SIMILAR PATTERNS OF AMINO ACIDS FOR 1FM6_X_BRLX504_1

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.
1cc1 HYDROGENASE (LARGE
SUBUNIT)

(Desulfomicrobium
baculatum) 		PF00374
(NiFeSe_Hases) 		5 CYH L 492
HIS L 498
HIS L  77
LEU L 428
LEU L 449
 NI  L 500 (-2.4A)
FE2  L 501 (-3.5A)
FCO  L 499 (-3.9A)
FCO  L 499 (-3.5A)
None
 1.30A 1fm6X-1cc1L:
0.0		 1fm6X-1cc1L:
19.48
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.
1dtp DIPHTHERIA TOXIN

(Corynephage
beta) 		PF02763
(Diphtheria_C) 		5 ILE A 124
PHE A 123
GLY A 119
LEU A 106
LEU A 114
 None
 1.42A 1fm6X-1dtpA:
undetectable		 1fm6X-1dtpA:
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.
1e0t PYRUVATE KINASE

(Escherichia
coli) 		PF00224
(PK)
PF02887
(PK_C) 		5 ILE A   6
CYH A   8
MET A  23
LEU A  50
LEU A  33
 None
 1.28A 1fm6X-1e0tA:
0.0		 1fm6X-1e0tA:
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.
1fft UBIQUINOL OXIDASE

(Escherichia
coli) 		PF00115
(COX1) 		5 ILE A 109
PHE A 112
GLY A 107
LEU A 246
LEU A 171
 None
None
HEM  A1001 (-3.3A)
None
None
 1.36A 1fm6X-1fftA:
0.3		 1fm6X-1fftA:
16.97
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.
1gz4 NAD-DEPENDENT MALIC
ENZYME

(Homo sapiens) 		PF00390
(malic)
PF03949
(Malic_M) 		5 ILE A  83
GLY A  87
HIS A  69
MET A  75
LEU A 107
 None
 1.43A 1fm6X-1gz4A:
0.0		 1fm6X-1gz4A:
19.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hfx ALPHA-LACTALBUMIN

(Cavia porcellus) 		PF00062
(Lys) 		5 ILE A  55
PHE A  53
GLY A  51
LEU A  12
LEU A   3
 None
 1.12A 1fm6X-1hfxA:
undetectable		 1fm6X-1hfxA:
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.
1iv8 MALTOOLIGOSYL
TREHALOSE SYNTHASE

(Sulfolobus
acidocaldarius) 		PF00128
(Alpha-amylase)
PF09196
(DUF1953) 		5 ILE A 631
GLY A 629
LEU A  29
LEU A 608
TYR A  25
 None
 1.30A 1fm6X-1iv8A:
0.0		 1fm6X-1iv8A:
18.36
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.
1ivh ISOVALERYL-COA
DEHYDROGENASE

(Homo sapiens) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 ILE A  39
GLY A 218
LEU A 265
LEU A 370
TYR A 371
 None
None
None
FAD  A 399 ( 4.6A)
None
 1.07A 1fm6X-1ivhA:
undetectable		 1fm6X-1ivhA:
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.
1j0h NEOPULLULANASE

(Geobacillus
stearothermophilus) 		PF00128
(Alpha-amylase)
PF02903
(Alpha-amylase_N)
PF16657
(Malt_amylase_C) 		5 ILE A 354
GLY A 356
HIS A 423
MET A 240
TYR A 207
 None
 1.15A 1fm6X-1j0hA:
undetectable		 1fm6X-1j0hA:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kzh PHOSPHOFRUCTOKINASE

(Borreliella
burgdorferi) 		PF00365
(PFK) 		5 ILE A  57
GLY A 479
LEU A 468
LEU A 446
TYR A 442
 None
 1.08A 1fm6X-1kzhA:
undetectable		 1fm6X-1kzhA:
20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nez H-2 CLASS I
HISTOCOMPATIBILITY
ANTIGEN, TLA(C)
ALPHA CHAIN

(Mus musculus) 		PF00129
(MHC_I)
PF07654
(C1-set) 		5 GLY A 162
SER A 167
TYR A  59
LEU A   5
TYR A   7
 None
 1.45A 1fm6X-1nezA:
undetectable		 1fm6X-1nezA:
22.83
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.
1pmi PHOSPHOMANNOSE
ISOMERASE

(Candida
albicans) 		PF01238
(PMI_typeI) 		5 ILE A 110
GLY A 258
CYH A 261
LEU A 158
LEU A 168
 None
 1.37A 1fm6X-1pmiA:
undetectable		 1fm6X-1pmiA:
19.27
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.
1qgr PROTEIN (IMPORTIN
BETA SUBUNIT)

(Homo sapiens) 		PF03810
(IBN_N)
PF13513
(HEAT_EZ) 		5 ILE A 772
PHE A 717
GLY A 718
SER A 764
LEU A 700
 None
 1.35A 1fm6X-1qgrA:
undetectable		 1fm6X-1qgrA:
14.83
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.
1sma MALTOGENIC AMYLASE

(Thermus sp.
IM6501) 		PF00128
(Alpha-amylase)
PF02903
(Alpha-amylase_N)
PF16657
(Malt_amylase_C) 		5 ILE A 354
GLY A 356
HIS A 423
MET A 240
TYR A 207
 None
 1.11A 1fm6X-1smaA:
undetectable		 1fm6X-1smaA:
20.24
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.
1vr0 PROBABLE
2-PHOSPHOSULFOLACTAT
E PHOSPHATASE

(Clostridium
acetobutylicum) 		PF04029
(2-ph_phosp) 		5 ILE A  76
GLY A  69
HIS A 201
TYR A 148
LEU A 208
 None
None
3SL  A 300 (-4.6A)
3SL  A 300 (-4.8A)
None
 1.15A 1fm6X-1vr0A:
undetectable		 1fm6X-1vr0A:
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.
1zl9 GLUTATHIONE
S-TRANSFERASE 5

(Caenorhabditis
elegans) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		5 ILE A 126
PHE A 127
TYR A  97
HIS A 165
LEU A 169
 None
 0.99A 1fm6X-1zl9A:
undetectable		 1fm6X-1zl9A:
25.36
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.
2bg9 ACETYLCHOLINE
RECEPTOR PROTEIN,
ALPHA CHAIN

(Torpedo
marmorata) 		PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb) 		5 ILE A 102
PHE A 100
LEU A  92
LEU A  35
TYR A 203
 None
 1.47A 1fm6X-2bg9A:
undetectable		 1fm6X-2bg9A:
22.08
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.
2bvm TOXIN B

(Clostridioides
difficile) 		PF12918
(TcdB_N)
PF12919
(TcdA_TcdB) 		5 ILE A 107
GLY A 105
LEU A 272
LEU A 259
TYR A 255
 None
 1.12A 1fm6X-2bvmA:
undetectable		 1fm6X-2bvmA:
20.41
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.
2cfc 2-(R)-HYDROXYPROPYL-
COM DEHYDROGENASE

(Xanthobacter
autotrophicus) 		PF13561
(adh_short_C2) 		5 ILE A 118
PHE A 119
GLY A 121
CYH A 122
TYR A 173
 None
 0.75A 1fm6X-2cfcA:
undetectable		 1fm6X-2cfcA:
20.62
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.
2dqb DEOXYGUANOSINETRIPHO
SPHATE
TRIPHOSPHOHYDROLASE,
PUTATIVE

(Thermus
thermophilus) 		PF01966
(HD)
PF13286
(HD_assoc) 		5 ILE A 256
PHE A 255
GLY A 253
LEU A 299
LEU A 228
 None
 1.35A 1fm6X-2dqbA:
undetectable		 1fm6X-2dqbA:
24.36
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.
2euh NADP DEPENDENT NON
PHOSPHORYLATING
GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Streptococcus
mutans) 		PF00171
(Aldedh) 		5 ILE A 454
PHE A 444
GLY A 456
SER A 162
MET A 248
 None
NAP  A 476 (-4.1A)
None
None
None
 1.29A 1fm6X-2euhA:
undetectable		 1fm6X-2euhA:
21.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hwk HELICASE NSP2

(Venezuelan
equine
encephalitis
virus) 		PF01707
(Peptidase_C9) 		5 ILE A 732
HIS A 689
HIS A 608
LEU A 780
TYR A 784
 None
 1.18A 1fm6X-2hwkA:
undetectable		 1fm6X-2hwkA:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hwk HELICASE NSP2

(Venezuelan
equine
encephalitis
virus) 		PF01707
(Peptidase_C9) 		5 PHE A 759
HIS A 689
HIS A 608
LEU A 780
TYR A 784
 None
 1.34A 1fm6X-2hwkA:
undetectable		 1fm6X-2hwkA:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ky4 PHYCOBILISOME LINKER
POLYPEPTIDE

(Nostoc sp. PCC
7120) 		PF00427
(PBS_linker_poly) 		5 ILE A 106
PHE A 115
GLY A 111
LEU A  69
TYR A  68
 None
 1.41A 1fm6X-2ky4A:
undetectable		 1fm6X-2ky4A:
20.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2p54 PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		8 ILE A 272
PHE A 273
CYH A 276
SER A 280
MET A 355
HIS A 440
LEU A 460
TYR A 464
 735  A 469 ( 4.2A)
735  A 469 (-3.7A)
735  A 469 (-2.9A)
735  A 469 (-2.8A)
735  A 469 (-2.9A)
735  A 469 (-4.0A)
735  A 469 (-4.3A)
735  A 469 (-4.6A)
 0.67A 1fm6X-2p54A:
36.9		 1fm6X-2p54A:
61.94
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.
2p5x N-ACETYLSEROTONIN
O-METHYLTRANSFERASE-
LIKE PROTEIN

(Homo sapiens) 		PF02545
(Maf) 		5 PHE A 204
HIS A 129
LEU A  10
LEU A 211
TYR A 212
 None
 1.31A 1fm6X-2p5xA:
undetectable		 1fm6X-2p5xA:
23.00
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.
2qru UNCHARACTERIZED
PROTEIN

(Enterococcus
faecalis) 		PF07859
(Abhydrolase_3) 		5 ILE A 137
HIS A  32
LEU A 107
LEU A  66
TYR A  64
 None
EDO  A 278 ( 4.7A)
None
None
None
 1.35A 1fm6X-2qruA:
undetectable		 1fm6X-2qruA:
22.08
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.
2r4j AEROBIC
GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Escherichia
coli) 		PF01266
(DAO)
PF16901
(DAO_C) 		5 ILE A 267
PHE A 257
GLY A 269
HIS A  50
TYR A  55
 None
None
None
FAD  A 600 ( 4.6A)
13P  A1968 (-4.6A)
 1.34A 1fm6X-2r4jA:
undetectable		 1fm6X-2r4jA:
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.
2uut RNA-DIRECTED RNA
POLYMERASE

(Sapporo virus) 		PF00680
(RdRP_1) 		5 PHE A 361
HIS A 313
LEU A 241
LEU A 368
TYR A 243
 None
 1.44A 1fm6X-2uutA:
undetectable		 1fm6X-2uutA:
21.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vl8 CYTOTOXIN L

(Paeniclostridium
sordellii) 		PF12918
(TcdB_N)
PF12919
(TcdA_TcdB) 		5 ILE A 107
GLY A 105
LEU A 272
LEU A 259
TYR A 255
 None
 1.06A 1fm6X-2vl8A:
undetectable		 1fm6X-2vl8A:
20.96
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.
2wk8 CAI-1 AUTOINDUCER
SYNTHASE

(Vibrio cholerae) 		PF00155
(Aminotran_1_2) 		5 ILE A 356
GLY A 319
SER A 315
HIS A 205
TYR A  49
 None
None
None
PLP  A 600 (-3.9A)
None
 1.09A 1fm6X-2wk8A:
undetectable		 1fm6X-2wk8A:
22.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 ILE A 281
PHE A 282
GLY A 284
CYH A 285
LEU A 452
 MC5  A   1 ( 4.8A)
MC5  A   1 (-4.4A)
MC5  A   1 ( 4.5A)
MC5  A   1 (-3.6A)
None
 1.36A 1fm6X-3b0qA:
39.4		 1fm6X-3b0qA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		12 ILE A 281
PHE A 282
GLY A 284
CYH A 285
SER A 289
HIS A 323
TYR A 327
MET A 364
HIS A 449
LEU A 453
LEU A 469
TYR A 473
 MC5  A   1 ( 4.8A)
MC5  A   1 (-4.4A)
MC5  A   1 ( 4.5A)
MC5  A   1 (-3.6A)
MC5  A   1 (-2.6A)
MC5  A   1 (-3.8A)
None
MC5  A   1 (-3.7A)
MC5  A   1 (-3.9A)
MC5  A   1 (-4.2A)
MC5  A   1 (-4.1A)
MC5  A   1 (-4.9A)
 0.68A 1fm6X-3b0qA:
39.4		 1fm6X-3b0qA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3d5f PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR DELTA

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 PHE A 282
CYH A 285
HIS A 323
HIS A 449
LEU A 469
TYR A 473
 L41  A 501 ( 4.9A)
L41  A 501 (-3.5A)
L41  A 501 (-3.8A)
L41  A 501 (-3.9A)
L41  A 501 (-3.8A)
L41  A 501 (-4.8A)
 0.64A 1fm6X-3d5fA:
35.5		 1fm6X-3d5fA:
62.92
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.
3dwd ADP-RIBOSYLATION
FACTOR
GTPASE-ACTIVATING
PROTEIN 1

(Homo sapiens) 		PF01412
(ArfGap) 		5 GLY A  26
CYH A  22
HIS A  49
LEU A  99
TYR A 103
 None
ZN  A 501 (-2.3A)
None
None
None
 1.36A 1fm6X-3dwdA:
undetectable		 1fm6X-3dwdA:
20.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		8 ILE D 281
PHE D 282
GLY D 284
SER D 289
MET D 364
HIS D 449
LEU D 469
TYR D 473
 PLB  D 701 (-4.6A)
None
PLB  D 701 (-3.3A)
PLB  D 701 ( 3.9A)
PLB  D 701 ( 4.8A)
None
None
None
 0.71A 1fm6X-3dzuD:
37.1		 1fm6X-3dzuD:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		5 PHE D 282
CYH D 285
TYR D 327
MET D 364
HIS D 449
 None
PLB  D 701 (-3.2A)
None
PLB  D 701 ( 4.8A)
None
 1.05A 1fm6X-3dzuD:
37.1		 1fm6X-3dzuD:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		5 PHE D 282
GLY D 284
CYH D 285
MET D 364
HIS D 449
 None
PLB  D 701 (-3.3A)
PLB  D 701 (-3.2A)
PLB  D 701 ( 4.8A)
None
 1.02A 1fm6X-3dzuD:
37.1		 1fm6X-3dzuD:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		5 PHE D 282
HIS D 323
TYR D 327
HIS D 449
TYR D 473
 None
 1.10A 1fm6X-3dzuD:
37.1		 1fm6X-3dzuD:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		6 PHE D 282
TYR D 327
MET D 364
HIS D 449
LEU D 469
TYR D 473
 None
None
PLB  D 701 ( 4.8A)
None
None
None
 0.85A 1fm6X-3dzuD:
37.1		 1fm6X-3dzuD:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ed5 YFNB

(Bacillus
subtilis) 		PF13419
(HAD_2) 		5 ILE A 178
PHE A   9
GLY A 180
LEU A 112
LEU A 220
 None
 1.17A 1fm6X-3ed5A:
undetectable		 1fm6X-3ed5A:
23.96
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.
3fsd NTF2-LIKE PROTEIN OF
UNKNOWN FUNCTION IN
NUTRIENT UPTAKE

(Rhodospirillum
rubrum) 		PF14534
(DUF4440) 		5 PHE A 109
GLY A 127
TYR A  61
LEU A  71
LEU A  22
 UNL  A 134 ( 4.8A)
None
None
None
None
 1.10A 1fm6X-3fsdA:
undetectable		 1fm6X-3fsdA:
18.11
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.
3gqp HEMOGLOBIN SUBUNIT
BETA-A/B

(Felis catus) 		PF00042
(Globin) 		5 PHE B  71
GLY B  74
HIS B  92
LEU B 106
LEU B 141
 HEM  B 148 ( 4.5A)
None
HEM  B 148 (-3.4A)
HEM  B 148 (-4.4A)
HEM  B 148 (-4.7A)
 1.35A 1fm6X-3gqpB:
undetectable		 1fm6X-3gqpB:
20.07
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.
3gyq RRNA
(ADENOSINE-2'-O-)-ME
THYLTRANSFERASE

(Streptomyces
cyaneus) 		PF00588
(SpoU_methylase)
PF04705
(TSNR_N) 		5 ILE A 146
GLY A 144
SER A 137
LEU A 195
LEU A 257
 None
None
None
SAM  A 270 (-4.1A)
None
 1.35A 1fm6X-3gyqA:
undetectable		 1fm6X-3gyqA:
21.58
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.
3h1n PROBABLE GLUTATHIONE
S-TRANSFERASE

(Bordetella
bronchiseptica) 		PF14497
(GST_C_3) 		5 ILE A  11
GLY A  10
TYR A 210
LEU A   5
TYR A  29
 None
 1.46A 1fm6X-3h1nA:
undetectable		 1fm6X-3h1nA:
21.92
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.
3k67 PUTATIVE DEHYDRATASE
AF1124

(Archaeoglobus
fulgidus) 		PF01575
(MaoC_dehydratas) 		5 GLY A 119
CYH A  49
TYR A  19
LEU A  91
LEU A  87
 None
 1.37A 1fm6X-3k67A:
undetectable		 1fm6X-3k67A:
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.
3kts GLYCEROL UPTAKE
OPERON
ANTITERMINATOR
REGULATORY PROTEIN

(Listeria
monocytogenes) 		PF04309
(G3P_antiterm) 		5 ILE A 152
GLY A 154
SER A 177
HIS A  15
LEU A  61
 None
UNL  A 191 ( 3.7A)
UNL  A 191 ( 2.8A)
None
None
 1.42A 1fm6X-3ktsA:
undetectable		 1fm6X-3ktsA:
21.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lah METHYL-ACCEPTING
CHEMOTAXIS PROTEIN

(Caldanaerobacter
subterraneus) 		PF07700
(HNOB) 		5 PHE A 141
GLY A 143
SER A 148
LEU A 117
LEU A  95
 HEM  A 200 ( 4.9A)
None
HEM  A 200 ( 4.1A)
IMD  A 502 (-4.2A)
None
 1.29A 1fm6X-3lahA:
undetectable		 1fm6X-3lahA:
19.20
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.
3n23 SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1
SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT BETA-1

(Sus scrofa) 		PF00122
(E1-E2_ATPase)
PF00287
(Na_K-ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF13246
(Cation_ATPase) 		5 ILE B  41
GLY B  44
CYH B  45
LEU A 856
TYR A 987
 None
 1.48A 1fm6X-3n23B:
undetectable		 1fm6X-3n23B:
19.38
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.
3n23 SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1
SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT BETA-1

(Sus scrofa) 		PF00122
(E1-E2_ATPase)
PF00287
(Na_K-ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF13246
(Cation_ATPase) 		5 ILE B  41
GLY B  44
CYH B  45
LEU A 990
LEU A 856
 None
 1.33A 1fm6X-3n23B:
undetectable		 1fm6X-3n23B:
19.38
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.
3n23 SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1
SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT BETA-1

(Sus scrofa) 		PF00122
(E1-E2_ATPase)
PF00287
(Na_K-ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF13246
(Cation_ATPase) 		5 ILE B  41
PHE B  42
GLY B  44
CYH B  45
LEU A 856
 None
 0.96A 1fm6X-3n23B:
undetectable		 1fm6X-3n23B:
19.38
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.
3o47 ADP-RIBOSYLATION
FACTOR
GTPASE-ACTIVATING
PROTEIN 1,
ADP-RIBOSYLATION
FACTOR 1

(Homo sapiens) 		PF00025
(Arf)
PF01412
(ArfGap) 		5 GLY A  26
CYH A  22
HIS A  49
LEU A  99
TYR A 103
 None
ZN  A 501 (-2.3A)
None
None
None
 1.43A 1fm6X-3o47A:
undetectable		 1fm6X-3o47A:
19.54
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.
3oa3 ALDOLASE

(Coccidioides
immitis) 		PF01791
(DeoC) 		5 ILE A 169
GLY A 172
CYH A 173
SER A 177
LEU A 210
 None
 1.31A 1fm6X-3oa3A:
undetectable		 1fm6X-3oa3A:
20.77
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.
3ofj NODULATION PROTEIN S

(Bradyrhizobium
sp. WM9) 		PF05401
(NodS) 		5 ILE A  72
GLY A  52
MET A 133
LEU A 110
LEU A  35
 None
 1.23A 1fm6X-3ofjA:
undetectable		 1fm6X-3ofjA:
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.
3v9a ESTERASE/LIPASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 ILE A 199
HIS A  74
LEU A 149
LEU A 108
TYR A 106
 None
None
None
SO4  A 401 (-4.0A)
None
 1.31A 1fm6X-3v9aA:
undetectable		 1fm6X-3v9aA:
22.96
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.
3w0l GLUCOKINASE

(Xenopus laevis) 		PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2) 		5 ILE A 432
PHE A 431
GLY A 400
LEU A 421
LEU A 383
 None
 1.30A 1fm6X-3w0lA:
undetectable		 1fm6X-3w0lA:
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.
3ze7 PERIPLASMIC [NIFESE]
HYDROGENASE, LARGE
SUBUNIT,
SELENOCYSTEINE-CONTA
INING

(Desulfovibrio
vulgaris) 		PF00374
(NiFeSe_Hases) 		5 CYH B 489
HIS B 495
HIS B  82
LEU B 425
LEU B 446
 NI  B 501 ( 2.2A)
FE2  B 502 (-3.5A)
FCO  B 500 (-4.3A)
FCO  B 500 (-3.5A)
None
 1.34A 1fm6X-3ze7B:
undetectable		 1fm6X-3ze7B:
19.67
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.
4boo ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA

(Torpedo
marmorata) 		PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb) 		5 ILE A 102
PHE A 100
LEU A  92
LEU A  35
TYR A 203
 None
 1.47A 1fm6X-4booA:
undetectable		 1fm6X-4booA:
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.
4bx9 VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 33A

(Homo sapiens) 		PF00995
(Sec1) 		5 ILE A 558
SER A 259
HIS A   4
LEU A   5
LEU A  48
 None
 1.15A 1fm6X-4bx9A:
undetectable		 1fm6X-4bx9A:
19.60
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.
4cyf PANTETHEINASE

(Homo sapiens) 		PF00795
(CN_hydrolase) 		5 PHE A 250
HIS A 387
LEU A 215
LEU A 395
TYR A 393
 None
 1.31A 1fm6X-4cyfA:
undetectable		 1fm6X-4cyfA:
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.
4doo CHALCONE-FLAVANONE
ISOMERASE FAMILY
PROTEIN

(Arabidopsis
thaliana) 		PF16035
(Chalcone_2) 		5 PHE A 130
SER A 110
LEU A 148
LEU A 180
TYR A 181
 None
DAO  A 301 (-2.8A)
None
None
None
 1.24A 1fm6X-4dooA:
undetectable		 1fm6X-4dooA:
21.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dr9 PEPTIDE DEFORMYLASE

(Synechococcus
elongatus) 		PF01327
(Pep_deformylase) 		5 ILE A  60
GLY A  61
LEU A 139
LEU A  90
TYR A 129
 BB2  A 203 (-4.1A)
BB2  A 203 (-4.4A)
None
None
None
 1.47A 1fm6X-4dr9A:
undetectable		 1fm6X-4dr9A:
22.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fc4 NITRITE TRANSPORTER
NIRC

(Salmonella
enterica) 		PF01226
(Form_Nir_trans) 		5 ILE A  73
GLY A  76
SER A  30
HIS A  83
LEU A  19
 None
 1.46A 1fm6X-4fc4A:
undetectable		 1fm6X-4fc4A:
21.28
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.
4ffl PYLC

(Methanosarcina
barkeri) 		PF02655
(ATP-grasp_3) 		5 ILE A  38
GLY A  13
SER A 246
TYR A 286
HIS A 288
 None
None
LYS  A 901 ( 2.9A)
None
None
 1.35A 1fm6X-4fflA:
undetectable		 1fm6X-4fflA:
21.90
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.
4fgv CHROMOSOME REGION
MAINTENANCE 1 (CRM1)
OR EXPORTIN 1 (XPO1)

(Chaetomium
thermophilum) 		PF03810
(IBN_N)
PF08389
(Xpo1)
PF08767
(CRM1_C) 		5 ILE A 270
PHE A 273
TYR A 406
HIS A 336
TYR A 357
 None
 1.44A 1fm6X-4fgvA:
undetectable		 1fm6X-4fgvA:
13.00
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.
4hoo LYSINE-SPECIFIC
DEMETHYLASE 4D

(Homo sapiens) 		PF02373
(JmjC)
PF02375
(JmjN) 		5 PHE A 182
GLY A 183
LEU A 144
LEU A 206
TYR A  63
 None
 1.39A 1fm6X-4hooA:
undetectable		 1fm6X-4hooA:
22.51
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.
4hzu ENERGY-COUPLING
FACTOR TRANSPORTER
TRANSMEMBRANE
PROTEIN ECFT

(Lactobacillus
brevis) 		PF02361
(CbiQ) 		5 PHE T  50
GLY T  53
SER T  58
LEU T  27
LEU T 126
 None
 1.26A 1fm6X-4hzuT:
undetectable		 1fm6X-4hzuT:
24.16
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.
4i1i MALATE DEHYDROGENASE

(Leishmania
major) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ILE A 280
PHE A 281
GLY A 265
SER A 263
LEU A 308
 None
 1.48A 1fm6X-4i1iA:
undetectable		 1fm6X-4i1iA:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i6m ACTIN-LIKE PROTEIN
ARP9

(Saccharomyces
cerevisiae) 		PF00022
(Actin) 		5 ILE B 428
PHE B 429
GLY B 431
SER B 436
LEU B  25
 None
 0.83A 1fm6X-4i6mB:
undetectable		 1fm6X-4i6mB:
22.00
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.
4l5i TRANSCRIPTIONAL
REGULATOR LSRR

(Escherichia
coli) 		PF04198
(Sugar-bind) 		5 ILE A 160
SER A 150
MET A 129
LEU A 176
TYR A 226
 None
 1.42A 1fm6X-4l5iA:
undetectable		 1fm6X-4l5iA:
22.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l9a PUTATIVE
UNCHARACTERIZED
PROTEIN SMU.1393C

(Streptococcus
mutans) 		no annotation 5 PHE A  27
CYH A  26
SER A  94
LEU A 269
LEU A 119
 None
 1.23A 1fm6X-4l9aA:
undetectable		 1fm6X-4l9aA:
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.
4lx4 ENDOGLUCANASE(ENDO-1
,4-BETA-GLUCANASE)PR
OTEIN

(Pseudomonas
stutzeri) 		PF00150
(Cellulase) 		5 ILE A 255
GLY A 254
MET A 310
HIS A  14
LEU A 273
 None
 1.45A 1fm6X-4lx4A:
undetectable		 1fm6X-4lx4A:
21.07
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.
4orx PROSTAGLANDIN-H2
D-ISOMERASE

(Homo sapiens) 		PF00061
(Lipocalin) 		5 PHE A  39
GLY A  41
SER A  67
LEU A 131
LEU A  79
 None
 0.95A 1fm6X-4orxA:
undetectable		 1fm6X-4orxA:
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.
4rp8 ASCORBATE-SPECIFIC
PERMEASE IIC
COMPONENT ULAA

(Escherichia
coli) 		PF03611
(EIIC-GAT) 		5 ILE A 242
PHE A 243
GLY A 245
SER A 250
LEU A 338
 None
 1.27A 1fm6X-4rp8A:
undetectable		 1fm6X-4rp8A:
19.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uoz BETA-GALACTOSIDASE

(Bifidobacterium
animalis) 		PF02449
(Glyco_hydro_42)
PF08532
(Glyco_hydro_42M)
PF08533
(Glyco_hydro_42C) 		5 ILE A  53
GLY A  26
CYH A 360
LEU A 352
LEU A 395
 None
 1.47A 1fm6X-4uozA:
undetectable		 1fm6X-4uozA:
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.
4x9e DEOXYGUANOSINETRIPHO
SPHATE
TRIPHOSPHOHYDROLASE

(Escherichia
coli) 		PF01966
(HD) 		5 ILE A 407
GLY A 409
MET A 488
LEU A 447
LEU A 443
 None
 1.39A 1fm6X-4x9eA:
undetectable		 1fm6X-4x9eA:
21.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xb3 GLUCAN
1,6-ALPHA-GLUCOSIDAS
E

(Streptococcus
mutans) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		5 ILE A 196
GLY A 235
SER A 257
MET A 221
LEU A 232
 None
 1.46A 1fm6X-4xb3A:
undetectable		 1fm6X-4xb3A:
21.26
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.
4xgu PUTATIVE PACHYTENE
CHECKPOINT PROTEIN 2

(Caenorhabditis
elegans) 		PF00004
(AAA) 		5 CYH A 189
SER A 187
LEU A 145
LEU A 139
TYR A 141
 None
SO4  A 501 ( 4.6A)
None
None
None
 1.15A 1fm6X-4xguA:
undetectable		 1fm6X-4xguA:
21.18
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.
5a0t RIBONUCLEASE J

(Streptomyces
coelicolor) 		PF00753
(Lactamase_B)
PF07521
(RMMBL) 		5 PHE A 174
GLY A 172
LEU A 383
LEU A 202
TYR A 387
 None
 1.38A 1fm6X-5a0tA:
undetectable		 1fm6X-5a0tA:
18.72
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.
5aew BIPHENYL DIOXYGENASE
SUBUNIT ALPHA

(Paraburkholderia
xenovorans) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		5 ILE A 208
PHE A 355
GLY A 210
HIS A 343
LEU A  60
 None
 1.41A 1fm6X-5aewA:
undetectable		 1fm6X-5aewA:
18.39
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.
5aw4 NA+,K+-ATPASE BETA
SUBUNIT
NA, K-ATPASE ALPHA
SUBUNIT

(Squalus
acanthias) 		PF00122
(E1-E2_ATPase)
PF00287
(Na_K-ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF13246
(Cation_ATPase) 		5 ILE B  42
PHE B  43
GLY B  45
CYH B  46
LEU A 863
 None
 0.88A 1fm6X-5aw4B:
undetectable		 1fm6X-5aw4B:
22.57
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.
5d9a RNA-DIRECTED RNA
POLYMERASE CATALYTIC
SUBUNIT

(Influenza C
virus) 		PF00602
(Flu_PB1) 		5 ILE B 304
PHE B 491
GLY B 306
SER B 444
LEU B 284
 None
 1.44A 1fm6X-5d9aB:
undetectable		 1fm6X-5d9aB:
17.62
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.
5eui HBB PROTEIN

(Ochotona
princeps) 		PF00042
(Globin) 		5 PHE B  71
GLY B  74
HIS B  92
LEU B 106
LEU B 141
 HEM  B 201 (-4.3A)
None
HEM  B 201 (-3.3A)
HEM  B 201 (-4.0A)
HEM  B 201 (-4.9A)
 1.20A 1fm6X-5euiB:
undetectable		 1fm6X-5euiB:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fbh EXTRACELLULAR
CALCIUM-SENSING
RECEPTOR

(Homo sapiens) 		no annotation 5 ILE B 223
GLY B 219
SER B 170
TYR B 489
MET B 197
 None
None
TCR  B 609 (-2.8A)
None
None
 1.25A 1fm6X-5fbhB:
undetectable		 1fm6X-5fbhB:
18.87
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.
5ikf CHROMATIN REMODELING
FACTOR MIT1
CRYPTIC LOCI
REGULATOR PROTEIN 1

(Schizosaccharomyces
pombe) 		no annotation 5 ILE A1316
GLY A1315
CYH A1314
LEU B 389
LEU B 398
 CL  A1503 ( 4.2A)
None
ZN  A1501 (-2.3A)
None
None
 1.40A 1fm6X-5ikfA:
undetectable		 1fm6X-5ikfA:
22.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jyg ACTIN-LIKE ATPASE

(Magnetospirillum
magneticum) 		PF06723
(MreB_Mbl) 		5 ILE A  16
GLY A  15
LEU A 341
LEU A 333
TYR A 337
 None
 1.30A 1fm6X-5jygA:
undetectable		 1fm6X-5jygA:
23.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k8d COAGULATION FACTOR
VIII,IG GAMMA-1
CHAIN C REGION

(Homo sapiens) 		PF00754
(F5_F8_type_C)
PF07731
(Cu-oxidase_2) 		5 ILE B1882
PHE B1883
GLY B1948
MET B2010
LEU B1758
 None
None
None
CU  B2610 ( 3.9A)
None
 1.28A 1fm6X-5k8dB:
undetectable		 1fm6X-5k8dB:
16.34
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.
5kf7 BIFUNCTIONAL PROTEIN
PUTA

(Sinorhizobium
meliloti) 		PF00171
(Aldedh)
PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		5 ILE A 712
PHE A 713
GLY A 715
LEU A 758
LEU A 756
 None
 1.22A 1fm6X-5kf7A:
undetectable		 1fm6X-5kf7A:
12.55
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.
5l9w ACETOPHENONE
CARBOXYLASE ALPHA
SUBUNIT

(Aromatoleum
aromaticum) 		PF01968
(Hydantoinase_A)
PF05378
(Hydant_A_N) 		5 PHE b  39
GLY b  41
CYH b  42
LEU b 226
LEU b  59
 None
 1.19A 1fm6X-5l9wb:
undetectable		 1fm6X-5l9wb:
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.
5twt PEROXIDASE PVI9

(Panicum
virgatum) 		PF00141
(peroxidase) 		5 ILE A 147
PHE A 150
SER A 235
HIS A 167
TYR A 222
 None
HEM  A 301 (-3.9A)
HEM  A 301 (-2.4A)
HEM  A 301 (-3.3A)
None
 1.29A 1fm6X-5twtA:
undetectable		 1fm6X-5twtA:
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.
5u1a FERRITIN,MTRE
PROTEIN CHIMERA

(Helicobacter
pylori;
Neisseria
gonorrhoeae) 		no annotation 5 PHE A  95
GLY A  97
LEU A  23
LEU A  58
TYR A  24
 None
 0.97A 1fm6X-5u1aA:
undetectable		 1fm6X-5u1aA:
19.06
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.
5ux5 BIFUNCTIONAL PROTEIN
PROLINE UTILIZATION
A (PUTA)

(Corynebacterium
freiburgense) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		5 ILE A1069
GLY A1067
HIS A 850
LEU A 852
LEU A 706
 None
 1.43A 1fm6X-5ux5A:
undetectable		 1fm6X-5ux5A:
13.94
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.
5veu CYTOCHROME P450 3A5

(Homo sapiens) 		no annotation 5 ILE A 303
PHE A 304
GLY A 306
SER A 311
LEU A 211
 None
RIT  A 602 (-3.7A)
HEM  A 601 ( 3.8A)
None
None
 1.00A 1fm6X-5veuA:
undetectable		 1fm6X-5veuA:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w1u CARBOXYLIC ESTER
HYDROLASE

(Culex
quinquefasciatus) 		PF00135
(COesterase) 		5 ILE A 106
GLY A 193
SER A 217
TYR A 416
LEU A 449
 None
 1.47A 1fm6X-5w1uA:
undetectable		 1fm6X-5w1uA:
19.67
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.
5wm4 SALICYLATE-AMP
LIGASE

(Streptomyces
gandocaensis) 		no annotation 5 ILE A  93
GLY A  94
LEU A 208
LEU A  22
TYR A 414
 None
 1.47A 1fm6X-5wm4A:
undetectable		 1fm6X-5wm4A:
13.60
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.
5yo8 TETRAPRENYL-BETA-CUR
CUMENE SYNTHASE

(Bacillus
alcalophilus) 		no annotation 5 GLY A  60
HIS A 299
TYR A 237
LEU A  65
TYR A 219
 None
 1.47A 1fm6X-5yo8A:
undetectable		 1fm6X-5yo8A:
14.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6bog RNA
POLYMERASE-ASSOCIATE
D PROTEIN RAPA

(Escherichia
coli) 		no annotation 5 ILE A 725
PHE A 723
GLY A 727
LEU A 783
LEU A 754
 None
 1.30A 1fm6X-6bogA:
undetectable		 1fm6X-6bogA:
14.92
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.
6d0n CLC-TYPE
FLUORIDE/PROTON
ANTIPORTER

(Enterococcus
casseliflavus) 		no annotation 5 ILE A 285
GLY A 281
SER A  43
LEU A 157
LEU A  39
 None
 1.43A 1fm6X-6d0nA:
undetectable		 1fm6X-6d0nA:
17.36
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.
6d0s TBC1 DOMAIN FAMILY
MEMBER 22B

(Homo sapiens) 		no annotation 5 CYH A 445
TYR A 430
MET A 410
LEU A 418
LEU A 485
 None
 1.35A 1fm6X-6d0sA:
undetectable		 1fm6X-6d0sA:
15.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6d6q EXOSOME COMPLEX
EXONUCLEASE RRP44

(Homo sapiens) 		no annotation 5 ILE K 701
CYH K 747
HIS K 691
TYR K 765
LEU K 632
 None
None
A  O  58 ( 4.1A)
None
A  O  58 ( 4.4A)
 1.36A 1fm6X-6d6qK:
undetectable		 1fm6X-6d6qK:
15.95