SIMILAR PATTERNS OF AMINO ACIDS FOR 2FK8_A_SAMA302_0

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dj2 ADENYLOSUCCINATE
SYNTHETASE

(Arabidopsis
thaliana) 		PF00709
(Adenylsucc_synt) 		5 ILE A  87
GLY A 269
GLY A  54
ALA A 122
HIS A 123
 None
 0.86A 2fk8A-1dj2A:
undetectable		 2fk8A-1dj2A:
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.
1gt9 KUMAMOLYSIN

(Bacillus
subtilis) 		PF00082
(Peptidase_S8) 		5 THR 1 341
ILE 1 324
GLY 1 166
GLY 1 219
GLY 1 170
 None
 0.94A 2fk8A-1gt91:
2.1		 2fk8A-1gt91:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1itx GLYCOSYL HYDROLASE

(Bacillus
circulans) 		PF00704
(Glyco_hydro_18) 		5 THR A 357
ILE A 407
GLY A 341
GLY A 359
GLY A 339
 None
 0.97A 2fk8A-1itxA:
undetectable		 2fk8A-1itxA:
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.
1jcf ROD
SHAPE-DETERMINING
PROTEIN MREB

(Thermotoga
maritima) 		PF06723
(MreB_Mbl) 		5 ILE A 210
GLY A 211
GLY A 244
GLU A 245
ILE A 208
 None
 0.98A 2fk8A-1jcfA:
undetectable		 2fk8A-1jcfA:
23.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1k9x M32 CARBOXYPEPTIDASE

(Pyrococcus
furiosus) 		PF02074
(Peptidase_M32) 		6 THR A 424
TYR A 423
ILE A 308
LEU A 265
GLY A 310
HIS A 269
 None
 1.44A 2fk8A-1k9xA:
undetectable		 2fk8A-1k9xA:
21.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1kph CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE 1

(Mycobacterium
tuberculosis) 		PF02353
(CMAS) 		11 THR A  32
TYR A  33
GLY A  72
GLY A  74
LEU A  95
GLY A 122
TRP A 123
GLU A 124
ILE A 136
ALA A 138
HIS A 141
 SAH  A1900 (-4.1A)
10A  A1901 ( 3.5A)
SAH  A1900 (-3.1A)
SAH  A1900 (-3.2A)
SAH  A1900 (-4.4A)
SAH  A1900 (-3.2A)
SAH  A1900 (-4.3A)
SAH  A1900 (-2.9A)
SAH  A1900 (-4.2A)
SAH  A1900 (-3.2A)
SAH  A1900 (-4.4A)
 0.43A 2fk8A-1kphA:
40.6		 2fk8A-1kphA:
54.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1kpi CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE 2

(Mycobacterium
tuberculosis) 		PF02353
(CMAS) 		11 THR A  40
TYR A  41
ILE A  79
GLY A  80
GLY A  82
LEU A 103
GLY A 130
TRP A 131
GLU A 132
ALA A 146
HIS A 149
 SAH  A 900 (-4.4A)
10A  A 901 ( 3.7A)
None
SAH  A 900 (-3.3A)
SAH  A 900 (-3.1A)
SAH  A 900 (-4.4A)
SAH  A 900 (-3.3A)
SAH  A 900 (-4.5A)
SAH  A 900 (-3.1A)
SAH  A 900 (-3.1A)
SAH  A 900 (-4.3A)
 0.55A 2fk8A-1kpiA:
36.9		 2fk8A-1kpiA:
47.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis) 		PF02353
(CMAS) 		12 THR A  32
TYR A  33
ILE A  71
GLY A  72
GLY A  74
LEU A  95
GLY A 122
TRP A 123
GLU A 124
ILE A 136
ALA A 138
HIS A 141
 SAH  A 900 (-4.1A)
None
None
SAH  A 900 (-3.1A)
SAH  A 900 (-3.4A)
SAH  A 900 (-4.1A)
SAH  A 900 (-3.2A)
SAH  A 900 (-4.3A)
SAH  A 900 (-3.7A)
SAH  A 900 (-3.9A)
SAH  A 900 (-3.4A)
SAH  A 900 ( 4.8A)
 0.58A 2fk8A-1l1eA:
39.9		 2fk8A-1l1eA:
51.12
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.
1mf1 ADENYLOSUCCINATE
SYNTHETASE

(Mus musculus) 		PF00709
(Adenylsucc_synt) 		5 ILE A  98
GLY A 283
GLY A  66
ALA A 134
HIS A 135
 None
 0.86A 2fk8A-1mf1A:
undetectable		 2fk8A-1mf1A:
22.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1o94 TRIMETHYLAMINE
DEHYDROGENASE

(Methylophilus
methylotrophus) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		7 THR A  70
ILE A  31
GLY A  32
GLY A 359
GLY A 371
GLU A 373
ALA A  33
 None
 1.41A 2fk8A-1o94A:
undetectable		 2fk8A-1o94A:
16.87
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.
1oyp RIBONUCLEASE PH

(Bacillus
subtilis) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		5 GLY A 220
GLY A 217
LEU A 174
GLY A 225
GLU A 228
 None
 0.96A 2fk8A-1oypA:
undetectable		 2fk8A-1oypA:
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.
1p91 RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE A

(Escherichia
coli) 		PF13847
(Methyltransf_31) 		5 ILE A  92
GLY A  93
GLY A  95
ILE A 155
ALA A 157
 None
None
SAM  A1401 (-3.4A)
SAM  A1401 (-4.2A)
None
 0.49A 2fk8A-1p91A:
12.1		 2fk8A-1p91A:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ps9 2,4-DIENOYL-COA
REDUCTASE

(Escherichia
coli) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		5 GLY A 385
GLY A 664
GLY A 409
ILE A 460
ALA A 462
 None
 0.90A 2fk8A-1ps9A:
undetectable		 2fk8A-1ps9A:
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.
1pw4 GLYCEROL-3-PHOSPHATE
TRANSPORTER

(Escherichia
coli) 		PF07690
(MFS_1) 		5 TYR A 300
ILE A 357
GLY A 358
GLY A 302
ILE A 355
 None
 0.85A 2fk8A-1pw4A:
undetectable		 2fk8A-1pw4A:
21.94
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.
1rkx CDP-GLUCOSE-4,6-DEHY
DRATASE

(Yersinia
pseudotuberculosis) 		PF16363
(GDP_Man_Dehyd) 		5 GLY A  16
GLY A  19
LEU A  41
GLY A  64
ALA A  88
 NAD  A 360 (-3.4A)
NAD  A 360 (-3.3A)
NAD  A 360 (-4.1A)
None
NAD  A 360 (-3.6A)
 0.85A 2fk8A-1rkxA:
5.7		 2fk8A-1rkxA:
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.
1t8h YLMD PROTEIN
SEQUENCE HOMOLOGUE

(Geobacillus
stearothermophilus) 		PF02578
(Cu-oxidase_4) 		5 ILE A 267
GLY A 268
GLY A 115
LEU A  66
ALA A  23
 None
 0.99A 2fk8A-1t8hA:
undetectable		 2fk8A-1t8hA:
19.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1tpy METHOXY MYCOLIC ACID
SYNTHASE 2

(Mycobacterium
tuberculosis) 		PF02353
(CMAS) 		12 THR A  32
TYR A  33
ILE A  71
GLY A  72
GLY A  74
LEU A  95
GLY A 122
TRP A 123
GLU A 124
ILE A 136
ALA A 138
HIS A 141
 SAH  A1900 (-4.1A)
16A  A1901 ( 3.5A)
None
SAH  A1900 (-3.2A)
SAH  A1900 (-3.3A)
SAH  A1900 (-4.3A)
SAH  A1900 (-3.1A)
SAH  A1900 (-4.5A)
SAH  A1900 (-3.1A)
SAH  A1900 (-3.6A)
SAH  A1900 (-3.1A)
16A  A1901 ( 4.2A)
 0.52A 2fk8A-1tpyA:
39.7		 2fk8A-1tpyA:
51.57
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.
1v4g GLUTAMATE--CYSTEINE
LIGASE

(Escherichia
coli) 		PF04262
(Glu_cys_ligase) 		5 TYR A 196
GLY A 199
LEU A 452
ILE A 381
ALA A 231
 None
 0.96A 2fk8A-1v4gA:
undetectable		 2fk8A-1v4gA:
18.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v59 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Saccharomyces
cerevisiae) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ILE A 193
GLY A 192
GLY A 190
ILE A 218
ALA A 220
 None
NAD  A 482 (-3.5A)
NAD  A 482 (-3.0A)
None
NAD  A 482 ( 3.7A)
 0.71A 2fk8A-1v59A:
2.7		 2fk8A-1v59A:
21.57
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.
1wvg CDP-GLUCOSE
4,6-DEHYDRATASE

(Salmonella
enterica) 		PF16363
(GDP_Man_Dehyd) 		5 GLY A  18
GLY A  21
LEU A  43
GLY A  66
ALA A  90
 APR  A 400 (-3.2A)
APR  A 400 (-3.2A)
APR  A 400 (-4.1A)
None
APR  A 400 (-3.4A)
 0.82A 2fk8A-1wvgA:
5.1		 2fk8A-1wvgA:
23.54
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.
1xxl YCGJ PROTEIN

(Bacillus
subtilis) 		PF08241
(Methyltransf_11) 		6 ILE A  19
GLY A  20
GLY A  22
GLU A  70
ALA A  87
HIS A  90
 None
 0.47A 2fk8A-1xxlA:
18.6		 2fk8A-1xxlA:
22.77
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.
1y6j L-LACTATE
DEHYDROGENASE

(Ruminiclostridium
thermocellum) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ILE A 227
GLY A 224
LEU A 151
GLY A 237
ALA A 223
 None
 0.95A 2fk8A-1y6jA:
4.2		 2fk8A-1y6jA:
21.88
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.
2d81 PHB DEPOLYMERASE

(Talaromyces
funiculosus) 		PF10503
(Esterase_phd) 		5 TYR A  68
GLY A  42
GLY A  66
GLY A 249
ALA A  45
 None
 0.90A 2fk8A-2d81A:
undetectable		 2fk8A-2d81A:
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.
2e0x GAMMA-GLUTAMYLTRANSP
EPTIDASE
GAMMA-GLUTAMYLTRANSP
EPTIDASE

(Escherichia
coli;
Escherichia
coli) 		PF01019
(G_glu_transpept)
PF01019
(G_glu_transpept) 		5 THR B 407
TYR B 408
LEU A 158
GLY A 162
ALA A  76
 None
 1.00A 2fk8A-2e0xB:
undetectable		 2fk8A-2e0xB:
19.45
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.
2eij CYTOCHROME C OXIDASE
SUBUNIT 1

(Bos taurus) 		PF00115
(COX1) 		5 ILE A  75
GLY A  76
GLY A  16
GLY A 160
ILE A  73
 None
None
None
None
HEA  A 515 (-4.4A)
 0.70A 2fk8A-2eijA:
undetectable		 2fk8A-2eijA:
20.11
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.
2eo5 419AA LONG
HYPOTHETICAL
AMINOTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF00202
(Aminotran_3) 		5 GLY A 356
GLY A 338
LEU A 397
GLY A 259
ALA A 358
 None
 0.91A 2fk8A-2eo5A:
undetectable		 2fk8A-2eo5A:
21.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2fk7 METHOXY MYCOLIC ACID
SYNTHASE 4

(Mycobacterium
tuberculosis) 		PF02353
(CMAS) 		11 THR A  41
TYR A  42
ILE A  80
GLY A  81
GLY A  83
LEU A 104
GLY A 131
TRP A 132
GLU A 133
ILE A 145
ALA A 147
 None
 0.47A 2fk8A-2fk7A:
44.8		 2fk8A-2fk7A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2fk7 METHOXY MYCOLIC ACID
SYNTHASE 4

(Mycobacterium
tuberculosis) 		PF02353
(CMAS) 		9 THR A  86
ILE A  80
GLY A  81
GLY A  83
LEU A 104
GLY A 131
TRP A 132
GLU A 133
ALA A 147
 None
 1.46A 2fk8A-2fk7A:
44.8		 2fk8A-2fk7A:
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.
2j1n OUTER MEMBRANE
PROTEIN C

(Escherichia
coli) 		PF00267
(Porin_1) 		5 ILE A 184
GLY A 195
GLY A 223
GLY A 182
ILE A 193
 None
 0.89A 2fk8A-2j1nA:
undetectable		 2fk8A-2j1nA:
19.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jgr YEGS

(Escherichia
coli) 		PF00781
(DAGK_cat) 		5 ILE A  90
GLY A  89
LEU A   9
GLY A  64
ALA A 116
 None
 0.76A 2fk8A-2jgrA:
undetectable		 2fk8A-2jgrA:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pff FATTY ACID SYNTHASE
SUBUNIT ALPHA

(Saccharomyces
cerevisiae) 		PF00106
(adh_short)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		6 THR A1581
ILE A1384
GLY A1383
GLY A1381
GLY A1248
ALA A1590
 None
 1.36A 2fk8A-2pffA:
4.9		 2fk8A-2pffA:
10.43
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.
2qfr PURPLE ACID
PHOSPHATASE

(Phaseolus
vulgaris) 		PF00149
(Metallophos)
PF14008
(Metallophos_C)
PF16656
(Pur_ac_phosph_N) 		5 ILE A 133
GLY A 134
GLY A 322
GLY A 390
ALA A 362
 None
 1.01A 2fk8A-2qfrA:
undetectable		 2fk8A-2qfrA:
23.29
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.
2qty POLY(ADP-RIBOSE)
GLYCOHYDROLASE ARH3

(Mus musculus) 		PF03747
(ADP_ribosyl_GH) 		5 THR A 288
GLY A 307
LEU A  11
GLY A 143
ALA A 312
 None
 0.97A 2fk8A-2qtyA:
undetectable		 2fk8A-2qtyA:
22.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2r4j AEROBIC
GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Escherichia
coli) 		PF01266
(DAO)
PF16901
(DAO_C) 		5 THR A  41
ILE A  18
GLY A  15
GLY A  12
ALA A 205
 EDO  A1958 ( 3.2A)
None
None
FAD  A 600 (-3.0A)
None
 0.88A 2fk8A-2r4jA:
3.1		 2fk8A-2r4jA:
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.
2vwb PUTATIVE
O-SIALOGLYCOPROTEIN
ENDOPEPTIDASE

(Methanocaldococcus
jannaschii) 		PF00814
(Peptidase_M22)
PF01163
(RIO1) 		5 GLY A 286
GLY A 103
ILE A 113
ALA A 109
HIS A 106
 None
None
None
None
ANP  A1531 (-3.4A)
 0.99A 2fk8A-2vwbA:
undetectable		 2fk8A-2vwbA:
20.72
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.
2xxl GRAM-POSITIVE
SPECIFIC SERINE
PROTEASE, ISOFORM B

(Drosophila
melanogaster) 		PF00089
(Trypsin)
PF12032
(CLIP) 		6 ILE A 211
LEU A 168
GLY A 167
ILE A 224
ALA A 162
HIS A 163
 None
 1.38A 2fk8A-2xxlA:
undetectable		 2fk8A-2xxlA:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cea MYO-INOSITOL
2-DEHYDROGENASE

(Lactobacillus
plantarum) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 ILE A  13
GLY A  14
GLY A  16
LEU A  41
ALA A  78
 NAD  A 400 (-4.9A)
NAD  A 400 (-3.3A)
NAD  A 400 (-3.3A)
NAD  A 400 (-4.2A)
NAD  A 400 (-4.2A)
 0.92A 2fk8A-3ceaA:
5.4		 2fk8A-3ceaA:
20.38
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.
3cj1 ECTONUCLEOSIDE
TRIPHOSPHATE
DIPHOSPHOHYDROLASE 2

(Rattus
norvegicus) 		PF01150
(GDA1_CD39) 		5 THR A 351
TYR A 350
GLY A 204
GLY A 124
HIS A  50
 None
 0.95A 2fk8A-3cj1A:
undetectable		 2fk8A-3cj1A:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cos ALCOHOL
DEHYDROGENASE 4

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A 207
GLY A 205
GLY A 181
GLU A  70
HIS A  48
 NAD  A 400 (-3.4A)
NAD  A 400 (-3.4A)
None
None
NAD  A 400 (-3.8A)
 0.74A 2fk8A-3cosA:
5.9		 2fk8A-3cosA:
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.
3da1 GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Bacillus
halodurans) 		PF01266
(DAO)
PF16901
(DAO_C) 		5 ILE A  24
GLY A  25
GLY A  27
ILE A 369
ALA A 228
 FAD  A 609 (-4.6A)
FAD  A 609 ( 4.0A)
FAD  A 609 (-3.4A)
None
FAD  A 609 ( 3.9A)
 0.96A 2fk8A-3da1A:
undetectable		 2fk8A-3da1A:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dkn PREPROTEIN
TRANSLOCASE SUBUNIT
SECY

(Canis lupus) 		PF00344
(SecY) 		5 THR A 400
ILE A  75
LEU A 172
ILE A  62
ALA A  64
 None
 1.00A 2fk8A-3dknA:
undetectable		 2fk8A-3dknA:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ege PUTATIVE
METHYLTRANSFERASE
FROM ANTIBIOTIC
BIOSYNTHESIS PATHWAY

(Trichormus
variabilis) 		PF08241
(Methyltransf_11) 		6 ILE A  40
GLY A  41
GLY A  43
GLU A  85
ILE A 100
HIS A 105
 None
EDO  A 261 (-3.2A)
EDO  A 261 ( 3.9A)
None
None
EDO  A 261 ( 4.6A)
 1.02A 2fk8A-3egeA:
15.2		 2fk8A-3egeA:
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.
3ege PUTATIVE
METHYLTRANSFERASE
FROM ANTIBIOTIC
BIOSYNTHESIS PATHWAY

(Trichormus
variabilis) 		PF08241
(Methyltransf_11) 		6 ILE A  40
GLY A  41
GLY A  43
ILE A 100
ALA A 102
HIS A 105
 None
EDO  A 261 (-3.2A)
EDO  A 261 ( 3.9A)
None
EDO  A 261 ( 3.8A)
EDO  A 261 ( 4.6A)
 1.01A 2fk8A-3egeA:
15.2		 2fk8A-3egeA:
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.
3g5l PUTATIVE
S-ADENOSYLMETHIONINE
DEPENDENT
METHYLTRANSFERASE

(Listeria
monocytogenes) 		PF13649
(Methyltransf_25) 		5 GLY A  50
GLY A  52
LEU A  73
GLU A  98
ALA A 115
 None
 0.73A 2fk8A-3g5lA:
16.1		 2fk8A-3g5lA:
22.77
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.
3gwf CYCLOHEXANONE
MONOOXYGENASE

(Rhodococcus sp.
HI-31) 		PF00743
(FMO-like) 		5 THR A  47
TYR A  49
ILE A  14
GLY A  15
GLY A  17
 FAD  A 541 (-3.7A)
None
FAD  A 541 (-4.8A)
FAD  A 541 (-3.3A)
FAD  A 541 (-3.4A)
 0.98A 2fk8A-3gwfA:
undetectable		 2fk8A-3gwfA:
20.83
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.
3h3j L-LACTATE
DEHYDROGENASE 1

(Staphylococcus
aureus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ILE A  12
GLY A  13
GLY A  15
LEU A  39
ALA A  82
 None
NAD  A 500 ( 4.2A)
NAD  A 500 (-3.3A)
NAD  A 500 (-4.2A)
NAD  A 500 (-3.5A)
 0.88A 2fk8A-3h3jA:
5.7		 2fk8A-3h3jA:
22.41
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.
3j7a 40S RIBOSOMAL
PROTEIN US2

(Plasmodium
falciparum) 		PF00318
(Ribosomal_S2) 		5 TYR C  36
ILE C  24
GLY C  25
GLY C 166
GLU C 168
 None
 0.95A 2fk8A-3j7aC:
undetectable		 2fk8A-3j7aC:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jyn QUINONE
OXIDOREDUCTASE

(Pseudomonas
syringae group
genomosp. 3) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A  65
GLY A  88
GLY A  67
ALA A  94
HIS A  99
 None
 0.96A 2fk8A-3jynA:
6.9		 2fk8A-3jynA:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k30 HISTAMINE
DEHYDROGENASE

(Pimelobacter
simplex) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		5 GLY A 403
GLY A 663
GLY A 427
ILE A 481
ALA A 483
 None
 0.93A 2fk8A-3k30A:
undetectable		 2fk8A-3k30A:
20.48
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.
3pc3 CG1753, ISOFORM A

(Drosophila
melanogaster) 		PF00291
(PALP)
PF00571
(CBS) 		5 ILE A 121
GLY A 122
GLY A  92
GLY A 117
ALA A 124
 None
None
None
P1T  A 702 (-4.3A)
None
 1.00A 2fk8A-3pc3A:
3.1		 2fk8A-3pc3A:
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.
3q6t 43.2 KDA SALIVARY
PROTEIN

(Lutzomyia
longipalpis) 		PF03022
(MRJP) 		5 THR A 200
ILE A 278
GLY A 243
ILE A 222
ALA A 220
 None
 0.87A 2fk8A-3q6tA:
undetectable		 2fk8A-3q6tA:
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.
3sqg METHYL-COENZYME M
REDUCTASE, BETA
SUBUNIT

(uncultured
archaeon) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		5 GLY B 346
GLY B 383
GLU B 214
ALA B 351
HIS B 380
 None
None
None
None
MHO  A 499 ( 4.6A)
 0.96A 2fk8A-3sqgB:
undetectable		 2fk8A-3sqgB:
18.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3umm PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE

(Salmonella
enterica) 		PF02769
(AIRS_C)
PF13507
(GATase_5) 		5 GLY A 373
GLY A 369
GLY A 313
ILE A 655
ALA A 375
 None
 0.96A 2fk8A-3ummA:
2.8		 2fk8A-3ummA:
13.70
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.
3up4 OTEMO

(Pseudomonas
putida) 		PF00743
(FMO-like) 		5 THR A  47
TYR A  49
ILE A  15
GLY A  16
GLY A  18
 FAD  A 551 (-3.3A)
None
None
FAD  A 551 (-3.2A)
FAD  A 551 (-2.9A)
 0.98A 2fk8A-3up4A:
undetectable		 2fk8A-3up4A:
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.
3vse PUTATIVE
UNCHARACTERIZED
PROTEIN

(Staphylococcus
aureus) 		PF10672
(Methyltrans_SAM) 		5 ILE A  21
GLY A  61
GLY A  54
LEU A  32
ALA A  51
 None
 0.98A 2fk8A-3vseA:
13.3		 2fk8A-3vseA:
21.31
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.
3w1h L-SERYL-TRNA(SEC)
SELENIUM TRANSFERASE

(Aquifex
aeolicus) 		PF03841
(SelA) 		5 ILE A 294
GLY A 293
GLY A 144
GLY A 251
ALA A 292
 None
 0.98A 2fk8A-3w1hA:
4.0		 2fk8A-3w1hA:
19.30
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.
3w4k D-AMINO-ACID OXIDASE

(Homo sapiens) 		PF01266
(DAO) 		5 THR A  44
ILE A   6
GLY A   7
GLY A   9
ALA A  36
 FAD  A 401 (-4.0A)
None
FAD  A 401 (-3.1A)
FAD  A 401 (-3.2A)
FAD  A 401 (-3.8A)
 0.97A 2fk8A-3w4kA:
undetectable		 2fk8A-3w4kA:
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.
4ac3 BIFUNCTIONAL PROTEIN
GLMU

(Streptococcus
pneumoniae) 		PF00132
(Hexapep)
PF00483
(NTP_transferase)
PF14602
(Hexapep_2) 		5 THR A 129
GLY A 171
GLY A  77
GLU A 195
ILE A 152
 None
 1.00A 2fk8A-4ac3A:
undetectable		 2fk8A-4ac3A:
23.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aec CYSTEINE SYNTHASE,
MITOCHONDRIAL

(Arabidopsis
thaliana) 		PF00291
(PALP) 		5 ILE A 188
GLY A 189
GLY A 158
GLY A 184
ALA A 191
 None
 0.98A 2fk8A-4aecA:
undetectable		 2fk8A-4aecA:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bem F1FO ATPASE C2
SUBUNIT
F1FO ATPASE C1
SUBUNIT

(Acetobacterium
woodii;
Acetobacterium
woodii) 		PF00137
(ATP-synt_C)
PF00137
(ATP-synt_C) 		6 THR J 127
GLY A  22
GLY A  26
GLY A  68
ILE J 123
ALA J 121
 None
 1.09A 2fk8A-4bemJ:
undetectable		 2fk8A-4bemJ:
19.69
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.
4ce7 UNSATURATED
3S-RHAMNOGLYCURONYL
HYDROLASE

(Nonlabens
ulvanivorans) 		PF07470
(Glyco_hydro_88) 		5 THR A  52
TYR A  51
GLY A 347
GLY A 349
GLY A 326
 None
 0.97A 2fk8A-4ce7A:
undetectable		 2fk8A-4ce7A:
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.
4ci8 ECHINODERM
MICROTUBULE-ASSOCIAT
ED PROTEIN-LIKE 1

(Homo sapiens) 		PF00400
(WD40)
PF03451
(HELP) 		5 ILE A 506
GLY A 479
GLY A 461
GLY A 504
ILE A 463
 None
None
None
SO4  A1821 ( 4.6A)
None
 0.94A 2fk8A-4ci8A:
undetectable		 2fk8A-4ci8A:
20.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4d7e L-LYS MONOOXYGENASE

(Nocardia
farcinica) 		PF13434
(K_oxygenase) 		5 THR A 276
ILE A 212
GLY A 213
GLY A 215
HIS A 297
 None
 0.92A 2fk8A-4d7eA:
2.2		 2fk8A-4d7eA:
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.
4dbh 2-HYDROXYHEPTA-2,4-D
IENE-1,7-DIOATE
ISOMERASE

(Corynebacterium
glutamicum) 		PF01557
(FAA_hydrolase)
PF10370
(DUF2437) 		5 THR A 143
GLY A 117
GLY A 241
GLU A  76
ILE A 145
 None
 1.00A 2fk8A-4dbhA:
undetectable		 2fk8A-4dbhA:
28.28
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.
4dyk AMIDOHYDROLASE

(Pseudomonas
aeruginosa) 		PF01979
(Amidohydro_1) 		5 GLY A 353
LEU A 359
GLY A 358
ILE A 306
ALA A  71
 None
 0.91A 2fk8A-4dykA:
undetectable		 2fk8A-4dykA:
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.
4e0b MALATE DEHYDROGENASE

(Vibrio
vulnificus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ILE A   6
GLY A   7
GLY A  13
ILE A 117
ALA A  77
 None
 1.00A 2fk8A-4e0bA:
6.1		 2fk8A-4e0bA:
24.34
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.
4i59 CYCLOHEXYLAMINE
OXIDASE

(Microbacterium
oxydans) 		PF01593
(Amino_oxidase) 		5 ILE A 369
GLY A 370
GLY A 201
GLY A 349
TRP A 377
 None
 1.00A 2fk8A-4i59A:
undetectable		 2fk8A-4i59A:
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.
4ine PROTEIN PMT-2

(Caenorhabditis
elegans) 		PF08241
(Methyltransf_11) 		5 ILE A 231
GLY A 232
GLY A 234
LEU A 255
HIS A 303
 None
SAH  A 501 (-3.6A)
SAH  A 501 (-3.6A)
SAH  A 501 (-4.3A)
SAH  A 501 (-4.0A)
 0.70A 2fk8A-4ineA:
26.3		 2fk8A-4ineA:
26.27
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.
4iv8 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
knowlesi) 		PF08241
(Methyltransf_11) 		5 ILE A  60
GLY A  61
GLY A  63
ALA A 127
HIS A 130
 None
SAM  A 301 (-3.5A)
SAM  A 301 ( 3.9A)
SAM  A 301 (-3.4A)
SAM  A 301 (-3.9A)
 0.37A 2fk8A-4iv8A:
25.6		 2fk8A-4iv8A:
26.44
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.
4jhz BETA-GLUCURONIDASE

(Escherichia
coli) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N) 		5 THR A 352
TYR A 331
GLY A 109
GLY A  95
ILE A 143
 None
 0.83A 2fk8A-4jhzA:
undetectable		 2fk8A-4jhzA:
19.21
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.
4k25 PROBABLE TRNA
THREONYLCARBAMOYLADE
NOSINE BIOSYNTHESIS
PROTEIN QRI7,
MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF00814
(Peptidase_M22) 		5 ILE A 366
GLY A 367
GLY A 142
ILE A 364
ALA A  37
 None
 0.97A 2fk8A-4k25A:
undetectable		 2fk8A-4k25A:
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.
4kri PHOSPHOLETHANOLAMINE
N-METHYLTRANSFERASE
2

(Haemonchus
contortus) 		PF08241
(Methyltransf_11) 		5 ILE A 227
GLY A 228
GLY A 230
LEU A 251
HIS A 299
 None
SAH  A 701 (-3.5A)
SAH  A 701 (-3.5A)
SAH  A 701 (-4.4A)
SAH  A 701 (-4.2A)
 0.63A 2fk8A-4kriA:
26.4		 2fk8A-4kriA:
21.63
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.
4m1q L-LACTATE
DEHYDROGENASE

([Bacillus]
selenitireducens) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ILE A  11
GLY A  12
GLY A  14
LEU A  38
ALA A  80
 None
None
None
None
MPD  A 404 ( 4.2A)
 0.94A 2fk8A-4m1qA:
5.6		 2fk8A-4m1qA:
25.20
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.
4p48 ANTIBODY SCFV 180

(Gallus gallus) 		PF07686
(V-set) 		5 TYR A  88
GLY A  34
GLY A  90
GLY A  65
ILE A 239
 None
 1.01A 2fk8A-4p48A:
undetectable		 2fk8A-4p48A:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q48 DNA HELICASE RECQ

(Deinococcus
radiodurans) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF09382
(RQC)
PF16124
(RecQ_Zn_bind) 		5 THR A 324
ILE A 289
GLY A 239
GLY A 287
HIS A 234
 None
 0.99A 2fk8A-4q48A:
3.0		 2fk8A-4q48A:
21.39
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.
4qtu PUTATIVE
METHYLTRANSFERASE
BUD23

(Saccharomyces
cerevisiae) 		PF08241
(Methyltransf_11) 		5 ILE B  54
GLY B  55
GLY B  57
ILE B 117
ALA B 119
 None
SAM  B 301 (-3.7A)
SAM  B 301 (-3.3A)
SAM  B 301 (-4.2A)
SAM  B 301 (-3.5A)
 0.54A 2fk8A-4qtuB:
14.9		 2fk8A-4qtuB:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r6w PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE

(Plasmodium
falciparum) 		PF13649
(Methyltransf_25) 		5 ILE A  62
GLY A  63
GLY A  65
ALA A 129
HIS A 132
 None
SAH  A 302 (-3.7A)
SAH  A 302 (-3.6A)
SAH  A 302 (-3.3A)
SAH  A 302 (-4.3A)
 0.32A 2fk8A-4r6wA:
27.1		 2fk8A-4r6wA:
20.28
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.
4rjk ACETOLACTATE
SYNTHASE

(Bacillus
subtilis) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 ILE A  36
GLY A  35
GLY A  88
ILE A  56
ALA A  64
 None
 0.99A 2fk8A-4rjkA:
undetectable		 2fk8A-4rjkA:
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.
4tkt AT-LESS POLYKETIDE
SYNTHASE

(Streptomyces
platensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 THR A3315
ILE A3265
GLY A3266
LEU A3334
GLY A3340
 None
 0.97A 2fk8A-4tktA:
undetectable		 2fk8A-4tktA:
20.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ucl RNA-DIRECTED RNA
POLYMERASE L

(Human
metapneumovirus) 		no annotation 5 ILE A1695
GLY A1696
GLY A1698
LEU A1720
ALA A1780
 None
 0.67A 2fk8A-4uclA:
7.2		 2fk8A-4uclA:
25.11
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.
4xcg THERMOSOME SUBUNIT
BETA

(Sulfolobus
solfataricus) 		PF00118
(Cpn60_TCP1) 		5 ILE B 457
GLY B  53
GLY B 488
ILE B 459
ALA B 461
 None
ADP  B 600 (-3.6A)
None
None
None
 0.89A 2fk8A-4xcgB:
undetectable		 2fk8A-4xcgB:
19.66
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.
4yjf D-AMINO-ACID OXIDASE

(Sus scrofa) 		PF01266
(DAO) 		5 THR B  44
ILE B   6
GLY B   7
GLY B   9
ALA B  36
 FAD  B 401 (-3.4A)
None
FAD  B 401 (-3.3A)
FAD  B 401 (-3.3A)
FAD  B 401 (-3.5A)
 0.92A 2fk8A-4yjfB:
undetectable		 2fk8A-4yjfB:
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.
5awf FES CLUSTER ASSEMBLY
PROTEIN SUFB
PROBABLE
ATP-DEPENDENT
TRANSPORTER SUFC

(Escherichia
coli;
Escherichia
coli) 		PF01458
(UPF0051)
PF00005
(ABC_tran) 		5 ILE A 453
GLY A 452
GLY C  77
LEU C 162
ALA C 105
 None
 0.91A 2fk8A-5awfA:
undetectable		 2fk8A-5awfA:
19.88
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.
5b1h CYSTATHIONINE
BETA-SYNTHASE

(Lactobacillus
plantarum) 		PF00291
(PALP) 		5 ILE A  75
GLY A  76
GLY A  46
GLY A  71
ALA A  78
 None
LLP  A  42 ( 3.5A)
LLP  A  42 ( 3.8A)
SO4  A 404 (-3.3A)
None
 0.98A 2fk8A-5b1hA:
3.3		 2fk8A-5b1hA:
21.88
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.
5b69 GERANYLGERANYLGLYCER
YL PHOSPHATE
SYNTHASE

(Thermoplasma
acidophilum) 		PF01884
(PcrB) 		5 ILE A 204
GLY A 203
GLY A 177
GLU A 184
ILE A 226
 None
1GP  A 501 (-3.7A)
1GP  A 501 (-3.7A)
None
None
 0.99A 2fk8A-5b69A:
undetectable		 2fk8A-5b69A:
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.
5c92 KELCH
DOMAIN-CONTAINING
PROTEIN

(Colletotrichum
graminicola) 		PF01344
(Kelch_1)
PF09118
(DUF1929) 		5 THR A 238
TYR A 239
GLY A 242
GLY A 224
GLY A 247
 None
 0.85A 2fk8A-5c92A:
undetectable		 2fk8A-5c92A:
18.62
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.
5fsb TECTONIN 2

(Laccaria
bicolor) 		no annotation 5 ILE A 221
GLY A 220
GLY A 218
LEU A 201
GLY A 214
 None
SO4  A 312 (-3.5A)
SO4  A 312 (-3.2A)
None
None
 0.92A 2fk8A-5fsbA:
undetectable		 2fk8A-5fsbA:
20.72
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.
5gm2 O-METHYLRANSFERASE

(Streptomyces
blastmyceticus) 		PF08241
(Methyltransf_11) 		5 ILE A  84
GLY A  85
GLY A  87
ILE A 152
HIS A 157
 None
SAH  A 301 (-3.2A)
SAH  A 301 (-3.1A)
SAH  A 301 (-4.1A)
SAH  A 301 ( 4.3A)
 0.50A 2fk8A-5gm2A:
24.8		 2fk8A-5gm2A:
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.
5itz DESIGNED ANKYRIN
REPEAT PROTEIN
(DARPIN) D1

(synthetic
construct) 		PF00023
(Ank)
PF12796
(Ank_2) 		5 TYR F  57
ILE F 128
GLY F  91
GLY F 124
ILE F  95
 None
 0.94A 2fk8A-5itzF:
undetectable		 2fk8A-5itzF:
16.93
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.
5l22 ABC TRANSPORTER
(HLYB SUBFAMILY)

(Aquifex
aeolicus) 		no annotation 5 ILE B 274
GLY B 260
GLY B 277
ILE B 265
HIS B 154
 None
 0.92A 2fk8A-5l22B:
undetectable		 2fk8A-5l22B:
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.
5m10 CYCLOHEXANONE
MONOOXYGENASE FROM
THERMOCRISPUM
MUNICIPALE

(Thermocrispum
municipale) 		PF07992
(Pyr_redox_2) 		5 THR A  47
TYR A  49
ILE A  14
GLY A  15
GLY A  17
 FAD  A 601 (-3.2A)
None
FAD  A 601 (-4.6A)
FAD  A 601 (-3.4A)
FAD  A 601 (-3.3A)
 0.93A 2fk8A-5m10A:
undetectable		 2fk8A-5m10A:
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.
5mio KINESIN-LIKE PROTEIN
KIF2C,KIF2C FUSED TO
A DARPIN,KIF2C FUSED
TO A DARPIN

(Homo sapiens) 		PF00023
(Ank)
PF00225
(Kinesin)
PF12796
(Ank_2) 		5 TYR C 666
ILE C 737
GLY C 700
GLY C 733
ILE C 704
 None
 0.93A 2fk8A-5mioC:
undetectable		 2fk8A-5mioC:
19.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5odr HETERODISULFIDE
REDUCTASE, SUBUNIT A

(Methanothermococcus
thermolithotrophicus) 		PF07992
(Pyr_redox_2)
PF13187
(Fer4_9) 		5 GLY A 155
GLY A 554
GLY A 179
ILE A 325
ALA A 327
 None
 1.00A 2fk8A-5odrA:
undetectable		 2fk8A-5odrA:
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.
5x1y MERCURIC REDUCTASE

(Lysinibacillus
sphaericus) 		no annotation 5 THR B 121
ILE B  90
GLY B  91
GLY B  93
GLY B 111
 FAD  B 601 (-3.5A)
FAD  B 601 (-4.9A)
FAD  B 601 (-3.3A)
FAD  B 601 (-3.2A)
None
 0.87A 2fk8A-5x1yB:
2.5		 2fk8A-5x1yB:
21.76
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.
5y6q ALDEHYDE OXIDASE
LARGE SUBUNIT

(Methylobacillus
sp. KY4400) 		no annotation 5 GLY C  43
GLY C 259
GLU C 211
ILE C  48
ALA C  51
 None
 1.00A 2fk8A-5y6qC:
undetectable		 2fk8A-5y6qC:
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.
5yat MITOCHONDRIAL
ALCOHOL
DEHYDROGENASE
ISOZYME III

(Komagataella
phaffii) 		no annotation 5 ILE A 203
GLY A 180
GLY A 186
GLY A 205
ILE A 246
 None
 0.99A 2fk8A-5yatA:
7.5		 2fk8A-5yatA:
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.
6bbn DARPIN

(Escherichia
coli) 		no annotation 5 TYR P  57
ILE P 128
GLY P  91
GLY P 124
ILE P  95
 None
 0.94A 2fk8A-6bbnP:
undetectable		 2fk8A-6bbnP:
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.
6bqc CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE

(Escherichia
coli) 		no annotation 5 TYR A 137
ILE A 174
GLY A 175
GLY A 177
HIS A 240
 LOP  A 402 (-2.8A)
None
None
None
LOP  A 402 (-3.2A)
 0.77A 2fk8A-6bqcA:
32.2		 2fk8A-6bqcA:
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.
6bwc POLYSACCHARIDE
BIOSYNTHESIS PROTEIN
CAPD

(Bacillus
thuringiensis) 		no annotation 5 ILE A  11
GLY A  12
GLY A  15
GLY A  62
ALA A  84
 None
NAP  A 401 (-3.4A)
NAP  A 401 (-3.5A)
None
NAP  A 401 (-3.5A)
 0.92A 2fk8A-6bwcA:
6.3		 2fk8A-6bwcA:
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.
6eu0 TRANSCRIPTION FACTOR
IIIB 70 KDA SUBUNIT

(Saccharomyces
cerevisiae) 		no annotation 5 ILE Z 228
GLY Z 225
GLY Z 222
LEU Z 259
HIS Z 241
 None
 0.98A 2fk8A-6eu0Z:
undetectable		 2fk8A-6eu0Z:
undetectable