhA-1ft9A:
21.60
1fxhB-1ft9A:
17.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1io1 PHASE 1 FLAGELLIN

(Salmonella
enterica) 		PF00669
(Flagellin_N)
PF00700
(Flagellin_C)
PF08884
(Flagellin_D3) 		4 PHE A 432
SER A  64
ALA A 435
ILE A 436
 None
 0.99A 1fxhA-1io1A:
0.0
1fxhB-1io1A:
0.0		 1fxhA-1io1A:
19.60
1fxhB-1io1A:
23.59
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.
1k5s PENICILLIN G ACYLASE
BETA SUBUNIT

(Escherichia
coli) 		PF01804
(Penicil_amidase) 		4 SER B   1
SER B  67
ALA B  69
ILE B 177
 GRO  B 601 (-2.3A)
GRO  B 601 (-4.6A)
GRO  B 601 (-3.0A)
GRO  B 601 ( 4.4A)
 0.22A 1fxhA-1k5sB:
0.0
1fxhB-1k5sB:
61.7		 1fxhA-1k5sB:
16.67
1fxhB-1k5sB:
99.64
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.
1nr6 CYTOCHROME P450 2C5

(Oryctolagus
cuniculus) 		PF00067
(p450) 		4 SER A 283
PHE A 279
ALA A 287
ILE A 112
 None
None
None
HEM  A 500 (-4.1A)
 0.99A 1fxhA-1nr6A:
undetectable
1fxhB-1nr6A:
0.9		 1fxhA-1nr6A:
18.22
1fxhB-1nr6A:
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.
1qpi PROTEIN
(TETRACYCLINE
REPRESSOR)

(Escherichia
coli) 		PF00440
(TetR_N)
PF02909
(TetR_C) 		4 MET A 120
PHE A 125
ALA A 133
ILE A 134
 None
 0.98A 1fxhA-1qpiA:
0.8
1fxhB-1qpiA:
undetectable		 1fxhA-1qpiA:
21.68
1fxhB-1qpiA:
17.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rdu CONSERVED
HYPOTHETICAL PROTEIN

(Thermotoga
maritima) 		PF02579
(Nitro_FeMo-Co) 		4 PHE A  21
PHE A  27
SER A  18
ALA A  68
 None
 1.07A 1fxhA-1rduA:
undetectable
1fxhB-1rduA:
undetectable		 1fxhA-1rduA:
23.39
1fxhB-1rduA:
14.02
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.
1rh1 COLICIN B

(Escherichia
coli) 		PF01024
(Colicin)
PF03515
(Cloacin) 		4 MET A 444
PHE A 464
ALA A 495
ILE A 373
 None
 1.07A 1fxhA-1rh1A:
undetectable
1fxhB-1rh1A:
0.0		 1fxhA-1rh1A:
16.70
1fxhB-1rh1A:
22.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1s72 50S RIBOSOMAL
PROTEIN L10E

(Haloarcula
marismortui) 		PF00252
(Ribosomal_L16) 		4 PHE H 150
PHE H 134
SER H  68
ALA H 149
 None
 0.97A 1fxhA-1s72H:
undetectable
1fxhB-1s72H:
undetectable		 1fxhA-1s72H:
19.44
1fxhB-1s72H:
14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sig RNA POLYMERASE
PRIMARY SIGMA FACTOR

(Escherichia
coli) 		PF04542
(Sigma70_r2)
PF04546
(Sigma70_ner) 		4 PHE A 419
PHE A 427
ALA A 120
ILE A 123
 None
 0.94A 1fxhA-1sigA:
undetectable
1fxhB-1sigA:
undetectable		 1fxhA-1sigA:
21.31
1fxhB-1sigA:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ub3 ALDOLASE PROTEIN

(Thermus
thermophilus) 		PF01791
(DeoC) 		4 MET A 194
SER A 153
ALA A 182
ILE A 185
 None
None
HPD  A 801 (-3.2A)
None
 0.94A 1fxhA-1ub3A:
undetectable
1fxhB-1ub3A:
undetectable		 1fxhA-1ub3A:
21.72
1fxhB-1ub3A:
17.08
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.
1ulv GLUCODEXTRANASE

(Arthrobacter
globiformis) 		PF00723
(Glyco_hydro_15)
PF09136
(Glucodextran_B)
PF09137
(Glucodextran_N)
PF09985
(Glucodextran_C) 		4 MET A 930
PHE A 806
ALA A 805
ILE A 826
 None
 0.94A 1fxhA-1ulvA:
undetectable
1fxhB-1ulvA:
undetectable		 1fxhA-1ulvA:
10.90
1fxhB-1ulvA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vrg PROPIONYL-COA
CARBOXYLASE, BETA
SUBUNIT

(Thermotoga
maritima) 		PF01039
(Carboxyl_trans) 		4 MET A 410
SER A 338
ALA A 342
ILE A 308
 None
 1.06A 1fxhA-1vrgA:
undetectable
1fxhB-1vrgA:
undetectable		 1fxhA-1vrgA:
19.55
1fxhB-1vrgA:
22.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yln HYPOTHETICAL PROTEIN
VCA0042

(Vibrio cholerae) 		PF07238
(PilZ)
PF12945
(YcgR_2) 		4 SER A  40
SER A  97
ALA A  95
ILE A 105
 OSE  A  39 ( 4.2A)
None
None
None
 1.03A 1fxhA-1ylnA:
undetectable
1fxhB-1ylnA:
undetectable		 1fxhA-1ylnA:
23.66
1fxhB-1ylnA:
19.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ysj PROTEIN YXEP

(Bacillus
subtilis) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 MET A 249
PHE A 182
ALA A 272
ILE A 209
 None
 1.05A 1fxhA-1ysjA:
undetectable
1fxhB-1ysjA:
undetectable		 1fxhA-1ysjA:
19.59
1fxhB-1ysjA:
21.72
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.
1zcz BIFUNCTIONAL PURINE
BIOSYNTHESIS PROTEIN
PURH

(Thermotoga
maritima) 		PF01808
(AICARFT_IMPCHas)
PF02142
(MGS) 		4 PHE A 442
PHE A 402
ALA A 435
ILE A 440
 None
 0.97A 1fxhA-1zczA:
undetectable
1fxhB-1zczA:
undetectable		 1fxhA-1zczA:
18.63
1fxhB-1zczA:
23.14
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.
1zye THIOREDOXIN-DEPENDEN
T PEROXIDE REDUCTASE

(Bos taurus) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		4 PHE A  37
SER A  55
ALA A  53
ILE A  52
 None
 1.06A 1fxhA-1zyeA:
undetectable
1fxhB-1zyeA:
undetectable		 1fxhA-1zyeA:
20.76
1fxhB-1zyeA:
17.92
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.
2d3t FATTY OXIDATION
COMPLEX ALPHA
SUBUNIT

(Pseudomonas
fragi) 		PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N) 		4 PHE A 452
SER A 333
ALA A 330
ILE A 340
 None
 1.01A 1fxhA-2d3tA:
undetectable
1fxhB-2d3tA:
undetectable		 1fxhA-2d3tA:
15.02
1fxhB-2d3tA:
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.
2wsx L-CARNITINE/GAMMA-BU
TYROBETAINE
ANTIPORTER

(Escherichia
coli) 		PF02028
(BCCT) 		4 MET A 408
PHE A 411
SER A 109
ILE A 395
 None
 0.81A 1fxhA-2wsxA:
undetectable
1fxhB-2wsxA:
undetectable		 1fxhA-2wsxA:
18.43
1fxhB-2wsxA:
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.
2x1m METHIONYL-TRNA
SYNTHETASE

(Mycolicibacterium
smegmatis) 		PF09334
(tRNA-synt_1g) 		4 PHE A 290
PHE A 334
ALA A 291
ILE A 262
 None
 1.02A 1fxhA-2x1mA:
undetectable
1fxhB-2x1mA:
undetectable		 1fxhA-2x1mA:
18.10
1fxhB-2x1mA:
23.20
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.
2x3k ACSD

(Dickeya
chrysanthemi) 		PF04183
(IucA_IucC)
PF06276
(FhuF) 		4 MET A  45
SER A  91
PHE A  75
ALA A  52
 None
 1.05A 1fxhA-2x3kA:
undetectable
1fxhB-2x3kA:
undetectable		 1fxhA-2x3kA:
15.65
1fxhB-2x3kA:
23.01
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.
2xdq LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE SUBUNIT B

(Thermosynechococcus
elongatus) 		PF00148
(Oxidored_nitro) 		4 PHE B  39
SER B  22
ALA B  20
ILE B  19
 None
 1.06A 1fxhA-2xdqB:
undetectable
1fxhB-2xdqB:
undetectable		 1fxhA-2xdqB:
17.08
1fxhB-2xdqB:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xry DEOXYRIBODIPYRIMIDIN
E PHOTOLYASE

(Methanosarcina
mazei) 		PF00875
(DNA_photolyase) 		4 PHE A  39
SER A   1
ALA A  42
ILE A  43
 None
 0.95A 1fxhA-2xryA:
undetectable
1fxhB-2xryA:
undetectable		 1fxhA-2xryA:
17.15
1fxhB-2xryA:
22.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yx0 RADICAL SAM ENZYME

(Pyrococcus
horikoshii) 		PF04055
(Radical_SAM)
PF08608
(Wyosine_form) 		4 MET A 251
SER A 291
ALA A 273
ILE A 295
 None
 1.07A 1fxhA-2yx0A:
undetectable
1fxhB-2yx0A:
undetectable		 1fxhA-2yx0A:
21.18
1fxhB-2yx0A:
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.
2z9s PEROXIREDOXIN-1

(Rattus
norvegicus) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		4 PHE A  42
SER A  60
ALA A  58
ILE A  57
 None
 0.96A 1fxhA-2z9sA:
undetectable
1fxhB-2z9sA:
undetectable		 1fxhA-2z9sA:
19.65
1fxhB-2z9sA:
18.43
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.
3acz METHIONINE
GAMMA-LYASE

(Entamoeba
histolytica) 		PF01053
(Cys_Met_Meta_PP) 		4 MET A 252
SER A  77
SER A  70
ILE A  71
 None
 1.05A 1fxhA-3aczA:
undetectable
1fxhB-3aczA:
undetectable		 1fxhA-3aczA:
17.63
1fxhB-3aczA:
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.
3ayh DNA-DIRECTED RNA
POLYMERASE III
SUBUNIT RPC8

(Schizosaccharomyces
pombe) 		PF03876
(SHS2_Rpb7-N)
PF08292
(RNA_pol_Rbc25) 		4 MET B 113
SER B 156
ALA B 189
ILE B 188
 None
 1.05A 1fxhA-3ayhB:
undetectable
1fxhB-3ayhB:
undetectable		 1fxhA-3ayhB:
20.26
1fxhB-3ayhB:
15.61
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.
3bb9 PUTATIVE ORPHAN
PROTEIN

(Shewanella
frigidimarina) 		PF13474
(SnoaL_3) 		4 SER A 123
SER A 110
ALA A 112
ILE A  90
 None
 0.98A 1fxhA-3bb9A:
undetectable
1fxhB-3bb9A:
undetectable		 1fxhA-3bb9A:
22.44
1fxhB-3bb9A:
13.97
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.
3gi8 UNCHARACTERIZED
PROTEIN MJ0609

(Methanocaldococcus
jannaschii) 		PF13520
(AA_permease_2) 		4 PHE C 192
SER C 345
ALA C 195
ILE C 196
 None
 1.04A 1fxhA-3gi8C:
undetectable
1fxhB-3gi8C:
undetectable		 1fxhA-3gi8C:
20.82
1fxhB-3gi8C:
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.
3hpf MUCONATE
CYCLOISOMERASE

(Oceanobacillus
iheyensis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 PHE A 119
PHE A  70
ALA A 109
ILE A 114
 None
 1.02A 1fxhA-3hpfA:
undetectable
1fxhB-3hpfA:
undetectable		 1fxhA-3hpfA:
19.34
1fxhB-3hpfA:
23.31
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.
3j1c CHAPERONIN ALPHA
SUBUNIT

(Acidianus
tengchongensis) 		PF00118
(Cpn60_TCP1) 		4 SER A 397
PHE A 170
ALA A 394
ILE A 217
 None
 0.95A 1fxhA-3j1cA:
undetectable
1fxhB-3j1cA:
undetectable		 1fxhA-3j1cA:
15.94
1fxhB-3j1cA:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jb9 PRE-MRNA-SPLICING
FACTOR CWF11

(Schizosaccharomyces
pombe) 		PF13087
(AAA_12)
PF16399
(Aquarius_N) 		4 PHE X 857
SER X 840
ALA X 843
ILE X 841
 None
 1.03A 1fxhA-3jb9X:
undetectable
1fxhB-3jb9X:
undetectable		 1fxhA-3jb9X:
9.67
1fxhB-3jb9X:
17.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jb9 PRE-MRNA-SPLICING
FACTOR CWF17

(Schizosaccharomyces
pombe) 		PF00400
(WD40) 		4 PHE L  58
SER L 327
ALA L  56
ILE L 334
 None
 1.07A 1fxhA-3jb9L:
undetectable
1fxhB-3jb9L:
undetectable		 1fxhA-3jb9L:
20.00
1fxhB-3jb9L:
20.60
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.
3jcm U4/U6 SMALL NUCLEAR
RIBONUCLEOPROTEIN
PRP4

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		4 SER B 442
SER B 182
ALA B 180
ILE B 224
 None
 1.05A 1fxhA-3jcmB:
undetectable
1fxhB-3jcmB:
undetectable		 1fxhA-3jcmB:
16.34
1fxhB-3jcmB:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k1i PUTATIVE
UNCHARACTERIZED
PROTEIN

(Helicobacter
pylori) 		PF16522
(FliS_cochap) 		4 SER C  43
SER C 108
ALA C 101
ILE C 106
 None
 0.99A 1fxhA-3k1iC:
undetectable
1fxhB-3k1iC:
undetectable		 1fxhA-3k1iC:
21.86
1fxhB-3k1iC:
15.66
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.
3khy PROPIONATE KINASE

(Francisella
tularensis) 		PF00871
(Acetate_kinase) 		4 MET A 275
SER A 297
ALA A 292
ILE A 293
 None
 0.88A 1fxhA-3khyA:
undetectable
1fxhB-3khyA:
undetectable		 1fxhA-3khyA:
18.75
1fxhB-3khyA:
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.
3l5o UNCHARACTERIZED
PROTEIN FROM DUF364
FAMILY

(Desulfitobacterium
hafniense) 		PF04016
(DUF364)
PF13938
(DUF4213) 		4 PHE A 220
SER A 242
ALA A 228
ILE A 231
 None
 1.07A 1fxhA-3l5oA:
undetectable
1fxhB-3l5oA:
undetectable		 1fxhA-3l5oA:
21.17
1fxhB-3l5oA:
18.95
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.
3m1t PUTATIVE
PHOSPHOHYDROLASE

(Shewanella
amazonensis) 		PF08668
(HDOD) 		4 MET A 269
PHE A 110
ALA A 113
ILE A 114
 None
 0.82A 1fxhA-3m1tA:
undetectable
1fxhB-3m1tA:
undetectable		 1fxhA-3m1tA:
20.43
1fxhB-3m1tA:
20.44
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.
3m2p UDP-N-ACETYLGLUCOSAM
INE 4-EPIMERASE

(Bacillus cereus) 		PF01370
(Epimerase) 		4 PHE A 220
SER A 206
ALA A 268
ILE A 222
 None
 1.05A 1fxhA-3m2pA:
undetectable
1fxhB-3m2pA:
0.7		 1fxhA-3m2pA:
20.25
1fxhB-3m2pA:
21.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ml0 PENICILLIN G
ACYLASE, ALPHA
SUBUNIT
PENICILLIN G
ACYLASE, BETA
SUBUNIT

(Alcaligenes
faecalis;
Alcaligenes
faecalis) 		PF01804
(Penicil_amidase)
PF01804
(Penicil_amidase) 		5 MET A 143
PHE A 147
SER B   1
PHE B  24
ALA B  69
 None
 0.68A 1fxhA-3ml0A:
22.3
1fxhB-3ml0A:
undetectable		 1fxhA-3ml0A:
46.01
1fxhB-3ml0A:
16.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ml0 PENICILLIN G
ACYLASE, ALPHA
SUBUNIT
PENICILLIN G
ACYLASE, BETA
SUBUNIT

(Alcaligenes
faecalis;
Alcaligenes
faecalis) 		PF01804
(Penicil_amidase)
PF01804
(Penicil_amidase) 		5 MET A 143
PHE A 147
SER B   1
PHE B  24
ILE B 177
 None
 0.63A 1fxhA-3ml0A:
22.3
1fxhB-3ml0A:
undetectable		 1fxhA-3ml0A:
46.01
1fxhB-3ml0A:
16.76
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.
3ngj DEOXYRIBOSE-PHOSPHAT
E ALDOLASE

(Entamoeba
histolytica) 		PF01791
(DeoC) 		4 MET A 197
SER A 156
ALA A 185
ILE A 188
 None
 0.95A 1fxhA-3ngjA:
undetectable
1fxhB-3ngjA:
undetectable		 1fxhA-3ngjA:
19.67
1fxhB-3ngjA:
16.11
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.
3psf TRANSCRIPTION
ELONGATION FACTOR
SPT6

(Saccharomyces
cerevisiae) 		PF14635
(HHH_7)
PF14639
(YqgF)
PF14641
(HTH_44)
PF14878
(DLD) 		4 PHE A 738
SER A 752
ALA A 810
ILE A 750
 None
 1.06A 1fxhA-3psfA:
undetectable
1fxhB-3psfA:
2.8		 1fxhA-3psfA:
12.15
1fxhB-3psfA:
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.
3psi TRANSCRIPTION
ELONGATION FACTOR
SPT6

(Saccharomyces
cerevisiae) 		PF14635
(HHH_7)
PF14639
(YqgF)
PF14641
(HTH_44)
PF14878
(DLD) 		4 PHE A 738
SER A 752
ALA A 810
ILE A 750
 None
 1.04A 1fxhA-3psiA:
undetectable
1fxhB-3psiA:
2.7		 1fxhA-3psiA:
9.87
1fxhB-3psiA:
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.
3r4r HYPOTHETICAL
FIMBRIAL ASSEMBLY
PROTEIN

(Parabacteroides
distasonis) 		PF06321
(P_gingi_FimA) 		4 SER A 239
SER A 223
ALA A 155
ILE A 154
 None
None
EDO  A 325 (-3.8A)
EDO  A 325 ( 4.4A)
 1.07A 1fxhA-3r4rA:
undetectable
1fxhB-3r4rA:
undetectable		 1fxhA-3r4rA:
21.65
1fxhB-3r4rA:
20.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tef IRON(III) ABC
TRANSPORTER,
PERIPLASMIC
IRON-COMPOUND-BINDIN
G PROTEIN

(Vibrio cholerae) 		PF01497
(Peripla_BP_2) 		4 PHE A 254
SER A 213
PHE A 285
ILE A 252
 None
 1.00A 1fxhA-3tefA:
undetectable
1fxhB-3tefA:
undetectable		 1fxhA-3tefA:
20.81
1fxhB-3tefA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3thc BETA-GALACTOSIDASE

(Homo sapiens) 		PF01301
(Glyco_hydro_35)
PF13364
(BetaGal_dom4_5) 		4 SER A 302
PHE A  48
SER A  52
ILE A 119
 None
 0.87A 1fxhA-3thcA:
undetectable
1fxhB-3thcA:
undetectable		 1fxhA-3thcA:
15.02
1fxhB-3thcA:
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.
3tqq METHIONYL-TRNA
FORMYLTRANSFERASE

(Coxiella
burnetii) 		PF00551
(Formyl_trans_N)
PF02911
(Formyl_trans_C) 		4 PHE A 258
SER A 272
ALA A 274
ILE A 279
 None
 0.99A 1fxhA-3tqqA:
undetectable
1fxhB-3tqqA:
undetectable		 1fxhA-3tqqA:
19.38
1fxhB-3tqqA:
20.47
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.
3wnb PROTEIN TRANSLATION
ELONGATION FACTOR 1A

(Methanosarcina
mazei) 		no annotation 4 MET A  32
SER A  56
ALA A  60
ILE A  63
 None
 0.94A 1fxhA-3wnbA:
undetectable
1fxhB-3wnbA:
undetectable		 1fxhA-3wnbA:
23.28
1fxhB-3wnbA:
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.
4a7l MYOSIN IE HEAVY
CHAIN

(Dictyostelium
discoideum) 		PF00063
(Myosin_head) 		4 MET C 166
SER C 139
SER C 133
ILE C 132
 None
 1.06A 1fxhA-4a7lC:
undetectable
1fxhB-4a7lC:
undetectable		 1fxhA-4a7lC:
14.29
1fxhB-4a7lC:
22.21
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.
4af0 INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE

(Cryptococcus
neoformans) 		PF00478
(IMPDH)
PF00571
(CBS) 		4 MET B  88
SER B 341
SER B 343
ILE B 344
 IMP  B1527 (-4.0A)
None
IMP  B1527 (-2.6A)
None
 1.07A 1fxhA-4af0B:
undetectable
1fxhB-4af0B:
undetectable		 1fxhA-4af0B:
17.13
1fxhB-4af0B:
22.20
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.
4azd ASPARTATE
1-DECARBOXYLASE

(Escherichia
coli) 		PF02261
(Asp_decarbox) 		4 SER A  70
SER A  25
ALA A  27
ILE A  60
 None
MLI  A1120 (-2.5A)
None
MLI  A1120 (-4.0A)
 0.99A 1fxhA-4azdA:
undetectable
1fxhB-4azdA:
undetectable		 1fxhA-4azdA:
19.91
1fxhB-4azdA:
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.
4bax GLUTAMINE SYNTHETASE

(Streptomyces
coelicolor) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		4 MET A 245
SER A 258
ALA A 256
ILE A 317
 None
 1.01A 1fxhA-4baxA:
undetectable
1fxhB-4baxA:
undetectable		 1fxhA-4baxA:
20.75
1fxhB-4baxA:
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.
4bhd SERINE
HYDROXYMETHYLTRANSFE
RASE

(Methanocaldococcus
jannaschii) 		PF00464
(SHMT) 		4 MET A 112
PHE A 168
ALA A 186
ILE A 158
 None
 0.95A 1fxhA-4bhdA:
undetectable
1fxhB-4bhdA:
undetectable		 1fxhA-4bhdA:
17.82
1fxhB-4bhdA:
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.
4d4z DEOXYHYPUSINE
HYDROXYLASE

(Homo sapiens) 		PF13646
(HEAT_2) 		4 MET A  65
SER A  44
ALA A  39
ILE A  40
 None
 1.02A 1fxhA-4d4zA:
undetectable
1fxhB-4d4zA:
undetectable		 1fxhA-4d4zA:
21.03
1fxhB-4d4zA:
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.
4emy AMINOTRANSFERASE
CLASS I AND II

(Anaerococcus
prevotii) 		PF00155
(Aminotran_1_2) 		4 PHE A 249
SER A 100
ALA A 270
ILE A 102
 None
 0.83A 1fxhA-4emyA:
undetectable
1fxhB-4emyA:
undetectable		 1fxhA-4emyA:
22.08
1fxhB-4emyA:
22.50
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.
4fh8 ACEPRX-1

(Ancylostoma
ceylanicum) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		4 PHE A  39
SER A  57
ALA A  55
ILE A  54
 None
 1.06A 1fxhA-4fh8A:
undetectable
1fxhB-4fh8A:
undetectable		 1fxhA-4fh8A:
24.07
1fxhB-4fh8A:
15.84
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.
4fn5 ELONGATION FACTOR G
1

(Pseudomonas
aeruginosa) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF03144
(GTP_EFTU_D2)
PF03764
(EFG_IV)
PF14492
(EFG_II) 		4 PHE A 667
SER A 417
ALA A 419
ILE A 457
 None
 1.04A 1fxhA-4fn5A:
undetectable
1fxhB-4fn5A:
undetectable		 1fxhA-4fn5A:
11.66
1fxhB-4fn5A:
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.
4gz8 SEMAPHORIN-3A

(Mus musculus) 		PF01403
(Sema) 		4 PHE A  78
SER A  54
ALA A  73
ILE A 118
 None
 1.00A 1fxhA-4gz8A:
undetectable
1fxhB-4gz8A:
undetectable		 1fxhA-4gz8A:
17.66
1fxhB-4gz8A:
17.34
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.
4i04 CATHEPSIN B-LIKE
PEPTIDASE (C01
FAMILY)

(Schistosoma
mansoni) 		PF00112
(Peptidase_C1)
PF08127
(Propeptide_C1) 		4 SER A  99
PHE A 175
SER A 132
ALA A 127
 None
 1.00A 1fxhA-4i04A:
undetectable
1fxhB-4i04A:
undetectable		 1fxhA-4i04A:
19.38
1fxhB-4i04A:
18.84
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.
4k8f TRANSCRIPTIONAL
REGULATOR, CRP/FNR
FAMILY

(Rhodospirillum
rubrum) 		no annotation 4 MET A 108
PHE A  19
PHE A  98
ILE A   7
 None
None
HEM  A 300 (-4.6A)
None
 1.05A 1fxhA-4k8fA:
undetectable
1fxhB-4k8fA:
undetectable		 1fxhA-4k8fA:
18.66
1fxhB-4k8fA:
12.93
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.
4m8j L-CARNITINE/GAMMA-BU
TYROBETAINE
ANTIPORTER

(Proteus
mirabilis) 		PF02028
(BCCT) 		4 MET A 408
PHE A 411
SER A 109
ILE A 395
 None
 0.91A 1fxhA-4m8jA:
undetectable
1fxhB-4m8jA:
undetectable		 1fxhA-4m8jA:
18.32
1fxhB-4m8jA:
21.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4pel PENICILLIN G ACYLASE
SUBUNIT ALPHA
PENICILLIN G ACYLASE
SUBUNIT BETA

(Kluyvera
cryocrescens;
Kluyvera
cryocrescens) 		PF01804
(Penicil_amidase)
PF01804
(Penicil_amidase) 		6 MET A 142
PHE A 146
PHE B  24
SER B  67
ALA B  69
ILE B 177
 None
 0.84A 1fxhA-4pelA:
25.6
1fxhB-4pelA:
undetectable		 1fxhA-4pelA:
72.34
1fxhB-4pelA:
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.
4pfr TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Rhodobacter
sphaeroides) 		PF03480
(DctP) 		4 MET A 229
SER A 168
ALA A 173
ILE A 172
 None
MLT  A 401 ( 4.5A)
None
None
 0.92A 1fxhA-4pfrA:
undetectable
1fxhB-4pfrA:
1.0		 1fxhA-4pfrA:
23.32
1fxhB-4pfrA:
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.
4poo PUTATIVE RNA
METHYLASE

(Bacillus
subtilis) 		PF06962
(rRNA_methylase) 		4 SER A  86
PHE A  51
ALA A  84
ILE A 129
 None
 1.07A 1fxhA-4pooA:
undetectable
1fxhB-4pooA:
undetectable		 1fxhA-4pooA:
22.92
1fxhB-4pooA:
16.94
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.
4pxb UREIDOGLYCOLATE
HYDROLASE

(Arabidopsis
thaliana) 		PF01546
(Peptidase_M20) 		4 MET A 435
SER A 420
ALA A 273
ILE A 274
 None
 1.02A 1fxhA-4pxbA:
undetectable
1fxhB-4pxbA:
2.1		 1fxhA-4pxbA:
20.20
1fxhB-4pxbA:
22.89
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.
4qfh GLUCOSE-6-PHOSPHATE
ISOMERASE

(Trypanosoma
cruzi) 		PF00342
(PGI) 		4 PHE A 347
SER A 182
SER A 341
ILE A 342
 None
 1.06A 1fxhA-4qfhA:
undetectable
1fxhB-4qfhA:
undetectable		 1fxhA-4qfhA:
17.23
1fxhB-4qfhA:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wzw PUMILIO
DOMAIN-CONTAINING
PROTEIN KIAA0020

(Homo sapiens) 		PF08144
(CPL) 		4 SER A 215
SER A 179
ALA A 174
ILE A 173
 None
 0.96A 1fxhA-4wzwA:
undetectable
1fxhB-4wzwA:
undetectable		 1fxhA-4wzwA:
17.97
1fxhB-4wzwA:
21.91
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.
4xsy RNA POLYMERASE SIGMA
FACTOR RPOD

(Escherichia
coli) 		PF00140
(Sigma70_r1_2)
PF04539
(Sigma70_r3)
PF04542
(Sigma70_r2)
PF04545
(Sigma70_r4)
PF04546
(Sigma70_ner) 		4 PHE F 419
PHE F 427
ALA F 120
ILE F 123
 None
 0.97A 1fxhA-4xsyF:
undetectable
1fxhB-4xsyF:
2.7		 1fxhA-4xsyF:
16.44
1fxhB-4xsyF:
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.
4zxw C-DOMAIN TYPE II
PEPTIDE SYNTHETASE

(Streptomyces
globisporus) 		PF00668
(Condensation) 		4 PHE A 266
PHE A 368
ALA A 370
ILE A 413
 None
 1.00A 1fxhA-4zxwA:
undetectable
1fxhB-4zxwA:
undetectable		 1fxhA-4zxwA:
18.80
1fxhB-4zxwA:
22.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cd6 TPR-DOMAIN
CONTAINING PROTEIN

(Parabacteroides
distasonis) 		PF17128
(DUF5107) 		4 PHE A 263
SER A 205
ALA A 207
ILE A 130
 None
 0.93A 1fxhA-5cd6A:
undetectable
1fxhB-5cd6A:
undetectable		 1fxhA-5cd6A:
16.81
1fxhB-5cd6A:
22.75
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.
5de0 DEFERROCHELATASE

(Vibrio cholerae) 		PF04261
(Dyp_perox) 		4 MET A 259
SER A 232
ALA A 248
ILE A 228
 HEM  A 401 (-3.8A)
None
None
HEM  A 401 ( 4.7A)
 1.06A 1fxhA-5de0A:
undetectable
1fxhB-5de0A:
undetectable		 1fxhA-5de0A:
21.36
1fxhB-5de0A:
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.
5edl PUTATIVE
HMP/THIAMINE
PERMEASE PROTEIN
YKOE

(Bacillus
subtilis) 		PF09819
(ABC_cobalt) 		4 PHE A  50
SER A 155
ALA A 160
ILE A  51
 None
 1.01A 1fxhA-5edlA:
1.1
1fxhB-5edlA:
undetectable		 1fxhA-5edlA:
23.18
1fxhB-5edlA:
17.41
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.
5fv4 CARBOXYLIC ESTER
HYDROLASE

(Sus scrofa) 		PF00135
(COesterase) 		4 MET A 345
PHE A 286
SER A 204
ILE A 369
 None
 0.90A 1fxhA-5fv4A:
undetectable
1fxhB-5fv4A:
undetectable		 1fxhA-5fv4A:
18.23
1fxhB-5fv4A:
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.
5gkq ALYGC MUTANT - R241A

(Paraglaciecola
chathamensis) 		PF14592
(Chondroitinas_B) 		4 MET A 641
SER A 660
ALA A 623
ILE A 622
 None
 0.97A 1fxhA-5gkqA:
undetectable
1fxhB-5gkqA:
undetectable		 1fxhA-5gkqA:
14.87
1fxhB-5gkqA:
22.75
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.
5hx0 UNCHARACTERIZED
PROTEIN DFER_1899

(Dyadobacter
fermentans) 		PF13088
(BNR_2) 		4 PHE A 382
SER A 394
SER A 379
ALA A 392
 None
 0.97A 1fxhA-5hx0A:
undetectable
1fxhB-5hx0A:
undetectable		 1fxhA-5hx0A:
19.90
1fxhB-5hx0A:
23.18
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.
5jen ANTI-SIGMA-V FACTOR
RSIV

(Bacillus
subtilis) 		PF11738
(DUF3298)
PF13739
(DUF4163) 		4 PHE A  82
SER A 102
ALA A 100
ILE A  80
 None
 1.00A 1fxhA-5jenA:
undetectable
1fxhB-5jenA:
undetectable		 1fxhA-5jenA:
20.58
1fxhB-5jenA:
19.26
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.
5jvf SITE-DETERMINING
PROTEIN

(Pseudomonas
aeruginosa) 		PF10609
(ParA) 		4 MET A  99
PHE A 139
ALA A  67
ILE A  70
 None
None
IOD  A 304 ( 4.2A)
None
 1.06A 1fxhA-5jvfA:
undetectable
1fxhB-5jvfA:
undetectable		 1fxhA-5jvfA:
23.00
1fxhB-5jvfA:
19.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k0t METHIONINE--TRNA
LIGASE

(Brucella suis) 		PF08264
(Anticodon_1)
PF09334
(tRNA-synt_1g) 		4 PHE A 289
PHE A 333
ALA A 290
ILE A 261
 None
 1.01A 1fxhA-5k0tA:
undetectable
1fxhB-5k0tA:
undetectable		 1fxhA-5k0tA:
17.89
1fxhB-5k0tA:
22.99
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.
5k6o B-GLUCOSIDASE

(metagenome) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		4 PHE A  45
SER A 130
ALA A 133
ILE A 134
 None
 1.07A 1fxhA-5k6oA:
undetectable
1fxhB-5k6oA:
undetectable		 1fxhA-5k6oA:
12.31
1fxhB-5k6oA:
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.
5ll7 BETA-LACTAMASE

(Escherichia
coli) 		no annotation 4 PHE A 207
SER A 189
ALA A 198
ILE A 155
 None
None
EDO  A 302 (-3.5A)
EDO  A 302 (-4.3A)
 1.05A 1fxhA-5ll7A:
undetectable
1fxhB-5ll7A:
undetectable		 1fxhA-5ll7A:
undetectable
1fxhB-5ll7A:
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.
5lng PUTATIVE FML
FIMBRIAL ADHESIN
FMLD

(Escherichia
coli) 		PF09160
(FimH_man-bind) 		4 MET A 130
PHE A 144
PHE A   1
ILE A  40
 None
 0.79A 1fxhA-5lngA:
undetectable
1fxhB-5lngA:
undetectable		 1fxhA-5lngA:
23.85
1fxhB-5lngA:
15.26
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.
5muz L PROTEIN

(California
reptarenavirus) 		no annotation 4 PHE A1862
SER A1846
ALA A1848
ILE A1835
 None
 1.03A 1fxhA-5muzA:
undetectable
1fxhB-5muzA:
undetectable		 1fxhA-5muzA:
21.18
1fxhB-5muzA:
12.16
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.
5o2c SERINE/THREONINE-PRO
TEIN KINASE WNK3

(Homo sapiens) 		PF00069
(Pkinase)
PF12202
(OSR1_C) 		4 MET A 466
SER A 483
ALA A 481
ILE A 484
 None
 1.07A 1fxhA-5o2cA:
undetectable
1fxhB-5o2cA:
undetectable		 1fxhA-5o2cA:
18.54
1fxhB-5o2cA:
21.15
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.
5uah RNA POLYMERASE SIGMA
FACTOR RPOD

(Escherichia
coli) 		PF00140
(Sigma70_r1_2)
PF04539
(Sigma70_r3)
PF04542
(Sigma70_r2)
PF04545
(Sigma70_r4)
PF04546
(Sigma70_ner) 		4 PHE F 419
PHE F 427
ALA F 120
ILE F 123
 None
 0.93A 1fxhA-5uahF:
undetectable
1fxhB-5uahF:
2.3		 1fxhA-5uahF:
17.39
1fxhB-5uahF:
21.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uhd RNA POLYMERASE SIGMA
FACTOR SIGA

(Mycobacterium
tuberculosis) 		PF00140
(Sigma70_r1_2)
PF04539
(Sigma70_r3)
PF04542
(Sigma70_r2)
PF04545
(Sigma70_r4) 		4 PHE F 335
PHE F 343
ALA F 250
ILE F 253
 None
 1.01A 1fxhA-5uhdF:
undetectable
1fxhB-5uhdF:
2.6		 1fxhA-5uhdF:
17.56
1fxhB-5uhdF:
22.35
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.
5wbf METHYL-ACCEPTING
CHEMOTAXIS
TRANSDUCER (TLPC)

(Helicobacter
pylori) 		no annotation 4 MET A 135
SER A 104
ALA A 179
ILE A 106
 None
 1.05A 1fxhA-5wbfA:
undetectable
1fxhB-5wbfA:
undetectable		 1fxhA-5wbfA:
21.79
1fxhB-5wbfA:
18.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xog DNA-DIRECTED RNA
POLYMERASE SUBUNIT

(Komagataella
phaffii) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		4 MET A 819
SER A 784
ALA A 777
ILE A 776
 None
 0.96A 1fxhA-5xogA:
undetectable
1fxhB-5xogA:
2.6		 1fxhA-5xogA:
8.53
1fxhB-5xogA:
15.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y09 PROTEASE DO-LIKE 9

(Arabidopsis
thaliana) 		no annotation 4 PHE A 457
SER A 508
ALA A 455
ILE A 572
 None
 1.02A 1fxhA-5y09A:
undetectable
1fxhB-5y09A:
undetectable		 1fxhA-5y09A:
17.25
1fxhB-5y09A:
22.28
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.
5yix RNA POLYMERASE SIGMA
FACTOR RPOD

(Caulobacter
vibrioides) 		no annotation 4 PHE A 459
PHE A 467
ALA A 138
ILE A 141
 None
 1.01A 1fxhA-5yixA:
undetectable
1fxhB-5yixA:
undetectable		 1fxhA-5yixA:
undetectable
1fxhB-5yixA:
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.
6ax8 METHIONINE-TRNA
LIGASE

(Mycobacterium
tuberculosis) 		no annotation 4 PHE A 288
PHE A 332
ALA A 289
ILE A 260
 None
 1.02A 1fxhA-6ax8A:
undetectable
1fxhB-6ax8A:
undetectable		 1fxhA-6ax8A:
undetectable
1fxhB-6ax8A:
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.
6ccv -

(-) 		no annotation 4 PHE F 273
PHE F 281
ALA F 188
ILE F 191
 None
 1.02A 1fxhA-6ccvF:
undetectable
1fxhB-6ccvF:
2.1		 1fxhA-6ccvF:
undetectable
1fxhB-6ccvF:
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.
6cfz DAD1,DAD1
DAM1

(Chaetomium
thermophilum;
Chaetomium
thermophilum) 		no annotation
no annotation 		4 PHE F  35
PHE H  59
ALA F  32
ILE F  31
 None
 1.03A 1fxhA-6cfzF:
undetectable
1fxhB-6cfzF:
undetectable		 1fxhA-6cfzF:
undetectable
1fxhB-6cfzF:
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.
6d6r EXOSOME COMPLEX
COMPONENT CSL4

(Homo sapiens) 		no annotation 4 PHE I  82
SER I  77
ALA I  83
ILE I 118
 None
 1.07A 1fxhA-6d6rI:
undetectable
1fxhB-6d6rI:
undetectable		 1fxhA-6d6rI:
undetectable
1fxhB-6d6rI:
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.
6ewj PUTATIVE CAPSULAR
POLYSACCHARIDE
BIOSYNTHESIS PROTEIN

(Streptococcus
pneumoniae) 		no annotation 4 PHE A 193
SER A 186
ALA A 188
ILE A 187
 None
 0.88A 1fxhA-6ewjA:
undetectable
1fxhB-6ewjA:
undetectable		 1fxhA-6ewjA:
undetectable
1fxhB-6ewjA:
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.
6fg9 -

(-) 		no annotation 5 MET A 528
PHE A 558
SER A 589
ALA A 574
ILE A 573
 None
 1.36A 1fxhA-6fg9A:
undetectable
1fxhB-6fg9A:
undetectable		 1fxhA-6fg9A:
undetectable
1fxhB-6fg9A:
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.
6fuy VINCULIN

(Homo sapiens) 		no annotation 4 PHE A 779
PHE A 835
SER A 787
ALA A 782
 None
 0.83A 1fxhA-6fuyA:
undetectable
1fxhB-6fuyA:
2.1		 1fxhA-6fuyA:
undetectable
1fxhB-6fuyA:
undetectable