SIMILAR PATTERNS OF AMINO ACIDS FOR 5YF0_A_SAMA505_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.
1b0z PROTEIN
(PHOSPHOGLUCOSE
ISOMERASE)

(Geobacillus
stearothermophilus) 		PF00342
(PGI) 		5 GLY A  40
GLY A  38
TRP A  46
MET A  32
PHE A  43
 None
 1.33A 5yf0A-1b0zA:
0.9		 5yf0A-1b0zA:
20.13
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.
1by4 PROTEIN (RETINOIC
ACID RECEPTOR
RXR-ALPHA)

(Homo sapiens) 		PF00105
(zf-C4) 		5 GLY A1154
ASN A1185
THR A1162
TYR A1169
TYR A1147
 None
 1.35A 5yf0A-1by4A:
undetectable		 5yf0A-1by4A:
11.91
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.
1f0p ANTIGEN 85-B

(Mycobacterium
tuberculosis) 		PF00756
(Esterase) 		5 GLY A 214
GLY A 260
ASN A 231
SER A 150
PHE A 228
 None
None
TRE  A1152 ( 4.5A)
None
None
 1.47A 5yf0A-1f0pA:
2.0		 5yf0A-1f0pA:
20.71
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.
1hsk UDP-N-ACETYLENOLPYRU
VOYLGLUCOSAMINE
REDUCTASE

(Staphylococcus
aureus) 		PF01565
(FAD_binding_4)
PF02873
(MurB_C) 		5 GLY A  79
GLY A 146
ASN A  80
SER A 115
TYR A  52
 FAD  A 401 (-3.2A)
FAD  A 401 (-3.7A)
FAD  A 401 (-4.5A)
FAD  A 401 ( 3.8A)
None
 1.45A 5yf0A-1hskA:
undetectable		 5yf0A-1hskA:
21.70
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.
1jqo PHOSPHOENOLPYRUVATE
CARBOXYLASE

(Zea mays) 		PF00311
(PEPcase) 		5 GLY A 970
GLY A 643
SER A 602
PHE A 779
TYR A 751
 None
 1.15A 5yf0A-1jqoA:
0.0		 5yf0A-1jqoA:
15.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1p49 STERYL-SULFATASE

(Homo sapiens) 		PF00884
(Sulfatase)
PF14707
(Sulfatase_C) 		5 GLY A 110
GLY A 138
ASN A 552
SER A 140
THR A 113
 None
 1.26A 5yf0A-1p49A:
0.6		 5yf0A-1p49A:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qfc PROTEIN (PURPLE ACID
PHOSPHATASE)

(Rattus
norvegicus) 		PF00149
(Metallophos) 		5 GLY A 242
GLY A 272
SER A 239
PHE A 244
TYR A  55
 None
None
None
None
FE  A 402 ( 4.1A)
 1.33A 5yf0A-1qfcA:
undetectable		 5yf0A-1qfcA:
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.
1qon ACETYLCHOLINESTERASE

(Drosophila
melanogaster) 		PF00135
(COesterase) 		5 GLY A 207
GLY A 186
ASN A 205
SER A 332
PHE A 340
 None
 1.32A 5yf0A-1qonA:
undetectable		 5yf0A-1qonA:
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.
1v71 HYPOTHETICAL PROTEIN
C320.14 IN
CHROMOSOME III

(Schizosaccharomyces
pombe) 		PF00291
(PALP) 		5 GLY A  54
GLY A 310
SER A 308
PHE A  58
THR A  27
 None
None
PLP  A 350 (-2.8A)
None
None
 1.12A 5yf0A-1v71A:
2.4		 5yf0A-1v71A:
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.
1xl8 PEROXISOMAL
CARNITINE
O-OCTANOYLTRANSFERAS
E

(Mus musculus) 		PF00755
(Carn_acyltransf) 		5 GLY A 562
SER A 579
CYH A 437
PHE A 539
THR A 543
 None
 1.09A 5yf0A-1xl8A:
0.8		 5yf0A-1xl8A:
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.
2bmo OXYGENASE-ALPHA NBDO

(Comamonas sp.
JS765) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		5 GLY A 296
GLY A 247
MET A 240
PHE A 200
THR A 306
 None
None
None
EDO  A1442 (-3.7A)
None
 1.29A 5yf0A-2bmoA:
undetectable		 5yf0A-2bmoA:
21.47
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.
2dvz PUTATIVE EXPORTED
PROTEIN

(Bordetella
pertussis) 		PF03401
(TctC) 		5 GLY A 153
GLY A 150
ASN A  90
PHE A 194
TYR A 146
 None
 1.46A 5yf0A-2dvzA:
undetectable		 5yf0A-2dvzA:
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.
2e7z ACETYLENE HYDRATASE
AHY

(Pelobacter
acetylenicus) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		5 GLY A 143
SER A 136
MET A 138
PHE A 384
TYR A 365
 None
 1.08A 5yf0A-2e7zA:
undetectable		 5yf0A-2e7zA:
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.
2gs9 HYPOTHETICAL PROTEIN
TT1324

(Thermus
thermophilus) 		PF08241
(Methyltransf_11) 		5 GLY A  45
GLY A  47
SER A  66
MET A  69
PHE A 103
 SAH  A 301 (-3.7A)
SAH  A 301 (-3.5A)
SAH  A 301 (-4.5A)
SAH  A 301 (-4.2A)
SAH  A 301 (-4.5A)
 1.19A 5yf0A-2gs9A:
13.0		 5yf0A-2gs9A:
19.51
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.
2gsn PHOSPHODIESTERASE-NU
CLEOTIDE
PYROPHOSPHATASE

(Xanthomonas
citri) 		PF01663
(Phosphodiest) 		5 GLY A  55
GLY A 259
SER A  88
MET A 372
TYR A 205
 ZN  A1000 ( 4.9A)
None
None
None
None
 1.46A 5yf0A-2gsnA:
undetectable		 5yf0A-2gsnA:
18.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iu4 DIHYDROXYACETONE
KINASE

(Lactococcus
lactis) 		PF02733
(Dak1) 		5 GLY A 259
GLY A 302
ASN A 293
SER A 297
MET A 300
 None
None
None
HIQ  A 215 ( 3.8A)
None
 1.35A 5yf0A-2iu4A:
undetectable		 5yf0A-2iu4A:
22.36
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.
2ixm SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
REGULATORY SUBUNIT
B'

(Homo sapiens) 		PF03095
(PTPA) 		5 GLY A 152
GLY A 154
SER A 142
PHE A 217
TYR A 295
 None
 0.88A 5yf0A-2ixmA:
undetectable		 5yf0A-2ixmA:
23.47
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.
2ixn SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
ACTIVATOR 2

(Saccharomyces
cerevisiae) 		PF03095
(PTPA) 		5 GLY A 132
GLY A 134
SER A 122
PHE A 198
TYR A 277
 None
 0.93A 5yf0A-2ixnA:
undetectable		 5yf0A-2ixnA:
22.25
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.
2jjx URIDYLATE KINASE

(Bacillus
anthracis) 		PF00696
(AA_kinase) 		5 GLY A  52
GLY A  78
ASN A  54
SER A  83
THR A 141
 None
 1.15A 5yf0A-2jjxA:
3.5		 5yf0A-2jjxA:
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.
2nll PROTEIN (THYROID
HORMONE RECEPTOR)

(Homo sapiens) 		PF00105
(zf-C4) 		5 GLY B 322
ASN B 355
THR B 330
TYR B 339
TYR B 315
 None
 1.42A 5yf0A-2nllB:
undetectable		 5yf0A-2nllB:
15.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nv9 A207R PROTEIN,
ARGININE
DECARBOXYLASE

(Paramecium
bursaria
Chlorella virus
1) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		5 GLY A 146
GLY A 150
ASN A 147
CYH A 136
PHE A 175
 None
 1.29A 5yf0A-2nv9A:
undetectable		 5yf0A-2nv9A:
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.
2o9a ACETATE OPERON
REPRESSOR

(Escherichia
coli) 		PF01614
(IclR) 		5 GLY A  66
GLY A  68
MET A  62
PHE A 117
THR A 110
 PYR  A 905 (-3.2A)
None
None
None
EDO  A 901 (-4.6A)
 1.37A 5yf0A-2o9aA:
undetectable		 5yf0A-2o9aA:
19.08
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.
2qae DIHYDROLIPOYL
DEHYDROGENASE

(Trypanosoma
cruzi) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLY A 115
GLY A 113
PHE A 117
CYH A  30
THR A 144
 FAD  A 480 (-3.8A)
None
None
None
FAD  A 480 (-3.9A)
 1.47A 5yf0A-2qaeA:
3.1		 5yf0A-2qaeA:
20.74
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.
2r9v ATP SYNTHASE SUBUNIT
ALPHA

(Thermotoga
maritima) 		PF00006
(ATP-synt_ab)
PF00306
(ATP-synt_ab_C)
PF02874
(ATP-synt_ab_N) 		5 GLY A 289
ASN A  66
PHE A  65
TYR A 237
TYR A 330
 None
 1.46A 5yf0A-2r9vA:
3.2		 5yf0A-2r9vA:
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.
2rds 1-DEOXYPENTALENIC
ACID 11-BETA
HYDROXYLASE
FE(II)/ALPHA-KETOGL
UTARATE DEPENDENT
HYDROXYLASE

(Streptomyces
avermitilis) 		PF05721
(PhyH) 		5 GLY A 164
GLY A 165
ASN A 231
SER A 242
TYR A   8
 None
None
None
OGA  A 268 ( 4.5A)
None
 1.24A 5yf0A-2rdsA:
undetectable		 5yf0A-2rdsA:
19.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2uxt PROTEIN SUFI

(Escherichia
coli) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 GLY A 205
GLY A 203
PHE A 207
THR A 452
TYR A 199
 None
 1.26A 5yf0A-2uxtA:
undetectable		 5yf0A-2uxtA:
20.88
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.
2vz9 FATTY ACID SYNTHASE

(Sus scrofa) 		PF00107
(ADH_zinc_N)
PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF08242
(Methyltransf_12)
PF08659
(KR)
PF14765
(PS-DH)
PF16197
(KAsynt_C_assoc) 		5 GLY A1897
GLY A1894
TRP A2060
PHE A1969
TYR A1924
 None
NAP  A3002 (-3.3A)
None
None
None
 1.39A 5yf0A-2vz9A:
undetectable		 5yf0A-2vz9A:
8.68
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.
2wab ENDOGLUCANASE E

(Ruminiclostridium
thermocellum) 		PF00657
(Lipase_GDSL) 		5 GLY A 129
PHE A 226
CYH A 259
PHE A 296
TYR A 158
 None
 1.29A 5yf0A-2wabA:
3.5		 5yf0A-2wabA:
21.73
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.
2wab ENDOGLUCANASE E

(Ruminiclostridium
thermocellum) 		PF00657
(Lipase_GDSL) 		5 GLY A 129
SER A 176
CYH A 259
PHE A 296
TYR A 158
 None
BGC  A1339 (-4.5A)
None
None
None
 1.18A 5yf0A-2wabA:
3.5		 5yf0A-2wabA:
21.73
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.
2ycb CLEAVAGE AND
POLYADENYLATION
SPECIFICITY FACTOR

(Methanothermobacter
thermautotrophicus) 		PF07521
(RMMBL)
PF10996
(Beta-Casp)
PF16661
(Lactamase_B_6)
PF17214
(KH_7) 		5 GLY A 192
GLY A 186
ASN A 212
TYR A 535
TYR A 349
 None
 1.39A 5yf0A-2ycbA:
undetectable		 5yf0A-2ycbA:
20.22
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.
2z2z TK-SUBTILISIN
PRECURSOR

(Thermococcus
kodakarensis) 		PF00082
(Peptidase_S8) 		5 GLY A  70
SER A 234
MET A 325
THR A 116
TYR A 312
 None
 1.38A 5yf0A-2z2zA:
undetectable		 5yf0A-2z2zA:
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.
3c5y RIBOSE/GALACTOSE
ISOMERASE

(Novosphingobium
aromaticivorans) 		PF02502
(LacAB_rpiB)
PF12408
(DUF3666) 		5 GLY A  57
ASN A 109
MET A  85
PHE A  67
THR A  70
 None
 1.47A 5yf0A-3c5yA:
undetectable		 5yf0A-3c5yA:
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.
3ca8 PROTEIN YDCF

(Escherichia
coli) 		PF02698
(DUF218) 		5 GLY A 181
ASN A 197
PHE A 195
THR A 154
TYR A 208
 MPD  A 901 (-3.5A)
None
None
None
None
 1.37A 5yf0A-3ca8A:
undetectable		 5yf0A-3ca8A:
17.87
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.
3ct4 PTS-DEPENDENT
DIHYDROXYACETONE
KINASE,
DIHYDROXYACETONE-BIN
DING SUBUNIT DHAK

(Lactococcus
lactis) 		PF02733
(Dak1) 		5 GLY A 262
GLY A 305
ASN A 296
SER A 300
MET A 303
 None
 1.31A 5yf0A-3ct4A:
undetectable		 5yf0A-3ct4A:
19.11
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.
3d2l SAM-DEPENDENT
METHYLTRANSFERASE

(Exiguobacterium
sibiricum) 		PF13649
(Methyltransf_25) 		5 GLY A  40
GLY A  42
SER A  62
MET A  65
CYH A 103
 None
 1.00A 5yf0A-3d2lA:
11.8		 5yf0A-3d2lA:
20.66
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.
3dzu RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		5 GLY A 154
ASN A 185
THR A 162
TYR A 169
TYR A 147
 None
 1.41A 5yf0A-3dzuA:
undetectable		 5yf0A-3dzuA:
20.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e4d ESTERASE D

(Agrobacterium
fabrum) 		PF00756
(Esterase) 		5 GLY A 149
GLY A 145
PHE A 103
THR A  81
TYR A 258
 None
 1.48A 5yf0A-3e4dA:
undetectable		 5yf0A-3e4dA:
20.74
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.
3hnr PROBABLE
METHYLTRANSFERASE
BT9727_4108

(Bacillus
thuringiensis) 		PF08241
(Methyltransf_11) 		5 GLY A  53
GLY A  55
SER A  76
MET A  79
PHE A  52
 None
 0.91A 5yf0A-3hnrA:
14.1		 5yf0A-3hnrA:
18.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ncy ADIC

(Salmonella
enterica) 		PF13520
(AA_permease_2) 		5 GLY A 206
ASN A  22
THR A 361
TYR A  93
TYR A 397
 None
 1.19A 5yf0A-3ncyA:
undetectable		 5yf0A-3ncyA:
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.
3nmz APC VARIANT PROTEIN

(Homo sapiens) 		PF00514
(Arm) 		5 GLY A 637
GLY A 635
ASN A 641
SER A 590
THR A 675
 None
 1.23A 5yf0A-3nmzA:
undetectable		 5yf0A-3nmzA:
20.63
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.
3nyi FAT ACID-BINDING
PROTEIN

(Eubacterium
ventriosum) 		PF02645
(DegV) 		5 GLY A 270
ASN A 124
SER A   8
PHE A  93
THR A  62
 None
STE  A 301 (-4.2A)
None
STE  A 301 (-4.1A)
STE  A 301 (-3.6A)
 1.40A 5yf0A-3nyiA:
undetectable		 5yf0A-3nyiA:
23.27
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.
3pvl MYOSIN VIIA ISOFORM
1

(Mus musculus) 		PF00784
(MyTH4) 		5 GLY A1161
GLY A1159
MET A1071
CYH A1198
THR A1239
 None
 1.26A 5yf0A-3pvlA:
undetectable		 5yf0A-3pvlA:
17.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sh5 LG3 PEPTIDE

(Homo sapiens) 		PF00054
(Laminin_G_1) 		5 GLY A 155
GLY A  14
PHE A 152
THR A  42
TYR A   9
 None
 1.28A 5yf0A-3sh5A:
undetectable		 5yf0A-3sh5A:
17.12
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.
3u4f MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN

(Roseovarius
nubinhibens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 SER A 117
MET A 119
THR A 293
TYR A 332
TYR A  34
 GAI  A 372 ( 4.3A)
GAI  A 372 ( 3.7A)
None
None
None
 1.48A 5yf0A-3u4fA:
undetectable		 5yf0A-3u4fA:
21.71
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.
3u4j NAD-DEPENDENT
ALDEHYDE
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF00171
(Aldedh) 		5 GLY A 305
GLY A 273
CYH A 301
PHE A 402
TYR A 295
 None
 1.49A 5yf0A-3u4jA:
4.4		 5yf0A-3u4jA:
19.41
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.
3voo FATTY ACID
ALPHA-HYDROXYLASE

(Sphingomonas
paucimobilis) 		PF00067
(p450) 		5 GLY A  50
GLY A 318
ASN A  34
PHE A 347
THR A 325
 None
 1.37A 5yf0A-3vooA:
undetectable		 5yf0A-3vooA:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b6g PUTATIVE ESTERASE

(Neisseria
meningitidis) 		PF00756
(Esterase) 		5 GLY A 147
GLY A 143
PHE A 102
THR A  81
TYR A 256
 None
 1.48A 5yf0A-4b6gA:
undetectable		 5yf0A-4b6gA:
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.
4bgn VOLTAGE-GATED SODIUM
CHANNEL

(Caldalkalibacillus
thermarum) 		PF00520
(Ion_trans) 		5 GLY A 165
SER A 179
PHE A 169
PHE A 158
THR A 186
 None
 1.48A 5yf0A-4bgnA:
3.0		 5yf0A-4bgnA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bz7 HISTONE DEACETYLASE
8

(Schistosoma
mansoni) 		PF00850
(Hist_deacetyl) 		5 GLY A 318
ASN A 299
SER A 315
CYH A 286
PHE A 295
 None
 0.98A 5yf0A-4bz7A:
4.8		 5yf0A-4bz7A:
20.58
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.
4gt6 CELL SURFACE PROTEIN

(Faecalibacterium
prausnitzii) 		PF13306
(LRR_5) 		5 GLY A 358
ASN A 381
SER A 377
CYH A 336
PHE A 333
 None
 1.46A 5yf0A-4gt6A:
undetectable		 5yf0A-4gt6A:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ha4 BETA-GALACTOSIDASE

(Acidilobus
saccharovorans) 		PF00232
(Glyco_hydro_1) 		5 GLY A 358
GLY A 346
PHE A 357
PHE A 361
THR A 321
 None
None
GOL  A 503 (-4.3A)
None
None
 1.38A 5yf0A-4ha4A:
undetectable		 5yf0A-4ha4A:
20.66
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.
4jz6 SALICYLALDEHYDE
DEHYDROGENASE NAHF

(Pseudomonas
putida) 		PF00171
(Aldedh) 		5 GLY A 325
GLY A 314
SER A 312
PHE A 279
CYH A 317
 None
 1.43A 5yf0A-4jz6A:
undetectable		 5yf0A-4jz6A:
20.43
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.
4lgl GLYCINE
DEHYDROGENASE
[DECARBOXYLATING]

(Synechocystis
sp. PCC 6803) 		PF02347
(GDC-P) 		5 GLY A 590
GLY A 593
ASN A 723
THR A 354
TYR A 131
 None
 1.49A 5yf0A-4lglA:
4.3		 5yf0A-4lglA:
15.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ope NRPS/PKS

(Streptomyces
albus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 GLY A4640
ASN A4645
SER A4497
PHE A4639
TYR A4346
 None
 1.33A 5yf0A-4opeA:
undetectable		 5yf0A-4opeA:
18.58
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.
4qdk MAGNESIUM-PROTOPORPH
YRIN
O-METHYLTRANSFERASE

(Synechocystis
sp. PCC 6803) 		PF07109
(Mg-por_mtran_C) 		5 GLY A  70
GLY A  72
SER A  93
MET A  96
TYR A 140
 SAH  A 301 (-3.4A)
SAH  A 301 (-3.6A)
SAH  A 301 (-4.6A)
SAH  A 301 (-4.2A)
SAH  A 301 (-4.6A)
 1.27A 5yf0A-4qdkA:
17.4		 5yf0A-4qdkA:
18.33
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.
4ui9 ANAPHASE-PROMOTING
COMPLEX SUBUNIT 11
ANAPHASE-PROMOTING
COMPLEX SUBUNIT 2

(Homo sapiens;
Homo sapiens) 		PF12861
(zf-ANAPC11)
PF00888
(Cullin) 		5 GLY B  32
GLY B  41
ASN B  31
SER N 597
CYH B  34
 None
None
None
None
ZN  B 103 (-3.1A)
 1.31A 5yf0A-4ui9B:
undetectable		 5yf0A-4ui9B:
13.51
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.
4wh3 N-ACETYLHEXOSAMINE
1-KINASE

(Bifidobacterium
longum) 		PF01636
(APH) 		5 GLY A 242
ASN A 207
SER A 236
PHE A 149
THR A 152
 None
GOL  A 405 (-4.9A)
None
None
None
 1.32A 5yf0A-4wh3A:
undetectable		 5yf0A-4wh3A:
23.27
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.
4xsv ETHANOLAMINE-PHOSPHA
TE
CYTIDYLYLTRANSFERASE

(Homo sapiens) 		PF01467
(CTP_transf_like) 		5 GLY A  55
GLY A  29
THR A 101
TYR A 105
TYR A 126
 None
CTP  A 402 (-3.4A)
None
None
None
 1.02A 5yf0A-4xsvA:
undetectable		 5yf0A-4xsvA:
20.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yk6 ADENOMATOUS
POLYPOSIS COLI
PROTEIN

(Homo sapiens) 		PF00514
(Arm)
PF16629
(Arm_APC_u3) 		5 GLY A 637
GLY A 635
ASN A 641
SER A 590
THR A 675
 None
 1.06A 5yf0A-4yk6A:
undetectable		 5yf0A-4yk6A:
19.28
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.
4zfm PUTATIVE
6-PHOSPHO-BETA-GALAC
TOBIOSIDASE

(Geobacillus
stearothermophilus) 		PF00232
(Glyco_hydro_1) 		5 GLY A  32
PHE A  89
PHE A 103
TYR A 150
TYR A  61
 None
 1.43A 5yf0A-4zfmA:
undetectable		 5yf0A-4zfmA:
19.52
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.
5lcw CELL DIVISION CYCLE
PROTEIN 20 HOMOLOG

(Homo sapiens) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		5 GLY Q 327
GLY Q 328
ASN Q 334
THR Q 373
TYR Q 185
 None
 1.46A 5yf0A-5lcwQ:
undetectable		 5yf0A-5lcwQ:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lcw CELL DIVISION CYCLE
PROTEIN 20 HOMOLOG

(Homo sapiens) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		5 GLY R 327
GLY R 328
ASN R 334
THR R 373
TYR R 185
 None
 1.45A 5yf0A-5lcwR:
undetectable		 5yf0A-5lcwR:
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.
5u38 LECTIN

(Platypodium
elegans) 		PF00139
(Lectin_legB) 		5 GLY A 110
GLY A  49
SER A 220
PHE A 112
PHE A 216
 None
 1.35A 5yf0A-5u38A:
undetectable		 5yf0A-5u38A:
21.70
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.
5wna MAJOR SURFACE
GLYCOPROTEIN G
MAB 3D3 FAB HEAVY
CHAIN

(Human
orthopneumovirus;
Homo sapiens) 		no annotation
no annotation 		5 GLY H  59
GLY H  50
ASN B 161
SER H  55
PHE H  68
 None
 1.35A 5yf0A-5wnaH:
undetectable		 5yf0A-5wnaH:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5x62 CARNOSINE
N-METHYLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF07942
(N2227) 		10 GLY A 146
GLY A 148
ASN A 166
SER A 169
MET A 172
PHE A 235
PHE A 275
THR A 279
TYR A 286
TYR A 371
 SAH  A 501 (-3.2A)
SAH  A 501 ( 3.7A)
SAH  A 501 (-3.6A)
SAH  A 501 (-4.4A)
SAH  A 501 (-3.9A)
None
None
SAH  A 501 (-3.6A)
None
SAH  A 501 (-4.8A)
 0.32A 5yf0A-5x62A:
38.7		 5yf0A-5x62A:
30.86
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.
5xev XAA-PRO
DIPEPTIDASE,PEPTIDAS
E-RELATED PROTEIN

(Deinococcus
radiodurans) 		no annotation 5 GLY A 331
GLY A 333
TRP A 148
PHE A 250
THR A 354
 None
None
None
None
ZN  A 501 ( 3.6A)
 1.46A 5yf0A-5xevA:
undetectable		 5yf0A-5xevA:
18.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5yf0 -

(-) 		no annotation 11 GLY A 208
GLY A 210
ASN A 228
SER A 231
MET A 234
PHE A 296
CYH A 312
PHE A 313
THR A 317
TYR A 324
TYR A 386
 SAM  A 505 (-3.3A)
SAM  A 505 ( 3.9A)
SAM  A 505 (-3.7A)
SAM  A 505 (-4.4A)
SAM  A 505 (-4.2A)
None
SAM  A 505 (-3.5A)
None
SAM  A 505 (-3.4A)
None
SAM  A 505 (-4.5A)
 0.00A 5yf0A-5yf0A:
55.3		 5yf0A-5yf0A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5yf0 -

(-) 		no annotation 9 GLY A 208
GLY A 210
ASN A 228
TRP A 230
MET A 234
CYH A 312
PHE A 313
THR A 317
TYR A 386
 SAM  A 505 (-3.3A)
SAM  A 505 ( 3.9A)
SAM  A 505 (-3.7A)
None
SAM  A 505 (-4.2A)
SAM  A 505 (-3.5A)
None
SAM  A 505 (-3.4A)
SAM  A 505 (-4.5A)
 0.79A 5yf0A-5yf0A:
55.3		 5yf0A-5yf0A:
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.
6aun PLA2G6, IPLA2BETA

(Cricetulus
griseus) 		no annotation 5 GLY A 431
GLY A 467
ASN A 604
SER A 583
TYR A 487
 None
 1.38A 5yf0A-6aunA:
undetectable		 5yf0A-6aunA:
undetectable