SIMILAR PATTERNS OF AMINO ACIDS FOR 4WNW_A_RTZA602_1

List of similar pattern of amino acids derived from ASSAM search

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

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1a8s CHLOROPEROXIDASE F

(Pseudomonas
fluorescens) 		PF00561
(Abhydrolase_1) 		5 PHE A 205
PHE A 200
GLY A 134
LEU A 135
VAL A 139
 None
PPI  A 278 (-3.6A)
None
None
None
 1.12A 4wnwA-1a8sA:
0.0		 4wnwA-1a8sA:
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.
1at0 17-HEDGEHOG

(Drosophila
melanogaster) 		PF01079
(Hint) 		5 PHE A 312
GLY A 276
LEU A 278
VAL A 298
THR A 386
 None
 1.20A 4wnwA-1at0A:
undetectable		 4wnwA-1at0A:
17.31
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.
1b1y PROTEIN
(BETA-AMYLASE)

(Hordeum vulgare) 		PF01373
(Glyco_hydro_14) 		5 GLY A 285
LEU A 455
ASP A 277
SER A 458
VAL A 177
 None
 1.17A 4wnwA-1b1yA:
0.0		 4wnwA-1b1yA:
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.
1btn BETA-SPECTRIN

(Mus musculus) 		PF15410
(PH_9) 		5 PHE A  88
LEU A  87
GLY A  83
LEU A  80
VAL A  56
 None
 1.18A 4wnwA-1btnA:
undetectable		 4wnwA-1btnA:
12.99
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.
1dnl PYRIDOXINE
5'-PHOSPHATE OXIDASE

(Escherichia
coli) 		PF01243
(Putative_PNPOx)
PF10590
(PNP_phzG_C) 		5 PHE A  35
LEU A  34
GLN A  41
THR A  51
VAL A 112
 None
 1.17A 4wnwA-1dnlA:
0.0		 4wnwA-1dnlA:
18.63
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.
1ka9 IMIDAZOLE GLYCEROL
PHOSPHATE SYNTHASE

(Thermus
thermophilus) 		PF00117
(GATase) 		5 LEU H   6
GLY H  11
VAL H  83
VAL H  68
PHE H  59
 None
 1.13A 4wnwA-1ka9H:
0.0		 4wnwA-1ka9H:
17.46
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.
1mqt POLYPROTEIN
POLYPROTEIN CAPSID
PROTEIN

(Enterovirus B) 		PF00073
(Rhv) 		6 PHE C 220
LEU C 100
GLY C 187
THR A 282
VAL C  53
PHE C  85
 None
 1.39A 4wnwA-1mqtC:
0.0		 4wnwA-1mqtC:
19.65
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.
1rpw TRANSCRIPTIONAL
REGULATOR QACR

(Staphylococcus
aureus) 		PF00440
(TetR_N)
PF08360
(TetR_C_5) 		5 GLY A  37
LEU A  39
SER A  34
VAL A  29
PHE A  43
 None
 1.12A 4wnwA-1rpwA:
0.0		 4wnwA-1rpwA:
16.06
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.
1tyd TYROSYL-TRNA
SYNTHETASE

(Geobacillus
stearothermophilus) 		PF00579
(tRNA-synt_1b) 		5 LEU E 172
GLY E 197
ASP E 176
VAL E 139
PHE E 143
 None
None
TYR  E 320 (-3.5A)
None
None
 1.21A 4wnwA-1tydE:
undetectable		 4wnwA-1tydE:
21.64
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.
1u31 NAD(P)
TRANSHYDROGENASE,
MITOCHONDRIAL

(Homo sapiens) 		PF02233
(PNTB) 		5 PHE A 118
PHE A  81
GLY A 128
LEU A  56
VAL A  69
 None
None
NDP  A 300 (-3.6A)
None
None
 1.22A 4wnwA-1u31A:
undetectable		 4wnwA-1u31A:
18.64
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.
1ur4 GALACTANASE

(Bacillus
licheniformis) 		PF07745
(Glyco_hydro_53) 		5 GLY A  19
LEU A  20
ASP A 302
VAL A 317
PHE A  24
 None
 1.17A 4wnwA-1ur4A:
undetectable		 4wnwA-1ur4A:
22.18
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.
1w2d INOSITOL-TRISPHOSPHA
TE 3-KINASE A

(Homo sapiens) 		PF03770
(IPK) 		5 PHE A 330
GLY A 334
LEU A 261
VAL A 358
PHE A 402
 None
 1.20A 4wnwA-1w2dA:
undetectable		 4wnwA-1w2dA:
19.14
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.
1yfm FUMARASE

(Saccharomyces
cerevisiae) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 PHE A 115
GLY A 125
GLN A 121
VAL A 172
VAL A 135
 None
 1.07A 4wnwA-1yfmA:
0.2		 4wnwA-1yfmA:
21.00
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.
1zoi ESTERASE

(Pseudomonas
putida) 		PF00561
(Abhydrolase_1) 		5 PHE A 208
PHE A 203
GLY A 137
LEU A 138
VAL A 142
 None
 1.09A 4wnwA-1zoiA:
undetectable		 4wnwA-1zoiA:
19.04
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.
2dzn 26S PROTEASE
REGULATORY SUBUNIT
6B HOMOLOG
PROBABLE 26S
PROTEASOME
REGULATORY SUBUNIT
P28

(Saccharomyces
cerevisiae) 		PF12796
(Ank_2)
no annotation 		5 LEU B 362
GLY A 116
LEU A 113
VAL A 108
THR A 104
 None
 1.19A 4wnwA-2dznB:
undetectable		 4wnwA-2dznB:
11.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2f9q CYTOCHROME P450 2D6

(Homo sapiens) 		PF00067
(p450) 		7 PHE A 112
PHE A 120
GLY A 212
ASP A 301
SER A 304
VAL A 308
THR A 309
 None
HEM  A 600 (-4.6A)
None
None
None
None
HEM  A 600 (-3.5A)
 0.98A 4wnwA-2f9qA:
50.6		 4wnwA-2f9qA:
99.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2f9q CYTOCHROME P450 2D6

(Homo sapiens) 		PF00067
(p450) 		8 PHE A 112
PHE A 120
GLY A 212
LEU A 213
GLN A 244
ASP A 301
VAL A 308
THR A 309
 None
HEM  A 600 (-4.6A)
None
None
None
None
None
HEM  A 600 (-3.5A)
 1.30A 4wnwA-2f9qA:
50.6		 4wnwA-2f9qA:
99.37
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.
2hdn ELONGATION FACTOR
EF-TU

(Escherichia
coli) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2) 		5 LEU B 121
LEU B 157
VAL B 132
VAL B 127
PHE B 162
 None
 1.17A 4wnwA-2hdnB:
undetectable		 4wnwA-2hdnB:
22.49
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.
2i0k OXIDOREDUCTASE

(Brevibacterium
sterolicum) 		PF01565
(FAD_binding_4)
PF09129
(Chol_subst-bind) 		5 PHE A 421
LEU A 185
GLY A 195
LEU A 197
VAL A 266
 None
None
FAD  A 700 (-3.3A)
None
None
 1.21A 4wnwA-2i0kA:
undetectable		 4wnwA-2i0kA:
23.95
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.
2ppv UNCHARACTERIZED
PROTEIN

(Staphylococcus
epidermidis) 		PF01933
(UPF0052) 		5 LEU A 212
GLY A  14
LEU A  15
VAL A  33
VAL A   6
 None
 1.17A 4wnwA-2ppvA:
undetectable		 4wnwA-2ppvA:
19.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qhs LIPOYLTRANSFERASE

(Thermus
thermophilus) 		PF03099
(BPL_LplA_LipB) 		5 LEU A   4
GLY A   9
LEU A  39
VAL A  88
VAL A  23
 None
 1.20A 4wnwA-2qhsA:
undetectable		 4wnwA-2qhsA:
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.
2qhu LIPOYLTRANSFERASE

(Thermus
thermophilus) 		PF03099
(BPL_LplA_LipB) 		5 LEU A   4
GLY A   9
LEU A  39
VAL A  88
VAL A  23
 None
 1.19A 4wnwA-2qhuA:
undetectable		 4wnwA-2qhuA:
19.37
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.
2rhq PHENYLALANYL-TRNA
SYNTHETASE ALPHA
CHAIN

(Staphylococcus
haemolyticus) 		PF01409
(tRNA-synt_2d) 		5 PHE A 310
LEU A 218
GLY A 127
LEU A 126
PHE A 123
 None
GAX  A 352 ( 4.3A)
None
None
None
 1.13A 4wnwA-2rhqA:
undetectable		 4wnwA-2rhqA:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ts1 TYROSYL-TRNA
SYNTHETASE

(Geobacillus
stearothermophilus) 		PF00579
(tRNA-synt_1b) 		5 LEU A 172
GLY A 197
ASP A 176
VAL A 139
PHE A 143
 None
 1.22A 4wnwA-2ts1A:
undetectable		 4wnwA-2ts1A:
23.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w92 ENDO-BETA-N-ACETYLGL
UCOSAMINIDASE D

(Streptococcus
pneumoniae) 		PF03644
(Glyco_hydro_85) 		5 PHE A 594
LEU A 576
LEU A 654
VAL A 623
VAL A 606
 None
 1.22A 4wnwA-2w92A:
undetectable		 4wnwA-2w92A:
21.80
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.
2xsg CCMAN5

(Cellulosimicrobium
cellulans) 		PF07971
(Glyco_hydro_92) 		5 PHE A 731
GLY A 676
LEU A 677
VAL A 741
THR A 740
 None
 1.06A 4wnwA-2xsgA:
undetectable		 4wnwA-2xsgA:
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.
2yfq NAD-SPECIFIC
GLUTAMATE
DEHYDROGENASE

(Peptoniphilus
asaccharolyticus) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 GLY A  96
LEU A  98
ASP A 344
VAL A 352
VAL A 198
 None
None
None
SO4  A1422 (-3.7A)
None
 0.94A 4wnwA-2yfqA:
undetectable		 4wnwA-2yfqA:
19.56
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.
2ynm LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE SUBUNIT N

(Prochlorococcus
marinus) 		PF00148
(Oxidored_nitro) 		5 PHE C 384
GLY C  18
LEU C  19
VAL C  36
THR C  62
 PMR  C1414 (-4.3A)
None
SF4  C1413 (-4.3A)
None
None
 1.19A 4wnwA-2ynmC:
undetectable		 4wnwA-2ynmC:
24.14
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.
2ywo PROBABLE
THIOL-DISULFIDE
ISOMERASE/THIOREDOXI
N

(Thermus
thermophilus) 		PF00578
(AhpC-TSA) 		5 GLY A  53
LEU A  55
VAL A 135
VAL A  66
PHE A  68
 None
 1.13A 4wnwA-2ywoA:
undetectable		 4wnwA-2ywoA:
18.04
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.
3eqn GLUCAN
1,3-BETA-GLUCOSIDASE

(Phanerochaete
chrysosporium) 		PF12708
(Pectate_lyase_3) 		5 LEU A 118
VAL A  96
THR A  60
VAL A  87
PHE A  89
 None
 1.22A 4wnwA-3eqnA:
undetectable		 4wnwA-3eqnA:
19.76
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.
3esh PROTEIN SIMILAR TO
METAL-DEPENDENT
HYDROLASE

(Staphylococcus
aureus) 		PF00753
(Lactamase_B) 		5 PHE A 126
GLY A  69
LEU A  71
VAL A  81
THR A  16
 None
 1.13A 4wnwA-3eshA:
undetectable		 4wnwA-3eshA:
18.78
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.
3g2p PCZA361.24

(Amycolatopsis
orientalis) 		PF13649
(Methyltransf_25) 		5 PHE A 126
LEU A  70
VAL A  63
THR A  60
PHE A  81
 None
 1.09A 4wnwA-3g2pA:
undetectable		 4wnwA-3g2pA:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g9g SUPPRESSOR OF YEAST
PROFILIN DELETION

(Saccharomyces
cerevisiae) 		no annotation 5 LEU A  34
LEU A 130
SER A 133
THR A 198
PHE A  39
 None
 1.16A 4wnwA-3g9gA:
0.6		 4wnwA-3g9gA:
20.29
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.
3gr3 NITROREDUCTASE

(Bartonella
henselae) 		PF00881
(Nitroreductase) 		5 PHE A 153
LEU A 166
VAL A  26
THR A  27
PHE A 164
 None
None
None
None
ACT  A 236 ( 4.4A)
 1.22A 4wnwA-3gr3A:
undetectable		 4wnwA-3gr3A:
21.89
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.
3h2x TYROSINE-PROTEIN
PHOSPHATASE
NON-RECEPTOR TYPE 22

(Homo sapiens) 		PF00102
(Y_phosphatase) 		5 PHE A 256
GLY A 250
GLN A   3
VAL A  93
VAL A 286
 None
 0.95A 4wnwA-3h2xA:
undetectable		 4wnwA-3h2xA:
19.76
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.
3ils AFLATOXIN
BIOSYNTHESIS
POLYKETIDE SYNTHASE

(Aspergillus
parasiticus) 		PF00975
(Thioesterase) 		5 GLY A1934
LEU A1933
SER A1959
VAL A1957
PHE A1869
 None
 1.14A 4wnwA-3ilsA:
undetectable		 4wnwA-3ilsA:
18.99
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.
3iom PURINE NUCLEOSIDE
PHOSPHORYLASE

(Mycobacterium
tuberculosis) 		PF01048
(PNP_UDP_1) 		5 PHE A 268
GLY A 258
LEU A 261
VAL A 226
VAL A  30
 None
 1.22A 4wnwA-3iomA:
undetectable		 4wnwA-3iomA:
22.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3j2j PROTEIN VP3

(Enterovirus B) 		PF00073
(Rhv) 		5 PHE B  83
GLY B 188
LEU B  87
VAL B 168
VAL B  55
 None
 0.98A 4wnwA-3j2jB:
undetectable		 4wnwA-3j2jB:
19.68
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.
3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE

(Thermotoga
maritima) 		PF00295
(Glyco_hydro_28)
PF12708
(Pectate_lyase_3) 		5 GLY A 298
LEU A 299
ASP A 242
VAL A 285
VAL A 309
 None
 1.18A 4wnwA-3jurA:
undetectable		 4wnwA-3jurA:
20.46
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.
3kio RIBONUCLEASE H2
SUBUNIT A
RIBONUCLEASE H2
SUBUNIT C

(Mus musculus) 		PF01351
(RNase_HII)
PF08615
(RNase_H2_suC) 		5 GLY C  65
ASP C 102
VAL A 253
VAL C  44
PHE A 229
 None
 0.98A 4wnwA-3kioC:
undetectable		 4wnwA-3kioC:
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.
3llc PUTATIVE HYDROLASE

(Agrobacterium
vitis) 		PF12697
(Abhydrolase_6) 		5 LEU A 238
GLY A 116
LEU A 120
VAL A 197
VAL A 236
 None
None
None
EDO  A 271 (-4.0A)
None
 1.22A 4wnwA-3llcA:
undetectable		 4wnwA-3llcA:
21.69
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.
3mc6 SPHINGOSINE-1-PHOSPH
ATE LYASE

(Saccharomyces
cerevisiae) 		PF00282
(Pyridoxal_deC) 		5 GLY C 370
LEU C 339
ASP C 324
VAL C 341
VAL C 299
 None
 1.08A 4wnwA-3mc6C:
undetectable		 4wnwA-3mc6C:
22.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nf2 PUTATIVE POLYPRENYL
SYNTHETASE

(Streptomyces
coelicolor) 		PF00348
(polyprenyl_synt) 		5 PHE A 366
LEU A  95
GLY A 233
LEU A 232
VAL A 117
 None
 1.21A 4wnwA-3nf2A:
undetectable		 4wnwA-3nf2A:
22.56
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.
3nut PRECORRIN-3
METHYLASE

(Rhodobacter
capsulatus) 		PF00590
(TP_methylase) 		5 GLY A  81
LEU A  10
ASP A  16
VAL A  22
THR A  23
 SAH  A1501 (-3.5A)
GOL  A 248 (-4.0A)
None
None
None
 1.10A 4wnwA-3nutA:
undetectable		 4wnwA-3nutA:
21.09
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.
3o98 BIFUNCTIONAL
GLUTATHIONYLSPERMIDI
NE
SYNTHETASE/AMIDASE

(Escherichia
coli) 		PF03738
(GSP_synth)
PF05257
(CHAP) 		5 LEU A 233
GLY A 364
LEU A 365
VAL A 588
THR A 314
 None
 1.18A 4wnwA-3o98A:
undetectable		 4wnwA-3o98A:
23.06
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.
3odg XANTHOSINE
PHOSPHORYLASE

(Yersinia
pseudotuberculosis) 		PF01048
(PNP_UDP_1) 		5 PHE A 112
PHE A 121
LEU A 120
GLY A  45
LEU A  44
 None
 1.17A 4wnwA-3odgA:
undetectable		 4wnwA-3odgA:
23.78
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.
3ogr BETA-GALACTOSIDASE

(Trichoderma
reesei) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		5 GLY A 563
LEU A 562
GLN A 561
VAL A 517
VAL A 537
 None
 1.21A 4wnwA-3ogrA:
undetectable		 4wnwA-3ogrA:
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.
3orw PHOSPHOTRIESTERASE

(Geobacillus
kaustophilus) 		PF02126
(PTE) 		5 GLY A  18
LEU A  17
VAL A  12
VAL A 143
PHE A 324
 None
 1.11A 4wnwA-3orwA:
undetectable		 4wnwA-3orwA:
23.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pfr MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Actinobacillus
succinogenes) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLY A 209
LEU A 207
ASP A 219
VAL A 189
VAL A 256
 None
 1.19A 4wnwA-3pfrA:
undetectable		 4wnwA-3pfrA:
21.80
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.
3pxn KINESIN-LIKE PROTEIN
NOD

(Drosophila
melanogaster) 		PF00225
(Kinesin) 		5 LEU A  67
GLY A  98
LEU A 113
VAL A 209
THR A 210
 None
 1.21A 4wnwA-3pxnA:
undetectable		 4wnwA-3pxnA:
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.
3ram HMRA PROTEIN

(Staphylococcus
aureus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 PHE A 274
GLY A 204
LEU A 208
VAL A 218
THR A 242
 None
 1.19A 4wnwA-3ramA:
undetectable		 4wnwA-3ramA:
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.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT N

(Escherichia
coli) 		no annotation 5 PHE N 207
GLY N 215
LEU N 214
VAL N 254
VAL N 177
 None
 1.03A 4wnwA-3rkoN:
0.0		 4wnwA-3rkoN:
23.02
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.
3rmv GLYCOGENIN-1

(Homo sapiens) 		PF01501
(Glyco_transf_8) 		5 GLY A  18
LEU A  20
SER A  24
VAL A  54
THR A  53
 None
 1.22A 4wnwA-3rmvA:
undetectable		 4wnwA-3rmvA:
21.24
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.
3rsc CALG2

(Micromonospora
echinospora) 		PF04101
(Glyco_tran_28_C) 		5 PHE A 245
GLY A 303
LEU A 307
VAL A 333
VAL A 297
 None
TYD  A 397 (-3.4A)
None
None
None
 1.18A 4wnwA-3rscA:
undetectable		 4wnwA-3rscA:
24.07
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.
3rza TRIPEPTIDASE

(Staphylococcus
aureus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 LEU A 361
GLY A 163
LEU A  74
VAL A 372
VAL A 121
 None
 1.03A 4wnwA-3rzaA:
undetectable		 4wnwA-3rzaA:
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.
3s6p CAPSID PROTEIN

(Helicoverpa
armigera stunt
virus) 		PF03566
(Peptidase_A21) 		5 PHE A 366
LEU A 353
VAL A 400
VAL A 373
PHE A 375
 None
 1.13A 4wnwA-3s6pA:
undetectable		 4wnwA-3s6pA:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sdq ALPHA-BISABOLENE
SYNTHASE

(Abies grandis) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		5 LEU A 674
GLY A 640
LEU A 638
VAL A 585
VAL A 558
 None
 1.08A 4wnwA-3sdqA:
undetectable		 4wnwA-3sdqA:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3swo GLUTARYL-COA
DEHYDROGENASE

(Mycolicibacterium
smegmatis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 GLY A 264
LEU A 263
ASP A  21
VAL A  85
PHE A 260
 None
 1.06A 4wnwA-3swoA:
undetectable		 4wnwA-3swoA:
23.85
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.
3tsc PUTATIVE
OXIDOREDUCTASE

(Mycobacterium
avium) 		PF13561
(adh_short_C2) 		5 GLY A 179
LEU A 180
VAL A 129
THR A 130
PHE A 184
 None
 1.10A 4wnwA-3tscA:
undetectable		 4wnwA-3tscA:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w0k BIFUNCTIONAL
ENDOMANNANASE/ENDOGL
UCANASE

(Caldanaerobius
polysaccharolyticus) 		PF00150
(Cellulase) 		5 GLY A 190
LEU A 189
ASP A 133
VAL A 159
THR A 158
 None
 1.07A 4wnwA-3w0kA:
undetectable		 4wnwA-3w0kA:
19.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w6q TYROSINASE

(Aspergillus
oryzae) 		PF00264
(Tyrosinase) 		5 PHE A 148
LEU A 164
LEU A 286
ASP A 147
VAL A 331
 None
 1.20A 4wnwA-3w6qA:
undetectable		 4wnwA-3w6qA:
22.54
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.
4a1o BIFUNCTIONAL PURINE
BIOSYNTHESIS PROTEIN
PURH

(Mycobacterium
tuberculosis) 		PF01808
(AICARFT_IMPCHas)
PF02142
(MGS) 		5 GLY A 478
LEU A 482
ASP A 470
VAL A 490
VAL A 440
 None
None
K  A1524 (-3.6A)
None
None
 1.00A 4wnwA-4a1oA:
undetectable		 4wnwA-4a1oA:
22.66
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.
4ain GLYCINE BETAINE
TRANSPORTER BETP

(Corynebacterium
glutamicum) 		PF02028
(BCCT) 		5 LEU A 399
GLY A 201
LEU A 385
SER A 389
VAL A 404
 None
 1.15A 4wnwA-4ainA:
0.4		 4wnwA-4ainA:
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.
4bz7 HISTONE DEACETYLASE
8

(Schistosoma
mansoni) 		PF00850
(Hist_deacetyl) 		5 LEU A  41
GLY A 337
LEU A 336
VAL A 279
VAL A  44
 None
 1.19A 4wnwA-4bz7A:
undetectable		 4wnwA-4bz7A:
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.
4c1o BETA-XYLOSIDASE

(Parageobacillus
thermoglucosidasius) 		PF03512
(Glyco_hydro_52) 		6 PHE A 122
GLY A 716
VAL A 355
THR A 342
VAL A 142
PHE A 375
 None
 1.47A 4wnwA-4c1oA:
undetectable		 4wnwA-4c1oA:
22.02
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4i8v CYTOCHROME P450 1A1

(Homo sapiens) 		PF00067
(p450) 		5 GLY A 453
LEU A  96
ASP A  90
VAL A 409
PHE A 103
 None
 1.13A 4wnwA-4i8vA:
42.7		 4wnwA-4i8vA:
34.64
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.
4j0q ELONGATION FACTOR
TU-A

(Pseudomonas
putida) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2) 		5 LEU A 122
LEU A 158
VAL A 133
VAL A 128
PHE A 163
 None
 1.22A 4wnwA-4j0qA:
undetectable		 4wnwA-4j0qA:
22.33
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.
4j8q PUTATIVE
UNCHARACTERIZED
PROTEIN

(Bacteroides
fragilis) 		PF12667
(NigD_N)
PF17415
(NigD_C) 		5 LEU A 137
ASP A 128
VAL A 210
VAL A 153
PHE A 195
 None
None
None
EDO  A 300 (-4.3A)
None
 1.18A 4wnwA-4j8qA:
undetectable		 4wnwA-4j8qA:
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.
4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11

(Mycobacterium
tuberculosis) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		5 PHE A  72
LEU A 114
GLY A 135
LEU A 136
SER A 313
 None
 1.20A 4wnwA-4jatA:
undetectable		 4wnwA-4jatA:
22.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ky0 PROTON/GLUTAMATE
SYMPORTER, SDF
FAMILY

(Thermococcus
kodakarensis) 		PF00375
(SDF) 		5 GLY A  21
ASP A 269
VAL A 276
THR A 277
VAL A 203
 None
 1.03A 4wnwA-4ky0A:
undetectable		 4wnwA-4ky0A:
23.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l39 4-SUBSTITUTED
BENZOATES-GLUTAMATE
LIGASE GH3.12

(Arabidopsis
thaliana) 		PF03321
(GH3) 		5 PHE A 144
LEU A 143
GLY A 204
LEU A 201
VAL A 221
 None
 1.16A 4wnwA-4l39A:
undetectable		 4wnwA-4l39A:
23.28
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.
4lbw ELONGATION FACTOR
TU-A

(Thermus
thermophilus) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2) 		5 LEU A 122
LEU A 158
VAL A 133
VAL A 128
PHE A 163
 None
 1.11A 4wnwA-4lbwA:
undetectable		 4wnwA-4lbwA:
22.55
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.
4lu6 FLAVIN-DEPENDENT
TRYPTOPHAN
HALOGENASE REBH

(Lechevalieria
aerocolonigenes) 		PF04820
(Trp_halogenase) 		5 PHE A 224
LEU A 223
GLY A  12
LEU A  37
VAL A 197
 None
 1.09A 4wnwA-4lu6A:
undetectable		 4wnwA-4lu6A:
22.60
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.
4mru SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF12741
(SusD-like) 		5 PHE A 221
LEU A 135
GLY A  56
LEU A  57
VAL A 109
 None
 1.13A 4wnwA-4mruA:
undetectable		 4wnwA-4mruA:
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.
4oav PROTEIN (RNASE L)

(Homo sapiens) 		PF00069
(Pkinase)
PF06479
(Ribonuc_2-5A)
PF12796
(Ank_2)
PF13857
(Ank_5) 		5 GLY B 253
LEU B 254
ASP B 227
VAL B 218
VAL B 232
 None
 1.18A 4wnwA-4oavB:
undetectable		 4wnwA-4oavB:
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.
4oko RAPID ENCYSTMENT
PHENOTYPE PROTEIN 34
KDA

(Francisella
tularensis) 		PF00246
(Peptidase_M14) 		5 PHE A 202
GLY A  92
LEU A 170
THR A 269
VAL A 223
 None
 1.22A 4wnwA-4okoA:
undetectable		 4wnwA-4okoA:
22.65
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.
4u4l BETA-LACTAMASE NDM-1

(Klebsiella
pneumoniae) 		PF00753
(Lactamase_B) 		5 GLY A 197
LEU A 180
ASP A  90
VAL A  80
PHE A 177
 None
 1.03A 4wnwA-4u4lA:
undetectable		 4wnwA-4u4lA:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xav GLIOMEDIN

(Mus musculus) 		PF02191
(OLF) 		5 PHE A 505
PHE A 491
GLY A 477
LEU A 495
VAL A 446
 None
 1.09A 4wnwA-4xavA:
undetectable		 4wnwA-4xavA:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z37 PUTATIVE MIXED
POLYKETIDE
SYNTHASE/NON-RIBOSOM
AL PEPTIDE
SYNTHETASE

(Brevibacillus
brevis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 PHE A2415
GLY A2677
LEU A2500
VAL A2754
THR A2588
 None
 1.15A 4wnwA-4z37A:
undetectable		 4wnwA-4z37A:
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.
5dt9 ERYTHRONATE-4-PHOSPH
ATE DEHYDROGENASE

(Vibrio cholerae) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C)
PF11890
(DUF3410) 		5 PHE A  68
LEU A  47
GLY A  26
LEU A  25
PHE A  22
 None
 1.22A 4wnwA-5dt9A:
undetectable		 4wnwA-5dt9A:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e5m CYTOTOXIC
T-LYMPHOCYTE PROTEIN
4

(Mus musculus) 		PF07686
(V-set) 		5 GLY A  81
LEU A  82
GLN A  80
SER A  12
VAL A 114
 GOL  A 201 (-4.5A)
GOL  A 201 (-4.7A)
None
None
None
 1.22A 4wnwA-5e5mA:
undetectable		 4wnwA-5e5mA:
12.66
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.
5ejy MYOSIN-I HEAVY CHAIN

(Dictyostelium
discoideum) 		PF00784
(MyTH4) 		5 PHE A 182
LEU A 210
GLY A 131
LEU A 132
VAL A 222
 None
 1.03A 4wnwA-5ejyA:
undetectable		 4wnwA-5ejyA:
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.
5fku DNA POLYMERASE III
SUBUNIT ALPHA

(Escherichia
coli) 		PF01336
(tRNA_anti-codon)
PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6) 		5 LEU A 999
GLY A 958
LEU A 959
ASP A1020
VAL A 801
 None
 1.21A 4wnwA-5fkuA:
0.0		 4wnwA-5fkuA:
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.
5hiu GTPASE
ACTIVATOR-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF11864
(DUF3384) 		5 LEU A 212
LEU A 173
GLN A 185
THR A 193
PHE A 170
 LEU  A 212 ( 0.6A)
LEU  A 173 ( 0.5A)
GLN  A 185 ( 0.6A)
THR  A 193 ( 0.8A)
PHE  A 170 ( 1.3A)
 1.22A 4wnwA-5hiuA:
undetectable		 4wnwA-5hiuA:
22.43
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.
5k4p PROBABLE
PHOSPHATIDYLETHANOLA
MINE TRANSFERASE
MCR-1

(Escherichia
coli) 		PF00884
(Sulfatase) 		5 LEU A 513
LEU A 522
VAL A 312
VAL A 463
PHE A 242
 None
 1.17A 4wnwA-5k4pA:
undetectable		 4wnwA-5k4pA:
20.95
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.
5k5t EXTRACELLULAR
CALCIUM-SENSING
RECEPTOR

(Homo sapiens) 		PF01094
(ANF_receptor)
PF07562
(NCD3G) 		5 PHE A 347
LEU A  71
GLY A  94
LEU A  34
VAL A 420
 None
 1.17A 4wnwA-5k5tA:
undetectable		 4wnwA-5k5tA:
21.82
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.
5ldt MOMP PORIN

(Campylobacter
jejuni) 		PF05538
(Campylo_MOMP) 		5 PHE A 147
GLY A 158
LEU A 157
GLN A 159
VAL A 209
 None
 1.19A 4wnwA-5ldtA:
undetectable		 4wnwA-5ldtA:
21.51
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.
5ldw NADH DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR PROTEIN
7, MITOCHONDRIAL

(Bos taurus) 		PF01058
(Oxidored_q6) 		5 PHE B  76
PHE B  72
GLY B 159
LEU B 161
ASP B  68
 None
 1.22A 4wnwA-5ldwB:
undetectable		 4wnwA-5ldwB:
17.86
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.
5mwl INOSITOL-PENTAKISPHO
SPHATE 2-KINASE

(Mus musculus) 		PF06090
(Ins_P5_2-kin) 		5 PHE A  58
GLY A  68
LEU A  67
VAL A 435
VAL A 394
 None
 1.14A 4wnwA-5mwlA:
0.4		 4wnwA-5mwlA:
21.13
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.
5na4 NADH
DEHYDROGENASE-LIKE
PROTEIN
SAOUHSC_00878

(Staphylococcus
aureus) 		no annotation 5 LEU A 184
GLY A 175
LEU A 174
VAL A 163
VAL A 195
 None
 1.20A 4wnwA-5na4A:
undetectable		 4wnwA-5na4A:
11.50
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.
5no8 BACCELL_00875

(Bacteroides
cellulosilyticus) 		no annotation 5 LEU A 694
GLY A 466
SER A 502
VAL A 471
VAL A 400
 None
 1.20A 4wnwA-5no8A:
undetectable		 4wnwA-5no8A:
21.83
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.
5thz CURJ

(Moorea
producens) 		no annotation 5 GLY B 323
LEU B 321
ASP B 230
VAL B 153
PHE B 318
 None
None
SAH  B 501 (-2.7A)
None
GOL  B 502 (-3.6A)
 1.04A 4wnwA-5thzB:
undetectable		 4wnwA-5thzB:
24.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uin FORMYLTRANSFERASE

(Salmonella
enterica) 		PF00551
(Formyl_trans_N)
PF13637
(Ank_4) 		5 PHE A  85
LEU A  90
GLY A   7
LEU A  74
VAL A  15
 None
 1.00A 4wnwA-5uinA:
undetectable		 4wnwA-5uinA:
18.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE

(Mycobacterium
tuberculosis) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon)
PF02938
(GAD) 		5 LEU A 198
GLN A 201
SER A 195
VAL A 442
PHE A 517
 None
None
ASP  A 701 (-3.6A)
None
None
 1.11A 4wnwA-5w25A:
undetectable		 4wnwA-5w25A:
22.92
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.
5w76 ANCESTRAL ELOGATION
FACTOR N153

(synthetic
construct) 		no annotation 5 LEU A 122
LEU A 158
VAL A 133
VAL A 128
PHE A 163
 None
 1.16A 4wnwA-5w76A:
undetectable		 4wnwA-5w76A:
8.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w7q CONSENSUS ELONGATION
FACTOR

(synthetic
construct) 		no annotation 5 LEU A 122
LEU A 158
VAL A 133
VAL A 128
PHE A 163
 None
 1.18A 4wnwA-5w7qA:
undetectable		 4wnwA-5w7qA:
10.71
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.
5weo GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT
CHIMERA

(Mus musculus;
Rattus
norvegicus) 		PF00060
(Lig_chan)
PF00822
(PMP22_Claudin)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		5 PHE A  74
GLY A 340
LEU A 341
VAL A 248
PHE A 258
 None
 1.06A 4wnwA-5weoA:
undetectable		 4wnwA-5weoA:
17.85
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.
5xnu PUTATIVE INTEGRAL
MEMBRANE PROTEIN

(Escherichia
coli) 		no annotation 5 LEU A 510
LEU A 519
VAL A 310
VAL A 461
PHE A 240
 None
 1.21A 4wnwA-5xnuA:
undetectable		 4wnwA-5xnuA:
10.29
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.
6b3e CYCLIN-DEPENDENT
KINASE 12

(Homo sapiens) 		no annotation 5 PHE A 839
LEU A 843
GLY A 822
LEU A 823
VAL A 829
 None
 1.11A 4wnwA-6b3eA:
undetectable		 4wnwA-6b3eA:
12.50
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.
6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE

(Rhodothermus
marinus) 		no annotation 5 LEU B 304
GLY B 309
SER B 656
VAL B 573
THR B 658
 None
 1.22A 4wnwA-6f0kB:
undetectable		 4wnwA-6f0kB:
11.28