SIMILAR PATTERNS OF AMINO ACIDS FOR 1FML_B_RTLB501

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.
1ava BARLEY
ALPHA-AMYLASE/SUBTIL
ISIN INHIBITOR

(Hordeum vulgare) 		PF00197
(Kunitz_legume) 		5 ILE C  73
LEU C  76
LEU C  14
TYR C 139
ILE C 128
 None
 1.17A 1fmlB-1avaC:
undetectable		 1fmlB-1avaC:
18.18
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.
1b8x PROTEIN (AML-1B)

(Escherichia
coli) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		5 ILE A   3
TYR A  27
LEU A  20
TYR A  73
ILE A  70
 None
 1.21A 1fmlB-1b8xA:
0.0		 1fmlB-1b8xA:
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.
1ecg GLUTAMINE
PHOSPHORIBOSYLPYROPH
OSPHATE
AMIDOTRANSFERASE

(Escherichia
coli) 		PF00156
(Pribosyltran)
PF13522
(GATase_6) 		5 ILE A 308
LEU A 363
LEU A 282
ILE A 286
PHE A 436
 None
 1.20A 1fmlB-1ecgA:
0.0		 1fmlB-1ecgA:
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.
1ee6 PECTATE LYASE

(Bacillus sp.
KSM-P15) 		PF03211
(Pectate_lyase) 		5 ILE A 111
LEU A 130
LEU A 158
HIS A  66
ILE A 119
 None
 1.17A 1fmlB-1ee6A:
undetectable		 1fmlB-1ee6A:
16.81
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.
1flc HAEMAGGLUTININ-ESTER
ASE-FUSION
GLYCOPROTEIN
HAEMAGGLUTININ-ESTER
ASE-FUSION
GLYCOPROTEIN

(Influenza C
virus;
Influenza C
virus) 		PF02710
(Hema_HEFG)
PF03996
(Hema_esterase)
PF08720
(Hema_stalk) 		5 LEU B  93
LEU B  92
SER B  89
LEU A  36
ILE A 408
 None
 1.11A 1fmlB-1flcB:
undetectable		 1fmlB-1flcB:
19.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1fml RETINOL DEHYDRATASE

(Spodoptera
frugiperda) 		PF00685
(Sulfotransfer_1) 		12 ILE A 111
TYR A 112
TYR A 120
LEU A 138
LEU A 139
SER A 142
HIS A 164
HIS A 197
LEU A 201
TYR A 298
ILE A 303
PHE A 310
 RTL  A 401 ( 4.9A)
RTL  A 401 ( 4.8A)
RTL  A 401 ( 4.5A)
RTL  A 401 ( 4.6A)
None
RTL  A 401 (-3.2A)
RTL  A 401 (-4.4A)
RTL  A 401 (-4.2A)
RTL  A 401 ( 4.3A)
RTL  A 401 (-4.2A)
RTL  A 401 ( 4.0A)
RTL  A 401 (-4.3A)
 0.04A 1fmlB-1fmlA:
59.2		 1fmlB-1fmlA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1fml RETINOL DEHYDRATASE

(Spodoptera
frugiperda) 		PF00685
(Sulfotransfer_1) 		6 LEU A 138
LEU A 139
SER A 142
TYR A 298
ILE A 301
PHE A 310
 RTL  A 401 ( 4.6A)
None
RTL  A 401 (-3.2A)
RTL  A 401 (-4.2A)
None
RTL  A 401 (-4.3A)
 1.34A 1fmlB-1fmlA:
59.2		 1fmlB-1fmlA:
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.
1gaj HIGH-AFFINITY
BRANCHED CHAIN AMINO
ACID TRANSPORT
ATP-BINDING PROTEIN

(Methanocaldococcus
jannaschii) 		PF00005
(ABC_tran) 		5 ILE A  53
LEU A  23
LEU A 207
TYR A 224
ILE A  38
 None
 1.20A 1fmlB-1gajA:
0.1		 1fmlB-1gajA:
22.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gtu GLUTATHIONE
S-TRANSFERASE

(Homo sapiens) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		5 ILE A   3
TYR A  27
LEU A  20
TYR A  78
ILE A  75
 None
 1.21A 1fmlB-1gtuA:
1.1		 1fmlB-1gtuA:
22.61
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.
1hlk BETA-LACTAMASE, TYPE
II

(Bacteroides
fragilis) 		no annotation 5 ILE A  72
LEU A  80
HIS A  99
HIS A 223
TYR A  40
 None
None
ZN  A1001 (-3.4A)
113  A2002 ( 3.6A)
None
 1.23A 1fmlB-1hlkA:
undetectable		 1fmlB-1hlkA:
20.51
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.
1kj2 KB5-C20 T-CELL
RECEPTOR ALPHA-CHAIN

(Mus musculus) 		PF07686
(V-set) 		5 TYR A  88
LEU A  46
LEU A  73
ILE A  64
PHE A  29
 None
 1.21A 1fmlB-1kj2A:
undetectable		 1fmlB-1kj2A:
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.
1n7g GDP-D-MANNOSE-4,6-DE
HYDRATASE

(Arabidopsis
thaliana) 		PF16363
(GDP_Man_Dehyd) 		5 ILE A  30
LEU A  48
LEU A  49
TYR A 111
ILE A  33
 None
 0.92A 1fmlB-1n7gA:
undetectable		 1fmlB-1n7gA:
21.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ogo DEXTRANASE

(Talaromyces
minioluteus) 		PF03718
(Glyco_hydro_49)
PF17433
(Glyco_hydro_49N) 		5 ILE X 526
LEU X 491
SER X 524
LEU X 536
ILE X 538
 None
 1.13A 1fmlB-1ogoX:
undetectable		 1fmlB-1ogoX:
18.45
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.
1ri6 PUTATIVE ISOMERASE
YBHE

(Escherichia
coli) 		PF10282
(Lactonase) 		5 ILE A 292
LEU A 313
HIS A 286
TYR A 246
ILE A 255
 None
 1.09A 1fmlB-1ri6A:
undetectable		 1fmlB-1ri6A:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sh2 RNA POLYMERASE

(Norwalk virus) 		PF00680
(RdRP_1) 		5 ILE A 463
LEU A 444
LEU A 440
TYR A 455
ILE A 458
 None
 1.16A 1fmlB-1sh2A:
undetectable		 1fmlB-1sh2A:
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.
1uwy CARBOXYPEPTIDASE M

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF13620
(CarboxypepD_reg) 		5 ILE A 288
LEU A  76
LEU A  75
HIS A 295
LEU A  83
 None
 1.22A 1fmlB-1uwyA:
undetectable		 1fmlB-1uwyA:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ven BETA-AMYLASE

(Bacillus cereus) 		PF00686
(CBM_20)
PF01373
(Glyco_hydro_14) 		5 TYR A 388
LEU A 349
LEU A 356
TYR A 313
ILE A 353
 None
 1.24A 1fmlB-1venA:
undetectable		 1fmlB-1venA:
22.64
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.
1wao SERINE/THREONINE
PROTEIN PHOSPHATASE
5

(Homo sapiens) 		PF00149
(Metallophos)
PF00515
(TPR_1)
PF08321
(PPP5) 		5 TYR 1 434
SER 1 460
HIS 1 244
HIS 1 352
ILE 1 424
 None
None
MN  1 602 (-3.3A)
MN  1 601 (-3.6A)
None
 1.16A 1fmlB-1wao1:
undetectable		 1fmlB-1wao1:
23.08
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.
1we5 PUTATIVE FAMILY 31
GLUCOSIDASE YICI

(Escherichia
coli) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		5 ILE A 197
LEU A 251
HIS A 439
LEU A 209
ILE A 242
 None
 1.21A 1fmlB-1we5A:
undetectable		 1fmlB-1we5A:
18.76
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.
1wza ALPHA-AMYLASE A

(Halothermothrix
orenii) 		PF00128
(Alpha-amylase) 		5 LEU A 284
HIS A  31
TYR A 308
ILE A 307
PHE A 317
 None
 1.18A 1fmlB-1wzaA:
undetectable		 1fmlB-1wzaA:
21.41
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.
1zj9 PROBABLE
FERREDOXIN-DEPENDENT
NITRITE REDUCTASE
NIRA

(Mycobacterium
tuberculosis) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		5 ILE A 373
LEU A 403
LEU A 398
LEU A 358
ILE A 357
 None
 1.19A 1fmlB-1zj9A:
undetectable		 1fmlB-1zj9A:
20.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dao TRANSCRIPTION FACTOR
ETV6

(Homo sapiens) 		PF00178
(Ets) 		5 ILE A  77
LEU A  86
HIS A  70
TYR A  61
ILE A  40
 None
 1.17A 1fmlB-2daoA:
undetectable		 1fmlB-2daoA:
17.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dfs MYOSIN-5A

(Gallus gallus) 		PF00063
(Myosin_head)
PF00612
(IQ) 		5 ILE A 139
TYR A 175
TYR A 119
HIS A 657
ILE A 124
 None
 0.95A 1fmlB-2dfsA:
undetectable		 1fmlB-2dfsA:
14.97
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.
2hdn ELONGATION FACTOR
EF-TU

(Escherichia
coli) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2) 		5 ILE B 356
LEU B 343
TYR B 326
ILE B 341
PHE B 323
 None
 1.08A 1fmlB-2hdnB:
undetectable		 1fmlB-2hdnB:
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.
2hrz NUCLEOSIDE-DIPHOSPHA
TE-SUGAR EPIMERASE

(Agrobacterium
fabrum) 		PF01370
(Epimerase) 		5 ILE A 189
LEU A  87
HIS A 227
ILE A 184
PHE A 303
 None
 1.23A 1fmlB-2hrzA:
undetectable		 1fmlB-2hrzA:
22.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i0m PHOSPHATE TRANSPORT
SYSTEM PROTEIN PHOU

(Streptococcus
pneumoniae) 		PF01895
(PhoU) 		5 ILE A  83
LEU A  90
HIS A  10
HIS A 140
ILE A 200
 None
None
ZN  A 218 (-3.3A)
None
None
 1.06A 1fmlB-2i0mA:
undetectable		 1fmlB-2i0mA:
21.97
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.
2jva PEPTIDYL-TRNA
HYDROLASE DOMAIN
PROTEIN

(Pseudomonas
syringae group
genomosp. 3) 		PF00472
(RF-1) 		5 ILE A  15
LEU A  48
SER A  46
LEU A  91
ILE A  95
 None
 1.25A 1fmlB-2jvaA:
undetectable		 1fmlB-2jvaA:
16.24
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.
2nan CD302 ANTIGEN

(Homo sapiens) 		PF00059
(Lectin_C) 		5 ILE A  66
TYR A  37
LEU A  76
LEU A  91
ILE A  89
 None
 1.04A 1fmlB-2nanA:
undetectable		 1fmlB-2nanA:
15.86
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.
2ohh TYPE A FLAVOPROTEIN
FPRA

(Methanothermobacter
thermautotrophicus) 		PF00258
(Flavodoxin_1)
PF00753
(Lactamase_B) 		5 TYR A 105
LEU A 142
LEU A 135
HIS A  88
LEU A  48
 None
None
None
FE  A 501 (-3.1A)
None
 1.25A 1fmlB-2ohhA:
undetectable		 1fmlB-2ohhA:
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.
2ppv UNCHARACTERIZED
PROTEIN

(Staphylococcus
epidermidis) 		PF01933
(UPF0052) 		5 ILE A 311
TYR A 312
HIS A 302
LEU A   8
ILE A  29
 None
 1.17A 1fmlB-2ppvA:
undetectable		 1fmlB-2ppvA:
21.01
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.
2q6d INFECTIOUS
BRONCHITIS VIRUS
(IBV) MAIN PROTEASE

(Avian
coronavirus) 		PF05409
(Peptidase_C30) 		5 ILE A 112
LEU A 139
SER A 137
TYR A 116
ILE A 121
 None
 1.23A 1fmlB-2q6dA:
undetectable		 1fmlB-2q6dA:
20.16
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.
2yk3 CYTOCHROME C

(Crithidia
fasciculata) 		PF00034
(Cytochrom_C) 		5 ILE A 106
LEU A  46
LEU A 112
LEU A  79
PHE A  85
 None
HEM  A 200 (-4.3A)
None
HEM  A 200 (-4.4A)
None
 1.18A 1fmlB-2yk3A:
undetectable		 1fmlB-2yk3A:
14.66
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.
2z6v PUTATIVE
UNCHARACTERIZED
PROTEIN

(Mycobacterium
avium) 		PF13469
(Sulfotransfer_3) 		5 TYR A 104
LEU A 106
SER A 114
HIS A 175
ILE A 102
 None
 1.18A 1fmlB-2z6vA:
10.0		 1fmlB-2z6vA:
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.
2zoa PHOSPHOHYDROLASE

(Klebsiella
aerogenes) 		PF00149
(Metallophos) 		5 ILE A  77
LEU A 131
SER A 121
HIS A   5
ILE A 191
 None
 1.06A 1fmlB-2zoaA:
undetectable		 1fmlB-2zoaA:
19.89
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.
3aqc COMPONENT B OF
HEXAPRENYL
DIPHOSPHATE SYNTHASE

(Micrococcus
luteus) 		PF00348
(polyprenyl_synt) 		5 ILE B 139
LEU B 181
HIS B  83
LEU B 120
ILE B 123
 None
None
2DE  B 329 ( 4.5A)
None
None
 1.24A 1fmlB-3aqcB:
undetectable		 1fmlB-3aqcB:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b2r CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE

(Homo sapiens) 		PF00233
(PDEase_I) 		5 ILE A 716
LEU A 651
SER A 652
LEU A 701
ILE A 700
 None
 1.15A 1fmlB-3b2rA:
undetectable		 1fmlB-3b2rA:
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.
3bjc CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE

(Homo sapiens) 		PF00233
(PDEase_I) 		5 ILE A 716
LEU A 651
SER A 652
LEU A 701
ILE A 700
 None
 1.15A 1fmlB-3bjcA:
undetectable		 1fmlB-3bjcA:
17.16
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.
3c5y RIBOSE/GALACTOSE
ISOMERASE

(Novosphingobium
aromaticivorans) 		PF02502
(LacAB_rpiB)
PF12408
(DUF3666) 		5 ILE A   3
LEU A  59
LEU A  60
LEU A   5
ILE A   6
 None
 1.23A 1fmlB-3c5yA:
undetectable		 1fmlB-3c5yA:
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.
3c5y RIBOSE/GALACTOSE
ISOMERASE

(Novosphingobium
aromaticivorans) 		PF02502
(LacAB_rpiB)
PF12408
(DUF3666) 		5 LEU A  59
LEU A  60
HIS A  19
TYR A  36
ILE A   6
 None
 1.01A 1fmlB-3c5yA:
undetectable		 1fmlB-3c5yA:
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.
3cq5 HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE

(Corynebacterium
glutamicum) 		PF00155
(Aminotran_1_2) 		5 TYR A 239
LEU A 237
SER A 227
HIS A 126
LEU A 102
 None
None
PMP  A 401 (-2.6A)
None
None
 1.18A 1fmlB-3cq5A:
undetectable		 1fmlB-3cq5A:
23.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dip ENOLASE

(unidentified) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 LEU A  93
LEU A  96
HIS A  47
LEU A   7
ILE A   4
 None
 1.25A 1fmlB-3dipA:
undetectable		 1fmlB-3dipA:
21.32
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.
3epj TRNA
ISOPENTENYLTRANSFERA
SE

(Saccharomyces
cerevisiae) 		PF01715
(IPPT) 		5 TYR A 207
LEU A 357
LEU A 356
LEU A 304
ILE A 305
 None
 1.21A 1fmlB-3epjA:
6.6		 1fmlB-3epjA:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eyt UNCHARACTERIZED
PROTEIN SPOA0173

(Ruegeria
pomeroyi) 		PF00578
(AhpC-TSA) 		5 ILE A   8
LEU A  20
LEU A  23
LEU A  65
ILE A  30
 EDO  A 201 (-4.4A)
None
None
None
None
 1.16A 1fmlB-3eytA:
undetectable		 1fmlB-3eytA:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3f2a PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE PIM-1

(Homo sapiens) 		PF00069
(Pkinase) 		5 LEU A 231
LEU A 228
HIS A 303
LEU A 182
PHE A 132
 None
 1.23A 1fmlB-3f2aA:
undetectable		 1fmlB-3f2aA:
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.
3fok UNCHARACTERIZED
PROTEIN CGL0159

(Corynebacterium
glutamicum) 		no annotation 5 ILE A   6
TYR A  70
LEU A  72
LEU A  98
ILE A  94
 None
 1.23A 1fmlB-3fokA:
undetectable		 1fmlB-3fokA:
21.11
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.
3g04 THYROTROPIN RECEPTOR

(Homo sapiens) 		PF13306
(LRR_5) 		5 ILE C 106
TYR C  82
LEU C  57
LEU C 100
ILE C  78
 None
 1.06A 1fmlB-3g04C:
undetectable		 1fmlB-3g04C:
22.04
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.
3h68 SERINE/THREONINE-PRO
TEIN PHOSPHATASE 5

(Homo sapiens) 		PF00149
(Metallophos)
PF08321
(PPP5) 		5 TYR A 434
SER A 460
HIS A 244
HIS A 352
ILE A 424
 None
None
ZN  A 501 ( 3.3A)
ZN  A 500 ( 3.2A)
None
 1.14A 1fmlB-3h68A:
undetectable		 1fmlB-3h68A:
23.45
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.
3i3o SHORT CHAIN
DEHYDROGENASE

(Bacillus
anthracis) 		PF13561
(adh_short_C2) 		5 TYR A 193
LEU A 190
SER A 194
LEU A 147
ILE A 142
 NAE  A 311 (-4.6A)
None
None
None
None
 1.15A 1fmlB-3i3oA:
undetectable		 1fmlB-3i3oA:
19.61
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.
3knt N-GLYCOSYLASE/DNA
LYASE

(Methanocaldococcus
jannaschii) 		no annotation 5 ILE A 160
TYR A 159
LEU A 179
LEU A 151
ILE A 150
 None
 0.94A 1fmlB-3kntA:
undetectable		 1fmlB-3kntA:
21.02
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.
3lq1 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE

(Listeria
monocytogenes) 		PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
PF16582
(TPP_enzyme_M_2) 		5 ILE A 345
LEU A 342
TYR A 316
ILE A 335
PHE A 226
 None
 1.17A 1fmlB-3lq1A:
undetectable		 1fmlB-3lq1A:
19.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lys PROPHAGE PI2 PROTEIN
01, INTEGRASE

(Lactococcus
lactis) 		PF14659
(Phage_int_SAM_3) 		5 TYR A  63
LEU A 138
SER A 134
TYR A 108
ILE A 103
 None
 1.00A 1fmlB-3lysA:
undetectable		 1fmlB-3lysA:
14.81
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.
3m66 MTERF
DOMAIN-CONTAINING
PROTEIN 1,
MITOCHONDRIAL

(Homo sapiens) 		PF02536
(mTERF) 		5 ILE A 215
LEU A 179
LEU A 178
LEU A 192
ILE A 188
 None
 1.07A 1fmlB-3m66A:
undetectable		 1fmlB-3m66A:
23.45
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.
3ncy ADIC

(Salmonella
enterica) 		PF13520
(AA_permease_2) 		5 ILE A 420
TYR A 424
LEU A  85
LEU A  92
TYR A 367
 None
 1.12A 1fmlB-3ncyA:
undetectable		 1fmlB-3ncyA:
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.
3nqh GLYCOSYL HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF04616
(Glyco_hydro_43) 		5 ILE A  97
LEU A 152
LEU A 153
LEU A 148
PHE A  72
 None
 1.24A 1fmlB-3nqhA:
undetectable		 1fmlB-3nqhA:
19.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nz4 PHENYLALANINE
AMMONIA-LYASE

(Taxus
canadensis) 		PF00221
(Lyase_aromatic) 		5 ILE A 185
TYR A 184
LEU A 109
LEU A 189
ILE A 190
 None
 1.10A 1fmlB-3nz4A:
undetectable		 1fmlB-3nz4A:
19.71
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.
3rr5 DNA LIGASE

(Thermococcus
sp. 1519) 		PF01068
(DNA_ligase_A_M)
PF04675
(DNA_ligase_A_N)
PF04679
(DNA_ligase_A_C) 		5 ILE A 277
LEU A 300
LEU A 347
ILE A 382
PHE A 350
 None
 0.92A 1fmlB-3rr5A:
undetectable		 1fmlB-3rr5A:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t5v NUCLEAR MRNA EXPORT
PROTEIN THP1

(Saccharomyces
cerevisiae) 		PF01399
(PCI) 		5 TYR B 343
LEU B 404
LEU B 407
TYR B 365
ILE B 368
 None
 1.22A 1fmlB-3t5vB:
undetectable		 1fmlB-3t5vB:
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.
3u5u RAUCAFFRICINE-O-BETA
-D-GLUCOSIDASE

(Rauvolfia
serpentina) 		PF00232
(Glyco_hydro_1) 		5 ILE A 271
TYR A 339
LEU A 335
SER A 338
PHE A 154
 None
 1.07A 1fmlB-3u5uA:
undetectable		 1fmlB-3u5uA:
19.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3uca GERANYLTRANSTRANSFER
ASE

(Clostridium
perfringens) 		PF00348
(polyprenyl_synt) 		5 ILE A 192
LEU A 292
LEU A 289
HIS A  84
ILE A  57
 None
 1.22A 1fmlB-3ucaA:
undetectable		 1fmlB-3ucaA:
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.
4af3 AURORA KINASE B

(Homo sapiens) 		PF00069
(Pkinase) 		5 ILE A 216
LEU A 162
HIS A 198
LEU A 184
ILE A 180
 None
 1.08A 1fmlB-4af3A:
undetectable		 1fmlB-4af3A:
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.
4af3 AURORA KINASE B

(Homo sapiens) 		PF00069
(Pkinase) 		5 ILE A 216
LEU A 208
HIS A 198
LEU A 184
ILE A 180
 None
 1.23A 1fmlB-4af3A:
undetectable		 1fmlB-4af3A:
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.
4dvy CYTOTOXICITY-ASSOCIA
TED IMMUNODOMINANT
ANTIGEN

(Helicobacter
pylori) 		no annotation 5 ILE P 463
TYR P 473
LEU P 471
SER P 472
ILE P 449
 None
 1.12A 1fmlB-4dvyP:
undetectable		 1fmlB-4dvyP:
18.31
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.
4eq5 DNA LIGASE

(Thermococcus
sibiricus) 		PF01068
(DNA_ligase_A_M)
PF04675
(DNA_ligase_A_N)
PF04679
(DNA_ligase_A_C) 		5 ILE A 278
LEU A 301
LEU A 348
ILE A 383
PHE A 351
 None
None
None
None
AMP  A 601 (-3.3A)
 0.83A 1fmlB-4eq5A:
undetectable		 1fmlB-4eq5A:
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.
4gkp SPINDLE POLE
BODY-ASSOCIATED
PROTEIN VIK1

([Candida]
glabrata) 		PF16796
(Microtub_bd) 		5 ILE A 547
LEU A 526
SER A 529
LEU A 494
ILE A 492
 None
 1.20A 1fmlB-4gkpA:
undetectable		 1fmlB-4gkpA:
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.
4h3v OXIDOREDUCTASE
DOMAIN PROTEIN

(Kribbella
flavida) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 LEU A 370
LEU A 199
TYR A 163
ILE A 196
PHE A 290
 None
 1.25A 1fmlB-4h3vA:
undetectable		 1fmlB-4h3vA:
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.
4hqn SPOROZOITE SURFACE
PROTEIN 2

(Plasmodium
vivax) 		PF00090
(TSP_1)
PF00092
(VWA) 		5 ILE A  82
LEU A  71
SER A  74
LEU A 152
ILE A 154
 None
 1.18A 1fmlB-4hqnA:
undetectable		 1fmlB-4hqnA:
20.45
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.
4iv5 ASPARTATE
CARBAMOYLTRANSFERASE
, PUTATIVE

(Trypanosoma
cruzi) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 ILE A 120
SER A  14
HIS A 141
ILE A 100
PHE A  58
 None
None
UNX  A 402 ( 4.2A)
None
None
 1.11A 1fmlB-4iv5A:
undetectable		 1fmlB-4iv5A:
21.98
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.
4lbw ELONGATION FACTOR
TU-A

(Thermus
thermophilus) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2) 		5 ILE A 131
TYR A 209
LEU A 202
HIS A 119
ILE A 206
 None
 1.11A 1fmlB-4lbwA:
undetectable		 1fmlB-4lbwA:
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.
4nsx U3 SMALL NUCLEOLAR
RNA-ASSOCIATED
PROTEIN 21

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		5 ILE A 284
LEU A 273
LEU A 287
ILE A 310
PHE A 256
 None
 0.89A 1fmlB-4nsxA:
undetectable		 1fmlB-4nsxA:
18.70
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.
4o5h PHENYLACETALDEHYDE
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00171
(Aldedh) 		5 ILE A 187
LEU A 180
LEU A 181
LEU A  93
ILE A  97
 None
 1.12A 1fmlB-4o5hA:
undetectable		 1fmlB-4o5hA:
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.
4ph0 BLV CAPSID

(Bovine leukemia
virus) 		PF00607
(Gag_p24) 		5 LEU A  97
SER A 101
HIS A  70
LEU A  74
ILE A  78
 None
 1.15A 1fmlB-4ph0A:
undetectable		 1fmlB-4ph0A:
18.31
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.
4ph3 BLV CAPSID

(Bovine leukemia
virus) 		PF00607
(Gag_p24) 		5 LEU A  97
SER A 101
HIS A  70
LEU A  74
ILE A  78
 None
None
None
None
IOD  A 207 ( 4.4A)
 1.18A 1fmlB-4ph3A:
undetectable		 1fmlB-4ph3A:
17.54
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.
4pt2 ENCAPSULIN PROTEIN

(Myxococcus
xanthus) 		no annotation 5 ILE P 269
LEU P 266
HIS P 177
LEU P 141
ILE P 129
 None
 1.06A 1fmlB-4pt2P:
undetectable		 1fmlB-4pt2P:
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.
4tn0 UPF0141 PROTEIN YJDB

(Campylobacter
jejuni) 		PF00884
(Sulfatase) 		5 TYR A 400
LEU A 398
SER A 357
LEU A 405
TYR A 234
 None
 1.09A 1fmlB-4tn0A:
undetectable		 1fmlB-4tn0A:
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.
4u8f PUTATIVE
UNCHARACTERIZED
PROTEIN GBS1892

(Streptococcus
agalactiae) 		PF02502
(LacAB_rpiB)
PF12408
(DUF3666) 		5 ILE A   3
LEU A  59
LEU A  60
LEU A   5
ILE A   6
 None
 1.19A 1fmlB-4u8fA:
undetectable		 1fmlB-4u8fA:
21.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xgx FAD:PROTEIN FMN
TRANSFERASE

(Escherichia
coli) 		PF02424
(ApbE) 		5 ILE A  31
TYR A 188
LEU A 179
LEU A  18
ILE A  46
 None
 1.23A 1fmlB-4xgxA:
undetectable		 1fmlB-4xgxA:
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.
4yfa PROTEIN RELATED TO
PENICILLIN ACYLASE
PROTEIN RELATED TO
PENICILLIN ACYLASE

(Acidovorax sp.
MR-S7;
Acidovorax sp.
MR-S7) 		PF01804
(Penicil_amidase)
PF01804
(Penicil_amidase) 		6 ILE A 172
LEU A  78
SER A 166
HIS C 125
TYR A 157
ILE A  94
 None
 1.34A 1fmlB-4yfaA:
undetectable		 1fmlB-4yfaA:
18.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5abm RETINAL
DEHYDROGENASE 1

(Ovis aries) 		PF00171
(Aldedh) 		5 ILE A 179
LEU A 172
LEU A 173
LEU A  91
ILE A  95
 None
 1.00A 1fmlB-5abmA:
undetectable		 1fmlB-5abmA:
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.
5e9u GLYCOSYLTRANSFERASE
GTF1

(Streptococcus
gordonii) 		PF00534
(Glycos_transf_1) 		5 ILE A 217
LEU A 496
LEU A 497
HIS A 242
ILE A 303
 None
None
None
NAG  A 602 (-3.6A)
None
 1.22A 1fmlB-5e9uA:
undetectable		 1fmlB-5e9uA:
22.14
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.
5g52 VP2

(Deformed wing
virus) 		PF00073
(Rhv) 		5 ILE B  84
LEU B  90
SER B  91
HIS B 144
ILE B 199
 None
 1.16A 1fmlB-5g52B:
undetectable		 1fmlB-5g52B:
21.61
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.
5g5t ARGONAUTE

(Methanocaldococcus
jannaschii) 		PF02171
(Piwi) 		5 ILE A 534
TYR A 547
LEU A 545
LEU A 552
ILE A 549
 None
 1.01A 1fmlB-5g5tA:
undetectable		 1fmlB-5g5tA:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gr1 1,4-ALPHA-GLUCAN
BRANCHING ENZYME
GLGB

(Cyanothece sp.
ATCC 51142) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C)
PF02922
(CBM_48) 		5 TYR A 587
LEU A 636
LEU A 633
HIS A 646
ILE A 750
 None
 1.20A 1fmlB-5gr1A:
undetectable		 1fmlB-5gr1A:
18.76
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.
5hmp UNCONVENTIONAL
MYOSIN-VC

(Homo sapiens) 		PF00063
(Myosin_head) 		5 ILE A 137
TYR A 173
TYR A 117
HIS A 645
ILE A 122
 None
None
ADP  A 803 (-4.6A)
None
None
 1.04A 1fmlB-5hmpA:
undetectable		 1fmlB-5hmpA:
20.08
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.
5ip9 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1

(Saccharomyces
cerevisiae) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		5 ILE A 274
LEU A 296
LEU A 295
LEU A 270
ILE A 269
 None
 1.13A 1fmlB-5ip9A:
undetectable		 1fmlB-5ip9A:
11.09
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.
5lmc ANAEROBIC NITRIC
OXIDE REDUCTASE
FLAVORUBREDOXIN

(Escherichia
coli) 		PF00258
(Flavodoxin_1)
PF00301
(Rubredoxin)
PF00753
(Lactamase_B) 		5 TYR A 101
LEU A 138
LEU A 130
HIS A  84
ILE A  40
 None
None
None
FEO  A 501 (-3.2A)
None
 1.19A 1fmlB-5lmcA:
2.6		 1fmlB-5lmcA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mgy FAD:PROTEIN FMN
TRANSFERASE

(Pseudomonas
stutzeri) 		no annotation 5 TYR H 188
LEU H  72
LEU H  75
TYR H  48
ILE H 209
 None
 1.17A 1fmlB-5mgyH:
undetectable		 1fmlB-5mgyH:
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.
5o0j ADP-DEPENDENT
GLUCOKINASE

(Pyrococcus
horikoshii) 		no annotation 5 ILE A 249
LEU A 256
LEU A 237
ILE A 234
PHE A 270
 None
 1.14A 1fmlB-5o0jA:
undetectable		 1fmlB-5o0jA:
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.
5oqp CONDENSIN COMPLEX
SUBUNIT 3

(Saccharomyces
cerevisiae) 		no annotation 5 ILE A 833
LEU A 896
SER A 876
LEU A 829
ILE A 858
 None
 1.14A 1fmlB-5oqpA:
undetectable		 1fmlB-5oqpA:
17.45
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.
5tqw INHIBITOR OF NUCLEAR
FACTOR KAPPA-B
KINASE SUBUNIT ALPHA

(Homo sapiens) 		PF00069
(Pkinase) 		5 ILE A 215
LEU A 122
LEU A 125
HIS A 432
ILE A 268
 None
 1.20A 1fmlB-5tqwA:
undetectable		 1fmlB-5tqwA:
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.
5vlj NUCLEAR DISTRIBUTION
PROTEIN PAC1

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		5 ILE B 169
LEU B 179
LEU B 194
ILE B 222
PHE B 208
 None
 1.24A 1fmlB-5vljB:
undetectable		 1fmlB-5vljB:
18.67
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.
5vvr DNA REPAIR AND
RECOMBINATION
PROTEIN RAD26

(Saccharomyces
cerevisiae) 		no annotation 5 ILE M 336
LEU M 444
LEU M 350
HIS M 341
ILE M 445
 None
 1.20A 1fmlB-5vvrM:
undetectable		 1fmlB-5vvrM:
16.15
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.
5x0z FLAGELLAR MOTOR
SWITCH PROTEIN
(FLIM)

(Helicobacter
pylori) 		PF02154
(FliM) 		5 ILE E 179
LEU E 154
LEU E 151
LEU E 118
ILE E 120
 None
 1.18A 1fmlB-5x0zE:
undetectable		 1fmlB-5x0zE:
19.55
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.
5xsx CHITINASE

(Thermococcus
chitonophagus) 		no annotation 5 ILE A 609
TYR A 506
TYR A 723
LEU A 716
ILE A 721
 None
GOL  A1005 (-4.8A)
GOL  A1005 ( 4.0A)
None
None
 1.09A 1fmlB-5xsxA:
undetectable		 1fmlB-5xsxA:
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.
5ydj ACETYLCHOLINESTERASE

(Anopheles
gambiae) 		no annotation 5 LEU A 368
LEU A 371
SER A 367
HIS A 600
PHE A 449
 None
None
None
SEB  A 360 ( 4.2A)
None
 1.19A 1fmlB-5ydjA:
undetectable		 1fmlB-5ydjA:
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.
5zw4 PUTATIVE
O-METHYLTRANSFERASE
YRRM

(Bacillus
subtilis) 		no annotation 5 ILE A 186
TYR A 189
LEU A 193
LEU A 162
ILE A 203
 None
 1.08A 1fmlB-5zw4A:
undetectable		 1fmlB-5zw4A:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c6l V-TYPE PROTON ATPASE
SUBUNIT A, VACUOLAR
ISOFORM
V-TYPE PROTON ATPASE
SUBUNIT C''

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		no annotation
no annotation 		5 ILE A 541
LEU A 609
LEU A 612
LEU A 734
ILE C 116
 None
 1.05A 1fmlB-6c6lA:
undetectable		 1fmlB-6c6lA:
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.
6d3i -

(-) 		no annotation 5 TYR A 241
LEU A 236
LEU A 237
LEU A 150
ILE A 158
 None
 1.13A 1fmlB-6d3iA:
undetectable		 1fmlB-6d3iA:
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.
6e85 -

(-) 		no annotation 5 LEU A  43
LEU A  47
HIS A 298
LEU A  24
ILE A  73
 None
 1.25A 1fmlB-6e85A:
undetectable		 1fmlB-6e85A:
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.
6f2c METHYLGLYOXAL
SYNTHASE

(Bacillus
subtilis) 		no annotation 5 ILE A  76
LEU A  72
HIS A   8
LEU A 105
ILE A 103
 None
None
GOL  A 202 (-4.1A)
None
None
 1.01A 1fmlB-6f2cA:
2.3		 1fmlB-6f2cA:
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.
6g72 NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
2

(Mus musculus) 		no annotation 5 TYR N  59
LEU N  33
LEU N  37
SER N  36
LEU N 106
 None
 1.21A 1fmlB-6g72N:
undetectable		 1fmlB-6g72N:
undetectable