SIMILAR PATTERNS OF AMINO ACIDS FOR 1UKB_A_BEZA1300_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.
1bd2 T CELL RECEPTOR
ALPHA

(Homo sapiens) 		PF07686
(V-set)
PF09291
(DUF1968) 		5 GLY D  58
ALA D  56
PHE D  62
PHE D  65
LEU D  75
 None
 0.97A 1ukbA-1bd2D:
undetectable		 1ukbA-1bd2D:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1d6h CHALCONE SYNTHASE

(Medicago sativa) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		5 SER A 191
ALA A 140
LEU A 144
VAL A  98
VAL A  99
 None
 1.14A 1ukbA-1d6hA:
undetectable		 1ukbA-1d6hA:
22.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1j1i META CLEAVAGE
COMPOUND HYDROLASE

(Janthinobacterium) 		PF12697
(Abhydrolase_6) 		6 GLY A  44
ALA A 140
LEU A 211
VAL A 235
VAL A 236
HIS A 261
 None
 1.04A 1ukbA-1j1iA:
35.9		 1ukbA-1j1iA:
34.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1j1i META CLEAVAGE
COMPOUND HYDROLASE

(Janthinobacterium) 		PF12697
(Abhydrolase_6) 		6 GLY A  45
ALA A 140
LEU A 211
VAL A 235
VAL A 236
HIS A 261
 None
 1.09A 1ukbA-1j1iA:
35.9		 1ukbA-1j1iA:
34.29
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.
1ljy MGP-40

(Capra hircus) 		PF00704
(Glyco_hydro_18) 		5 GLY A 241
ALA A 298
LEU A 282
VAL A 295
HIS A 197
 None
 1.06A 1ukbA-1ljyA:
undetectable		 1ukbA-1ljyA:
20.73
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.
1naa CELLOBIOSE
DEHYDROGENASE

(Phanerochaete
chrysosporium) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 GLY A 227
SER A 465
ALA A 231
ALA A 232
LEU A 244
 6FA  A 801 (-4.1A)
None
None
None
None
 1.12A 1ukbA-1naaA:
undetectable		 1ukbA-1naaA:
20.84
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.
1odt CEPHALOSPORIN C
DEACETYLASE

(Bacillus
subtilis) 		PF05448
(AXE1) 		5 GLY C  90
ALA C 181
LEU C 207
VAL C 271
HIS C 298
 ACT  C1318 (-3.6A)
ACT  C1318 (-3.0A)
None
None
ACT  C1318 (-4.0A)
 0.52A 1ukbA-1odtC:
17.2		 1ukbA-1odtC:
22.94
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.
1ql4 CYTOCHROME C552

(Paracoccus
denitrificans) 		PF00034
(Cytochrom_C) 		5 GLY A  55
ALA A  61
LEU A  62
VAL A  73
VAL A  72
 None
 1.13A 1ukbA-1ql4A:
undetectable		 1ukbA-1ql4A:
16.01
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.
1ql4 CYTOCHROME C552

(Paracoccus
denitrificans) 		PF00034
(Cytochrom_C) 		5 GLY A  55
ALA A  61
VAL A  73
VAL A  72
HIS A  53
 None
 1.12A 1ukbA-1ql4A:
undetectable		 1ukbA-1ql4A:
16.01
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.
1qou CEN

(Antirrhinum
majus) 		PF01161
(PBP) 		5 ALA A 166
PHE A 122
PHE A 125
LEU A  66
VAL A  16
 None
 1.15A 1ukbA-1qouA:
undetectable		 1ukbA-1qouA:
23.86
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.
1rhx CONSERVED
HYPOTHETICAL PROTEIN
TM0979

(Thermotoga
maritima) 		PF04077
(DsrH) 		5 GLY A   9
PHE A  36
LEU A  39
VAL A  14
HIS A  12
 None
 1.09A 1ukbA-1rhxA:
undetectable		 1ukbA-1rhxA:
17.14
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.
1rhy IMIDAZOLE GLYCEROL
PHOSPHATE
DEHYDRATASE

(Cryptococcus
neoformans) 		PF00475
(IGPD) 		5 GLY A  82
ALA A  84
PHE A  85
ALA A  88
LEU A  23
 None
 1.08A 1ukbA-1rhyA:
undetectable		 1ukbA-1rhyA:
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.
1tfd TRANSFERRIN

(Oryctolagus
cuniculus) 		PF00405
(Transferrin) 		5 GLY A 190
ALA A 191
PHE A 192
ALA A 203
LEU A 100
 None
 1.08A 1ukbA-1tfdA:
undetectable		 1ukbA-1tfdA:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wyt GLYCINE
DEHYDROGENASE
(DECARBOXYLATING)
SUBUNIT 1
GLYCINE
DEHYDROGENASE
SUBUNIT 2
(P-PROTEIN)

(Thermus
thermophilus;
Thermus
thermophilus) 		PF02347
(GDC-P)
PF02347
(GDC-P) 		5 GLY B  16
ALA A 336
ALA A 335
VAL A  81
VAL A  82
 None
 1.14A 1ukbA-1wytB:
undetectable		 1ukbA-1wytB:
19.96
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.
1xvt CROTONOBETAINYL-COA:
CARNITINE
COA-TRANSFERASE

(Escherichia
coli) 		PF02515
(CoA_transf_3) 		5 GLY A  30
PHE A  33
ALA A  38
PHE A   9
LEU A  12
 None
 0.87A 1ukbA-1xvtA:
2.3		 1ukbA-1xvtA:
22.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2d0d 2-HYDROXY-6-OXO-7-ME
THYLOCTA-2,4-DIENOAT
E HYDROLASE

(Pseudomonas
fluorescens) 		PF00561
(Abhydrolase_1) 		5 GLY A  33
ALA A 128
VAL A 226
VAL A 227
HIS A 252
 CL  A 400 ( 4.2A)
None
None
None
None
 1.10A 1ukbA-2d0dA:
51.6		 1ukbA-2d0dA:
99.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2d0d 2-HYDROXY-6-OXO-7-ME
THYLOCTA-2,4-DIENOAT
E HYDROLASE

(Pseudomonas
fluorescens) 		PF00561
(Abhydrolase_1) 		9 GLY A  33
SER A  34
PHE A 104
PHE A 133
TRP A 143
LEU A 202
VAL A 226
VAL A 227
HIS A 252
 CL  A 400 ( 4.2A)
CL  A 400 (-2.8A)
None
None
None
None
None
None
None
 0.29A 1ukbA-2d0dA:
51.6		 1ukbA-2d0dA:
99.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2d0d 2-HYDROXY-6-OXO-7-ME
THYLOCTA-2,4-DIENOAT
E HYDROLASE

(Pseudomonas
fluorescens) 		PF00561
(Abhydrolase_1) 		7 GLY A  33
SER A  34
PHE A 104
TRP A 143
LEU A 202
VAL A 226
HIS A 252
 CL  A 400 ( 4.2A)
CL  A 400 (-2.8A)
None
None
None
None
None
 1.43A 1ukbA-2d0dA:
51.6		 1ukbA-2d0dA:
99.29
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.
2dcq PUTATIVE PROTEIN
AT4G01050

(Arabidopsis
thaliana) 		no annotation 5 GLY A  98
ALA A  95
PHE A  99
ALA A 102
LEU A  77
 None
 1.09A 1ukbA-2dcqA:
undetectable		 1ukbA-2dcqA:
19.50
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.
2dkn 3-ALPHA-HYDROXYSTERO
ID DEHYDROGENASE

(Pseudomonas sp.
B-0831) 		PF13561
(adh_short_C2) 		5 GLY A 147
ALA A 143
LEU A 125
VAL A  82
VAL A  83
 None
 0.95A 1ukbA-2dknA:
4.9		 1ukbA-2dknA:
24.50
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.
2fzw ALCOHOL
DEHYDROGENASE CLASS
III CHI CHAIN

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A 178
ALA A 181
ALA A 186
LEU A 188
VAL A 289
 None
 1.04A 1ukbA-2fzwA:
3.5		 1ukbA-2fzwA:
24.11
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.
2gl5 PUTATIVE DEHYDRATASE
PROTEIN

(Salmonella
enterica) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLY A  96
ALA A  99
ALA A 103
LEU A 104
VAL A   8
 None
 1.12A 1ukbA-2gl5A:
undetectable		 1ukbA-2gl5A:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hxr HTH-TYPE
TRANSCRIPTIONAL
REGULATOR CYNR

(Escherichia
coli) 		PF03466
(LysR_substrate) 		5 GLY A 144
ALA A 146
ALA A 265
LEU A 160
VAL A 150
 None
 1.02A 1ukbA-2hxrA:
undetectable		 1ukbA-2hxrA:
22.22
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.
2l0r LETHAL FACTOR

(Bacillus
anthracis) 		PF07737
(ATLF) 		5 GLY A  19
ALA A  68
ALA A  64
LEU A  37
HIS A  16
 None
 1.12A 1ukbA-2l0rA:
undetectable		 1ukbA-2l0rA:
16.25
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.
2nqo GAMMA-GLUTAMYLTRANSP
EPTIDASE

(Helicobacter
pylori) 		PF01019
(G_glu_transpept) 		5 GLY A 138
ALA A 141
PHE A 102
ALA A 145
LEU A 100
 None
 1.07A 1ukbA-2nqoA:
undetectable		 1ukbA-2nqoA:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o1s 1-DEOXY-D-XYLULOSE-5
-PHOSPHATE SYNTHASE

(Escherichia
coli) 		PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
PF13292
(DXP_synthase_N) 		5 GLY A 158
ALA A 160
PHE A 161
PHE A 277
LEU A 246
 None
 0.93A 1ukbA-2o1sA:
undetectable		 1ukbA-2o1sA:
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.
2r4q PHOSPHOTRANSFERASE
SYSTEM (PTS)
FRUCTOSE-SPECIFIC
ENZYME IIABC
COMPONENT

(Bacillus
subtilis) 		PF02302
(PTS_IIB) 		5 GLY A 254
ALA A 231
LEU A 247
VAL A 205
VAL A 175
 None
 1.09A 1ukbA-2r4qA:
undetectable		 1ukbA-2r4qA:
16.55
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.
2rgq DOMAIN OF UNKNOWN
FUNCTION WITH A
CYSTATIN-LIKE FOLD

(Nostoc
punctiforme) 		PF13577
(SnoaL_4) 		5 GLY A  45
ALA A  47
ALA A  39
PHE A  34
LEU A 121
 None
 1.06A 1ukbA-2rgqA:
undetectable		 1ukbA-2rgqA:
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.
2vfv XYLITOL OXIDASE

(Streptomyces
coelicolor) 		PF01565
(FAD_binding_4)
PF04030
(ALO) 		5 GLY A 164
ALA A 165
ALA A 398
LEU A 397
VAL A 415
 SFD  A1418 (-3.4A)
None
None
None
None
 1.16A 1ukbA-2vfvA:
undetectable		 1ukbA-2vfvA:
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.
2wjs LAMININ SUBUNIT
ALPHA-2

(Mus musculus) 		PF00054
(Laminin_G_1) 		5 GLY A2660
PHE A2657
PHE A2692
VAL A2680
VAL A2525
 None
 1.12A 1ukbA-2wjsA:
undetectable		 1ukbA-2wjsA:
19.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a3u MENAQUINONE
BIOSYNTHETIC ENZYME

(Thermus
thermophilus) 		PF02621
(VitK2_biosynth) 		5 GLY A  89
ALA A  87
ALA A 140
LEU A  97
VAL A  85
 None
 1.14A 1ukbA-3a3uA:
undetectable		 1ukbA-3a3uA:
23.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b8l UNCHARACTERIZED
PROTEIN

(Novosphingobium
aromaticivorans) 		PF13577
(SnoaL_4) 		5 GLY A  98
ALA A 143
PHE A  60
LEU A 140
VAL A  22
 GOL  A 146 ( 4.4A)
GOL  A 146 ( 4.6A)
None
None
None
 1.11A 1ukbA-3b8lA:
undetectable		 1ukbA-3b8lA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3c0i PERIPHERAL PLASMA
MEMBRANE PROTEIN
CASK

(Homo sapiens) 		PF00069
(Pkinase) 		5 GLY A 204
PHE A 185
PHE A 227
VAL A 190
VAL A 191
 None
 1.15A 1ukbA-3c0iA:
undetectable		 1ukbA-3c0iA:
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.
3d8h GLYCOLYTIC
PHOSPHOGLYCERATE
MUTASE

(Cryptosporidium
parvum) 		PF00300
(His_Phos_1) 		5 GLY A 202
SER A 204
ALA A  80
LEU A  77
VAL A 198
 None
 1.00A 1ukbA-3d8hA:
undetectable		 1ukbA-3d8hA:
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.
3et5 OUTER MEMBRANE
PROTEIN P4, NADP
PHOSPHATASE

(Haemophilus
influenzae) 		PF03767
(Acid_phosphat_B) 		5 GLY A  31
SER A  30
ALA A  35
ALA A  37
TRP A  26
 None
 1.09A 1ukbA-3et5A:
undetectable		 1ukbA-3et5A:
23.31
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.
3fvr ACETYL XYLAN
ESTERASE

(Bacillus
pumilus) 		PF05448
(AXE1) 		5 GLY A 183
ALA A 187
LEU A 250
VAL A 201
VAL A 200
 None
 1.11A 1ukbA-3fvrA:
17.0		 1ukbA-3fvrA:
23.56
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.
3g7n LIPASE

(Penicillium
expansum) 		PF01764
(Lipase_3) 		5 GLY A  64
SER A  65
VAL A 237
VAL A 190
HIS A 241
 None
SO4  A 259 (-3.5A)
SO4  A 259 (-4.9A)
None
SO4  A 259 ( 4.6A)
 0.94A 1ukbA-3g7nA:
4.9		 1ukbA-3g7nA:
23.77
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.
3gi8 UNCHARACTERIZED
PROTEIN MJ0609

(Methanocaldococcus
jannaschii) 		PF13520
(AA_permease_2) 		5 GLY C 189
ALA C 193
PHE C 192
ALA C 195
LEU C 389
 None
 1.02A 1ukbA-3gi8C:
undetectable		 1ukbA-3gi8C:
23.41
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.
3h04 UNCHARACTERIZED
PROTEIN

(Staphylococcus
aureus) 		PF07859
(Abhydrolase_3) 		5 GLY A 127
ALA A 107
LEU A 112
VAL A 212
VAL A 122
 None
 1.08A 1ukbA-3h04A:
19.2		 1ukbA-3h04A:
25.33
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.
3h1l CYTOCHROME B

(Gallus gallus) 		PF00032
(Cytochrom_B_C)
PF00033
(Cytochrome_B) 		6 GLY C  87
ALA C  88
PHE C  91
ALA C 128
PHE C 275
LEU C 124
 None
HEM  C 501 ( 3.8A)
None
HEM  C 501 (-4.1A)
3H1  C2001 (-4.5A)
None
 1.48A 1ukbA-3h1lC:
undetectable		 1ukbA-3h1lC:
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.
3h2z MANNITOL-1-PHOSPHATE
5-DEHYDROGENASE

(Shigella
flexneri) 		PF01232
(Mannitol_dh)
PF08125
(Mannitol_dh_C) 		5 ALA A  30
PHE A  29
ALA A  65
LEU A  40
VAL A  32
 PO4  A 396 (-4.9A)
None
None
None
PO4  A 396 (-3.4A)
 1.10A 1ukbA-3h2zA:
undetectable		 1ukbA-3h2zA:
24.87
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.
3ham AMINOGLYCOSIDE
PHOSPHOTRANSFERASE

(Enterococcus
faecium) 		PF01636
(APH) 		5 GLY A 212
PHE A 214
PHE A 116
LEU A 188
VAL A 208
 None
 1.11A 1ukbA-3hamA:
undetectable		 1ukbA-3hamA:
20.44
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.
3l6i UNCHARACTERIZED
LIPOPROTEIN YCEB

(Escherichia
coli) 		PF07273
(DUF1439) 		5 GLY A 151
SER A 152
ALA A 156
ALA A 158
PHE A 176
 None
 1.07A 1ukbA-3l6iA:
undetectable		 1ukbA-3l6iA:
23.43
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.
3nf2 PUTATIVE POLYPRENYL
SYNTHETASE

(Streptomyces
coelicolor) 		PF00348
(polyprenyl_synt) 		5 GLY A 110
ALA A 114
ALA A 116
LEU A 167
VAL A  53
 None
 1.14A 1ukbA-3nf2A:
undetectable		 1ukbA-3nf2A:
23.99
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.
3nvn PLEXIN-C1

(Homo sapiens) 		PF01437
(PSI) 		5 GLY B  56
ALA B  51
ALA B  50
LEU B 109
VAL B 430
 None
 1.11A 1ukbA-3nvnB:
undetectable		 1ukbA-3nvnB:
20.04
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.
3qm1 CINNAMOYL ESTERASE

(Lactobacillus
johnsonii) 		PF12146
(Hydrolase_4) 		5 GLY A  33
ALA A 106
VAL A 199
VAL A 200
HIS A 225
 ZYC  A 245 (-3.4A)
ZYC  A 245 (-3.0A)
NA  A 249 ( 4.0A)
None
ZYC  A 245 ( 3.9A)
 0.39A 1ukbA-3qm1A:
21.9		 1ukbA-3qm1A:
24.22
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.
3qtd PMBA PROTEIN

(Pseudomonas
aeruginosa) 		PF01523
(PmbA_TldD) 		5 GLY A 257
PHE A 259
ALA A 262
LEU A 275
VAL A 380
 None
 1.15A 1ukbA-3qtdA:
undetectable		 1ukbA-3qtdA:
23.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ram HMRA PROTEIN

(Staphylococcus
aureus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 GLY A  94
ALA A 349
ALA A 348
LEU A 338
HIS A  26
 None
 1.15A 1ukbA-3ramA:
4.0		 1ukbA-3ramA:
21.43
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.
3trd ALPHA/BETA HYDROLASE

(Coxiella
burnetii) 		PF00561
(Abhydrolase_1) 		5 PHE A 111
PHE A 136
VAL A 160
VAL A 161
HIS A 187
 None
ACT  A 206 (-4.8A)
ACT  A 206 (-4.9A)
None
None
 0.95A 1ukbA-3trdA:
19.2		 1ukbA-3trdA:
23.51
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.
3vpi TYPE VI SECRETION
EXPORTED 1

(Pseudomonas
aeruginosa) 		no annotation 5 GLY A  77
ALA A  74
PHE A  78
VAL A  94
VAL A  95
 None
 0.98A 1ukbA-3vpiA:
undetectable		 1ukbA-3vpiA:
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.
4ay1 CHITINASE-3-LIKE
PROTEIN 2

(Homo sapiens) 		PF00704
(Glyco_hydro_18) 		5 GLY A 270
ALA A 327
LEU A 311
VAL A 324
HIS A 226
 None
 1.07A 1ukbA-4ay1A:
undetectable		 1ukbA-4ay1A:
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.
4emb 2,3-BISPHOSPHOGLYCER
ATE-DEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Borreliella
burgdorferi) 		PF00300
(His_Phos_1) 		5 GLY A 188
SER A 190
ALA A  66
LEU A  63
VAL A 184
 None
 1.06A 1ukbA-4embA:
undetectable		 1ukbA-4embA:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4eqa PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 5 GLY A  77
ALA A  74
PHE A  78
VAL A  94
VAL A  95
 None
 0.96A 1ukbA-4eqaA:
undetectable		 1ukbA-4eqaA:
21.55
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.
4ewg BETA-KETOACYL
SYNTHASE

(Paraburkholderia
phymatum) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A 167
ALA A 170
ALA A 174
LEU A 240
VAL A 158
 None
 1.12A 1ukbA-4ewgA:
undetectable		 1ukbA-4ewgA:
21.05
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.
4f4m PAPAIN PEPTIDOGLYCAN
AMIDASE EFFECTOR
TSE1

(Pseudomonas
aeruginosa) 		no annotation 5 GLY A  77
ALA A  74
PHE A  78
VAL A  94
VAL A  95
 None
 1.00A 1ukbA-4f4mA:
undetectable		 1ukbA-4f4mA:
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.
4fx0 PROBABLE
TRANSCRIPTIONAL
REPRESSOR PROTEIN

(Mycobacterium
tuberculosis) 		PF12802
(MarR_2) 		5 GLY A  23
ALA A  25
ALA A  29
LEU A  30
VAL A 123
 None
 1.07A 1ukbA-4fx0A:
undetectable		 1ukbA-4fx0A:
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.
4g9i HYDROGENASE
MATURATION PROTEIN
HYPF

(Thermococcus
kodakarensis) 		PF00708
(Acylphosphatase)
PF00814
(Peptidase_M22)
PF01300
(Sua5_yciO_yrdC)
PF07503
(zf-HYPF) 		5 GLY A 705
ALA A 701
PHE A 704
LEU A 535
VAL A 709
 None
 1.00A 1ukbA-4g9iA:
undetectable		 1ukbA-4g9iA:
16.99
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.
4h7u PYRANOSE
DEHYDROGENASE

(Leucoagaricus
meleagris) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 GLY A 282
ALA A  21
LEU A 242
VAL A 246
VAL A 259
 FED  A 801 (-3.5A)
None
FED  A 801 (-4.1A)
None
None
 0.97A 1ukbA-4h7uA:
undetectable		 1ukbA-4h7uA:
19.57
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.
4hts SEC-INDEPENDENT
PROTEIN TRANSLOCASE
PROTEIN TATC

(Aquifex
aeolicus) 		PF00902
(TatC) 		5 GLY A  26
ALA A  28
PHE A  29
ALA A  32
LEU A  64
 None
 1.11A 1ukbA-4htsA:
undetectable		 1ukbA-4htsA:
23.20
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.
4htt SEC-INDEPENDENT
PROTEIN TRANSLOCASE
PROTEIN TATC,
LYSOZYME

(Escherichia
virus T4;
Aquifex
aeolicus) 		PF00902
(TatC) 		6 GLY A  26
ALA A  28
PHE A  29
ALA A  32
LEU A  64
VAL A  71
 None
 1.05A 1ukbA-4httA:
undetectable		 1ukbA-4httA:
22.07
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.
4htt SEC-INDEPENDENT
PROTEIN TRANSLOCASE
PROTEIN TATC,
LYSOZYME

(Escherichia
virus T4;
Aquifex
aeolicus) 		PF00902
(TatC) 		5 GLY A 161
ALA A 163
PHE A 164
PHE A 191
LEU A 219
 None
 1.09A 1ukbA-4httA:
undetectable		 1ukbA-4httA:
22.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4i3f SERINE HYDROLASE
CCSP0084

(Cycloclasticus
sp. P1) 		PF12697
(Abhydrolase_6) 		5 GLY A  31
SER A  32
PHE A 134
TRP A 144
HIS A 258
 CL  A 301 (-3.7A)
CL  A 302 (-3.1A)
None
None
None
 0.66A 1ukbA-4i3fA:
41.2		 1ukbA-4i3fA:
34.63
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.
4ia4 AQUAPORIN

(Spinacia
oleracea) 		PF00230
(MIP) 		5 GLY A 252
ALA A 256
ALA A 257
LEU A 110
VAL A 179
 None
 1.03A 1ukbA-4ia4A:
undetectable		 1ukbA-4ia4A:
21.17
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.
4j5u SERINE
HYDROXYMETHYLTRANSFE
RASE

(Rickettsia
rickettsii) 		PF00464
(SHMT) 		5 GLY A 238
SER A  97
ALA A 101
ALA A 104
LEU A 259
 None
LLP  A 230 ( 3.4A)
None
None
None
 1.16A 1ukbA-4j5uA:
undetectable		 1ukbA-4j5uA:
22.99
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.
4lb0 UNCHARACTERIZED
PROTEIN

(Agrobacterium
vitis) 		PF05544
(Pro_racemase) 		5 GLY A 174
ALA A 125
ALA A 124
LEU A  38
VAL A 128
 None
 1.01A 1ukbA-4lb0A:
undetectable		 1ukbA-4lb0A:
23.58
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.
4lx3 DNA POLYMERASE III,
ALPHA SUBUNIT
NUCLEIC ACID
BINDING, OB-FOLD,
TRNA/HELICASE-TYPE

(Nostoc
punctiforme;
Nostoc
punctiforme) 		no annotation
no annotation 		5 GLY B  31
ALA B  27
PHE B  32
ALA B  34
VAL A  33
 None
 1.14A 1ukbA-4lx3B:
undetectable		 1ukbA-4lx3B:
10.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4lxi MCP HYDROLASE

(Sphingomonas
wittichii) 		PF12697
(Abhydrolase_6) 		5 GLY A  33
ALA A 105
ALA A 131
LEU A 205
HIS A 255
 22J  A 301 (-3.4A)
22J  A 301 (-2.8A)
22J  A 301 ( 4.7A)
None
22J  A 301 ( 4.5A)
 0.75A 1ukbA-4lxiA:
37.9		 1ukbA-4lxiA:
34.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4lxi MCP HYDROLASE

(Sphingomonas
wittichii) 		PF12697
(Abhydrolase_6) 		5 GLY A  33
ALA A 105
ALA A 131
VAL A 230
HIS A 255
 22J  A 301 (-3.4A)
22J  A 301 (-2.8A)
22J  A 301 ( 4.7A)
None
22J  A 301 ( 4.5A)
 0.81A 1ukbA-4lxiA:
37.9		 1ukbA-4lxiA:
34.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4lxi MCP HYDROLASE

(Sphingomonas
wittichii) 		PF12697
(Abhydrolase_6) 		5 GLY A  34
ALA A 105
ALA A 131
LEU A 205
HIS A 255
 22J  A 301 (-3.7A)
22J  A 301 (-2.8A)
22J  A 301 ( 4.7A)
None
22J  A 301 ( 4.5A)
 1.04A 1ukbA-4lxiA:
37.9		 1ukbA-4lxiA:
34.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4lxi MCP HYDROLASE

(Sphingomonas
wittichii) 		PF12697
(Abhydrolase_6) 		5 GLY A  34
ALA A 105
ALA A 131
VAL A 230
HIS A 255
 22J  A 301 (-3.7A)
22J  A 301 (-2.8A)
22J  A 301 ( 4.7A)
None
22J  A 301 ( 4.5A)
 1.09A 1ukbA-4lxiA:
37.9		 1ukbA-4lxiA:
34.36
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.
4nnq PUTATIVE ENOYL-COA
HYDRATASE

(Streptomyces
atroolivaceus) 		PF00378
(ECH_1) 		5 GLY A 119
ALA A 123
ALA A 124
LEU A 155
VAL A 129
 None
 1.08A 1ukbA-4nnqA:
undetectable		 1ukbA-4nnqA:
24.92
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.
4oc9 PUTATIVE
O-ACETYLHOMOSERINE
(THIOL)-LYASE

(Campylobacter
jejuni) 		PF01053
(Cys_Met_Meta_PP) 		5 SER A 258
PHE A  76
ALA A  69
PHE A 192
VAL A 198
 None
 1.11A 1ukbA-4oc9A:
undetectable		 1ukbA-4oc9A:
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.
4odi PHOSPHOGLYCERATE
MUTASE PGMII

(Toxoplasma
gondii) 		PF00300
(His_Phos_1) 		5 GLY A 200
SER A 202
ALA A  78
LEU A  75
VAL A 196
 None
 1.02A 1ukbA-4odiA:
undetectable		 1ukbA-4odiA:
20.12
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.
4pag PERIPLASMIC BINDING
PROTEIN

(Sulfurospirillum
deleyianum) 		PF01497
(Peripla_BP_2) 		5 GLY A  41
SER A  42
ALA A 132
LEU A 125
VAL A 135
 None
 0.85A 1ukbA-4pagA:
2.6		 1ukbA-4pagA:
22.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q2h PROLINE RACEMASE
PROTEIN

(Agrobacterium
tumefaciens) 		PF05544
(Pro_racemase) 		5 GLY A 174
ALA A 125
ALA A 124
LEU A  38
VAL A 128
 None
 1.01A 1ukbA-4q2hA:
undetectable		 1ukbA-4q2hA:
23.20
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.
4qnk IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
2, CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00475
(IGPD) 		5 GLY A  84
ALA A  86
ALA A  90
LEU A  91
VAL A  60
 None
 1.10A 1ukbA-4qnkA:
undetectable		 1ukbA-4qnkA:
21.95
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.
4ux8 PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET

(Homo sapiens) 		PF00028
(Cadherin) 		5 GLY A 344
ALA A 342
LEU A 319
VAL A 282
VAL A 293
 None
 1.02A 1ukbA-4ux8A:
undetectable		 1ukbA-4ux8A:
18.57
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.
4wer DIACYLGLYCEROL
KINASE CATALYTIC
DOMAIN PROTEIN

(Enterococcus
faecalis) 		PF00781
(DAGK_cat) 		5 GLY A  44
ALA A  46
ALA A  50
PHE A  86
VAL A  63
 None
 1.15A 1ukbA-4werA:
2.9		 1ukbA-4werA:
23.71
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.
4xoq COENZYME
F420:L-GLUTAMATE
LIGASE

(Mycobacterium
tuberculosis) 		PF00881
(Nitroreductase) 		5 GLY A 394
SER A 395
ALA A 389
ALA A 387
LEU A 384
 None
 1.03A 1ukbA-4xoqA:
undetectable		 1ukbA-4xoqA:
23.89
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.
4y4m PUTATIVE RIBOSE
1,5-BISPHOSPHATE
ISOMERASE

(Methanocaldococcus
jannaschii) 		PF01946
(Thi4) 		5 GLY A 180
ALA A 231
ALA A 232
LEU A 214
VAL A 176
 48F  A 301 (-3.3A)
None
None
None
None
 1.13A 1ukbA-4y4mA:
undetectable		 1ukbA-4y4mA:
21.43
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.
4ynu GLUCOSE OXIDASE,
PUTATIVE

(Aspergillus
flavus) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 GLY A  87
SER A  90
ALA A 214
ALA A 216
LEU A 156
 None
 1.11A 1ukbA-4ynuA:
undetectable		 1ukbA-4ynuA:
20.84
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.
5ap9 LIPASE

(Thermomyces
lanuginosus) 		PF01764
(Lipase_3)
PF03893
(Lipase3_N) 		5 GLY A  82
SER A  83
LEU A  93
VAL A 203
HIS A 258
 None
 1.14A 1ukbA-5ap9A:
5.1		 1ukbA-5ap9A:
23.68
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.
5g53 ADENOSINE RECEPTOR
A2A

(Homo sapiens) 		PF00001
(7tm_1) 		5 ALA A  81
PHE A  79
LEU A 137
VAL A 171
VAL A 172
 None
 1.14A 1ukbA-5g53A:
undetectable		 1ukbA-5g53A:
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.
5g5g PUTATIVE XANTHINE
DEHYDROGENASE YAGS
FAD-BINDING SUBUNIT

(Escherichia
coli) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 GLY C 588
ALA C 587
ALA C 612
LEU C 675
VAL C 626
 None
 1.05A 1ukbA-5g5gC:
undetectable		 1ukbA-5g5gC:
18.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hm7 BUTYROPHILIN
SUBFAMILY 3 MEMBER
A1

(Homo sapiens) 		PF00622
(SPRY)
PF13765
(PRY) 		5 ALA A 319
PHE A 348
LEU A 355
VAL A 332
VAL A 325
 None
 1.15A 1ukbA-5hm7A:
undetectable		 1ukbA-5hm7A:
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.
5idu ACYL-COA
DEHYDROGENASE DOMAIN
PROTEIN

(Paraburkholderia
phymatum) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 GLY A 106
SER A 107
ALA A 133
ALA A 131
VAL A  52
 None
 1.14A 1ukbA-5iduA:
undetectable		 1ukbA-5iduA:
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.
5jy1 PUTATIVE SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE

(Paraburkholderia
xenovorans) 		PF13561
(adh_short_C2) 		5 GLY A 224
ALA A 227
ALA A 231
VAL A  11
VAL A  88
 None
 1.13A 1ukbA-5jy1A:
4.5		 1ukbA-5jy1A:
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.
5jy1 PUTATIVE SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE

(Paraburkholderia
xenovorans) 		PF13561
(adh_short_C2) 		6 GLY A 224
SER A  25
ALA A 227
ALA A 231
LEU A   4
VAL A  88
 None
 1.44A 1ukbA-5jy1A:
4.5		 1ukbA-5jy1A:
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.
5opj RHAMNOGALACTURONAN
LYASE

(Bacteroides
thetaiotaomicron) 		no annotation 5 GLY A 135
PHE A  65
ALA A 124
LEU A 121
VAL A 128
 None
 1.13A 1ukbA-5opjA:
undetectable		 1ukbA-5opjA:
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.
5tr3 DIHYDROLIPOYL
DEHYDROGENASE

(Pseudomonas
putida) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLY A  15
ALA A  19
ALA A  20
VAL A 337
VAL A 338
 FAD  A 501 (-3.8A)
None
None
None
None
 1.13A 1ukbA-5tr3A:
undetectable		 1ukbA-5tr3A:
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.
5um0 2,3-BISPHOSPHOGLYCER
ATE-DEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Neisseria
gonorrhoeae) 		PF00300
(His_Phos_1) 		5 GLY A 182
SER A 184
ALA A  60
LEU A  57
VAL A 178
 None
 1.00A 1ukbA-5um0A:
undetectable		 1ukbA-5um0A:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ux5 BIFUNCTIONAL PROTEIN
PROLINE UTILIZATION
A (PUTA)

(Corynebacterium
freiburgense) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		5 GLY A 601
ALA A 605
PHE A 604
ALA A 608
VAL A 586
 None
 1.09A 1ukbA-5ux5A:
undetectable		 1ukbA-5ux5A:
14.54
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.
5wbl REGULATORY-ASSOCIATE
D PROTEIN OF TOR 1

(Arabidopsis
thaliana) 		no annotation 5 ALA A 842
PHE A 841
ALA A 844
LEU A 859
VAL A 701
 None
 1.01A 1ukbA-5wblA:
undetectable		 1ukbA-5wblA:
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.
5wvg CHITINASE

(Ostrinia
furnacalis) 		no annotation 5 GLY A 771
ALA A 831
LEU A 813
VAL A 828
HIS A 727
 None
 1.11A 1ukbA-5wvgA:
undetectable		 1ukbA-5wvgA:
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.
5xep CHITINASE-3-LIKE
PROTEIN 1

(Mus musculus) 		no annotation 5 GLY A 263
ALA A 320
LEU A 304
VAL A 317
HIS A 219
 None
 1.02A 1ukbA-5xepA:
undetectable		 1ukbA-5xepA:
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.
6aqf ADENOSINE RECEPTOR
A2A,SOLUBLE
CYTOCHROME
B562,ADENOSINE
RECEPTOR A2A

(Escherichia
coli;
Homo sapiens) 		no annotation 5 ALA A  81
PHE A  79
LEU A 137
VAL A 171
VAL A 172
 None
OLC  A1216 ( 4.6A)
None
None
None
 0.85A 1ukbA-6aqfA:
undetectable		 1ukbA-6aqfA:
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.
6c66 CRISPR-ASSOCIATED
PROTEIN, CAS5E
FAMILY

(Thermobifida
fusca) 		no annotation 5 GLY M  37
ALA M  41
PHE M  39
ALA M  42
LEU M 129
 U  J   2 ( 3.3A)
A  J   1 ( 3.1A)
None
None
None
 1.07A 1ukbA-6c66M:
undetectable		 1ukbA-6c66M:
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.
6ezm IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE

(Saccharomyces
cerevisiae) 		no annotation 5 GLY U 101
ALA U 103
PHE U 104
LEU U  23
VAL U  79
 None
 0.88A 1ukbA-6ezmU:
undetectable		 1ukbA-6ezmU:
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.
6fwh IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE

(Acanthamoeba
castellanii) 		no annotation 5 GLY A  77
ALA A  79
PHE A  80
ALA A  83
LEU A  23
 None
 1.10A 1ukbA-6fwhA:
undetectable		 1ukbA-6fwhA:
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.
6gdg TRXA,ADENOSINE
RECEPTOR A2A

(Escherichia
coli;
Homo sapiens) 		no annotation 5 ALA A  81
PHE A  79
LEU A 137
VAL A 171
VAL A 172
 None
 1.15A 1ukbA-6gdgA:
undetectable		 1ukbA-6gdgA:
undetectable