SIMILAR PATTERNS OF AMINO ACIDS FOR 1I18_A_RBFA98_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.
1a5z L-LACTATE
DEHYDROGENASE

(Thermotoga
maritima) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ASP A  62
LEU A  29
ILE A  95
THR A 246
ILE A 250
 None
None
None
OXM  A 355 (-4.6A)
None
 1.37A 1i18A-1a5zA:
0.0
1i18B-1a5zA:
0.0		 1i18A-1a5zA:
16.24
1i18B-1a5zA:
16.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gwi CYTOCHROME P450
154C1

(Streptomyces
coelicolor) 		PF00067
(p450) 		5 LEU A 111
LEU A 213
ILE A 232
THR A 235
THR A 105
 None
 1.42A 1i18A-1gwiA:
0.0
1i18B-1gwiA:
undetectable		 1i18A-1gwiA:
15.09
1i18B-1gwiA:
15.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hze RIBOFLAVIN SYNTHASE
ALPHA CHAIN

(Escherichia
coli) 		PF00677
(Lum_binding) 		7 CYH A  48
LEU A  49
ASP A  62
LEU A  63
THR A  67
ILE A  70
THR A  71
 RBF  A  98 (-3.3A)
RBF  A  98 (-3.8A)
RBF  A  98 (-2.7A)
RBF  A  98 (-4.1A)
RBF  A  98 (-3.1A)
RBF  A  98 ( 4.1A)
None
 0.23A 1i18A-1hzeA:
20.4
1i18B-1hzeA:
20.2		 1i18A-1hzeA:
100.00
1i18B-1hzeA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1i8d RIBOFLAVIN SYNTHASE

(Escherichia
coli) 		PF00677
(Lum_binding) 		5 LEU A  49
LEU A  63
ILE A  70
THR A  71
PHE A   2
 None
 0.96A 1i18A-1i8dA:
13.2
1i18B-1i8dA:
12.7		 1i18A-1i8dA:
100.00
1i18B-1i8dA:
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.
1i8q HYALURONATE LYASE

(Streptococcus
agalactiae) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF08124
(Lyase_8_N) 		5 ASP A 395
THR A 402
ILE A 405
THR A 448
ILE A 449
 None
 1.35A 1i18A-1i8qA:
0.1
1i18B-1i8qA:
0.1		 1i18A-1i8qA:
9.66
1i18B-1i8qA:
9.66
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.
1iwp GLYCEROL DEHYDRATASE
ALPHA SUBUNIT

(Klebsiella
pneumoniae) 		PF02286
(Dehydratase_LU) 		5 LEU A 322
LEU A  92
ILE A 109
THR A 106
ILE A 285
 None
 1.33A 1i18A-1iwpA:
0.0
1i18B-1iwpA:
0.0		 1i18A-1iwpA:
10.74
1i18B-1iwpA:
10.74
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.
1jof CARBOXY-CIS,CIS-MUCO
NATE CYCLASE

(Neurospora
crassa) 		PF10282
(Lactonase) 		5 LEU A   5
LEU A 334
THR A 327
PHE A  47
THR A  46
 None
 1.09A 1i18A-1jofA:
0.0
1i18B-1jofA:
0.0		 1i18A-1jofA:
15.31
1i18B-1jofA:
15.31
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.
1jqg CARBOXYPEPTIDASE A

(Helicoverpa
armigera) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		5 LEU A  50
LEU A  22
ILE A  47
PHE A  55
ILE A 182
 None
 1.41A 1i18A-1jqgA:
undetectable
1i18B-1jqgA:
0.0		 1i18A-1jqgA:
12.47
1i18B-1jqgA:
12.47
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.
1pdk PROTEIN (PROTEIN
PAPK)

(Escherichia
coli) 		PF00419
(Fimbrial) 		5 LEU B 123
LEU B 121
ILE B  62
PHE B  67
THR B  66
 None
 1.11A 1i18A-1pdkB:
undetectable
1i18B-1pdkB:
undetectable		 1i18A-1pdkB:
21.60
1i18B-1pdkB:
21.60
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.
1qxy METHIONYL
AMINOPEPTIDASE

(Staphylococcus
aureus) 		PF00557
(Peptidase_M24) 		5 CYH A  19
THR A 235
THR A 246
PHE A  47
ILE A  15
 None
 1.19A 1i18A-1qxyA:
undetectable
1i18B-1qxyA:
undetectable		 1i18A-1qxyA:
18.99
1i18B-1qxyA:
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.
1rtw TRANSCRIPTIONAL
ACTIVATOR, PUTATIVE

(Pyrococcus
furiosus) 		PF03070
(TENA_THI-4) 		5 LEU A  40
LEU A  94
ILE A  98
PHE A  22
ILE A 204
 None
 1.42A 1i18A-1rtwA:
undetectable
1i18B-1rtwA:
undetectable		 1i18A-1rtwA:
20.36
1i18B-1rtwA:
20.36
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.
1rw0 CONSERVED
HYPOTHETICAL PROTEIN

(Salmonella
enterica) 		PF02578
(Cu-oxidase_4) 		5 LEU A  36
LEU A  54
ILE A  23
THR A  21
THR A 233
 None
 1.38A 1i18A-1rw0A:
undetectable
1i18B-1rw0A:
undetectable		 1i18A-1rw0A:
19.15
1i18B-1rw0A:
19.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sny SNIFFER CG10964-PA

(Drosophila
melanogaster) 		PF00106
(adh_short) 		5 CYH A  10
LEU A  16
THR A 220
ILE A 223
THR A   8
 None
 1.41A 1i18A-1snyA:
undetectable
1i18B-1snyA:
undetectable		 1i18A-1snyA:
15.18
1i18B-1snyA:
15.18
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.
1sny SNIFFER CG10964-PA

(Drosophila
melanogaster) 		PF00106
(adh_short) 		5 LEU A  84
LEU A 130
ILE A 150
THR A  34
ILE A   7
 None
 1.43A 1i18A-1snyA:
undetectable
1i18B-1snyA:
undetectable		 1i18A-1snyA:
15.18
1i18B-1snyA:
15.18
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.
1xeu INTERNALIN C

(Listeria
monocytogenes) 		PF08191
(LRR_adjacent)
PF12354
(Internalin_N)
PF12799
(LRR_4) 		5 LEU A 164
LEU A 183
ILE A 177
THR A 155
PHE A 146
 None
 1.06A 1i18A-1xeuA:
undetectable
1i18B-1xeuA:
undetectable		 1i18A-1xeuA:
20.23
1i18B-1xeuA:
20.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z9a NAD(P)H-DEPENDENT
D-XYLOSE REDUCTASE

([Candida]
tenuis) 		PF00248
(Aldo_ket_red) 		5 LEU A 110
LEU A 112
ILE A 214
THR A 215
ILE A   8
 None
 1.41A 1i18A-1z9aA:
undetectable
1i18B-1z9aA:
undetectable		 1i18A-1z9aA:
14.52
1i18B-1z9aA:
14.52
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.
2anp LEUCYL
AMINOPEPTIDASE

(Vibrio
proteolyticus) 		PF04389
(Peptidase_M28) 		5 LEU A 178
LEU A 176
ILE A 143
THR A 126
ILE A 129
 None
 1.30A 1i18A-2anpA:
undetectable
1i18B-2anpA:
undetectable		 1i18A-2anpA:
19.56
1i18B-2anpA:
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.
2d07 G/T
MISMATCH-SPECIFIC
THYMINE DNA
GLYCOSYLASE

(Homo sapiens) 		PF03167
(UDG) 		5 LEU A 132
THR A 264
ILE A 259
PHE A 189
ILE A 137
 None
 1.22A 1i18A-2d07A:
undetectable
1i18B-2d07A:
undetectable		 1i18A-2d07A:
19.13
1i18B-2d07A:
19.13
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.
2glj PROBABLE M18-FAMILY
AMINOPEPTIDASE 1

(Clostridium
acetobutylicum) 		PF02127
(Peptidase_M18) 		5 CYH A 433
ASP A 266
THR A 418
THR A 373
ILE A 431
 None
MN  A6002 ( 4.9A)
None
None
None
 1.32A 1i18A-2gljA:
undetectable
1i18B-2gljA:
undetectable		 1i18A-2gljA:
14.93
1i18B-2gljA:
14.93
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.
2go7 HYDROLASE, HALOACID
DEHALOGENASE-LIKE
FAMILY

(Streptococcus
pneumoniae) 		PF13419
(HAD_2) 		5 LEU A  14
LEU A  93
ILE A 101
PHE A 182
ILE A 180
 None
 1.40A 1i18A-2go7A:
undetectable
1i18B-2go7A:
undetectable		 1i18A-2go7A:
21.36
1i18B-2go7A:
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.
2i6d RNA
METHYLTRANSFERASE,
TRMH FAMILY

(Porphyromonas
gingivalis) 		PF00588
(SpoU_methylase) 		5 CYH A 247
LEU A 246
LEU A 221
ILE A 199
ILE A 126
 None
 1.41A 1i18A-2i6dA:
0.6
1i18B-2i6dA:
0.6		 1i18A-2i6dA:
17.39
1i18B-2i6dA:
17.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2isj BLUB

(Sinorhizobium
meliloti) 		PF00881
(Nitroreductase) 		5 CYH A 191
LEU A 190
ILE A 174
PHE A  37
ILE A 111
 None
 1.10A 1i18A-2isjA:
undetectable
1i18B-2isjA:
undetectable		 1i18A-2isjA:
24.44
1i18B-2isjA:
24.44
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.
2lj8 COFILIN/ACTIN
DEPOLYMERIZING
FACTOR, PUTATIVE

(Trypanosoma
brucei) 		PF00241
(Cofilin_ADF) 		5 LEU A  27
LEU A  88
ILE A  91
THR A  49
ILE A  36
 None
 1.38A 1i18A-2lj8A:
undetectable
1i18B-2lj8A:
undetectable		 1i18A-2lj8A:
20.57
1i18B-2lj8A:
20.57
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.
2o4u DIMERIC DIHYDRODIOL
DEHYDROGENASE

(Macaca
fascicularis) 		PF01408
(GFO_IDH_MocA) 		5 CYH X1228
LEU X1177
LEU X1158
PHE X1226
THR X1213
 None
None
GOL  X3001 ( 4.7A)
None
None
 1.28A 1i18A-2o4uX:
undetectable
1i18B-2o4uX:
undetectable		 1i18A-2o4uX:
16.42
1i18B-2o4uX:
16.42
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.
2o4u DIMERIC DIHYDRODIOL
DEHYDROGENASE

(Macaca
fascicularis) 		PF01408
(GFO_IDH_MocA) 		5 CYH X1228
LEU X1177
THR X1231
PHE X1226
THR X1213
 None
 1.34A 1i18A-2o4uX:
undetectable
1i18B-2o4uX:
undetectable		 1i18A-2o4uX:
16.42
1i18B-2o4uX:
16.42
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.
2q6d INFECTIOUS
BRONCHITIS VIRUS
(IBV) MAIN PROTEASE

(Avian
coronavirus) 		PF05409
(Peptidase_C30) 		5 LEU A 224
ILE A 282
PHE A 246
THR A 199
ILE A 202
 None
 1.43A 1i18A-2q6dA:
2.1
1i18B-2q6dA:
2.0		 1i18A-2q6dA:
14.33
1i18B-2q6dA:
14.33
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.
2q7x UPF0052 PROTEIN
SP_1565

(Streptococcus
pneumoniae) 		PF01933
(UPF0052) 		5 LEU A 317
LEU A 256
ILE A 252
THR A   7
ILE A 187
 None
 1.43A 1i18A-2q7xA:
undetectable
1i18B-2q7xA:
undetectable		 1i18A-2q7xA:
17.21
1i18B-2q7xA:
17.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rb5 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF08282
(Hydrolase_3) 		5 LEU A  61
LEU A  56
ILE A 251
THR A  25
ILE A 261
 None
 1.21A 1i18A-2rb5A:
undetectable
1i18B-2rb5A:
undetectable		 1i18A-2rb5A:
20.38
1i18B-2rb5A:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v4j SULFITE REDUCTASE,
DISSIMILATORY-TYPE
SUBUNIT ALPHA

(Desulfovibrio
vulgaris) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		5 ASP A 367
THR A 395
ILE A 397
PHE A 216
ILE A 327
 None
 1.21A 1i18A-2v4jA:
undetectable
1i18B-2v4jA:
undetectable		 1i18A-2v4jA:
12.87
1i18B-2v4jA:
12.87
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.
2vca ALPHA-N-ACETYLGLUCOS
AMINIDASE

(Clostridium
perfringens) 		PF00754
(F5_F8_type_C)
PF05089
(NAGLU)
PF12971
(NAGLU_N)
PF12972
(NAGLU_C) 		5 LEU A 612
ILE A 633
THR A 629
THR A 654
ILE A 651
 None
 1.42A 1i18A-2vcaA:
undetectable
1i18B-2vcaA:
undetectable		 1i18A-2vcaA:
7.66
1i18B-2vcaA:
7.66
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.
2ww8 CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN

(Streptococcus
pneumoniae) 		PF13519
(VWA_2) 		5 LEU A 363
ILE A 369
PHE A 358
THR A 278
ILE A 279
 None
 1.31A 1i18A-2ww8A:
undetectable
1i18B-2ww8A:
undetectable		 1i18A-2ww8A:
8.18
1i18B-2ww8A:
8.18
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.
2xci 3-DEOXY-D-MANNO-2-OC
TULOSONIC ACID
TRANSFERASE

(Aquifex
aeolicus) 		PF04413
(Glycos_transf_N) 		5 LEU A 205
LEU A 323
ILE A 285
PHE A 229
ILE A 191
 None
 1.43A 1i18A-2xciA:
undetectable
1i18B-2xciA:
undetectable		 1i18A-2xciA:
13.60
1i18B-2xciA:
13.60
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.
2xyq PUTATIVE 2'-O-METHYL
TRANSFERASE

(Severe acute
respiratory
syndrome-related
coronavirus) 		PF06460
(NSP13) 		5 LEU A 180
LEU A 153
ILE A 128
THR A 191
ILE A 207
 None
 1.40A 1i18A-2xyqA:
undetectable
1i18B-2xyqA:
undetectable		 1i18A-2xyqA:
14.81
1i18B-2xyqA:
14.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2y8n 4-HYDROXYPHENYLACETA
TE DECARBOXYLASE
LARGE SUBUNIT

(Clostridium
scatologenes) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		5 LEU A  96
LEU A 376
ILE A 428
PHE A 335
ILE A 348
 None
 1.23A 1i18A-2y8nA:
undetectable
1i18B-2y8nA:
undetectable		 1i18A-2y8nA:
7.58
1i18B-2y8nA:
7.58
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.
2yij PHOSPHOLIPASE
A1-IIGAMMA

(Arabidopsis
thaliana) 		PF01764
(Lipase_3) 		5 LEU A  43
LEU A  36
ILE A 321
PHE A  19
ILE A  48
 None
 1.36A 1i18A-2yijA:
undetectable
1i18B-2yijA:
undetectable		 1i18A-2yijA:
12.71
1i18B-2yijA:
12.71
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.
2yva DNAA
INITIATOR-ASSOCIATIN
G PROTEIN DIAA

(Escherichia
coli) 		PF13580
(SIS_2) 		5 LEU A  45
LEU A  79
ILE A 125
THR A 138
ILE A 139
 None
 1.37A 1i18A-2yvaA:
undetectable
1i18B-2yvaA:
undetectable		 1i18A-2yvaA:
21.03
1i18B-2yvaA:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z55 ARCHAERHODOPSIN-2

(Halobacterium
sp. AUS-2) 		PF01036
(Bac_rhodopsin) 		5 LEU A  99
ASP A 120
LEU A 116
THR A  50
ILE A  49
 None
 1.37A 1i18A-2z55A:
undetectable
1i18B-2z55A:
undetectable		 1i18A-2z55A:
20.00
1i18B-2z55A:
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.
3bdz P450CIN

(Citrobacter
braakii) 		PF00067
(p450) 		5 LEU A 157
ILE A 240
PHE A  86
THR A  83
ILE A 174
 None
 1.38A 1i18A-3bdzA:
undetectable
1i18B-3bdzA:
undetectable		 1i18A-3bdzA:
14.63
1i18B-3bdzA:
14.63
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.
3bo7 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
CYCLOPHILIN-TYPE

(Toxoplasma
gondii) 		PF00160
(Pro_isomerase) 		5 LEU A 129
THR A 122
ILE A 121
PHE A  93
THR A 134
 None
 1.36A 1i18A-3bo7A:
undetectable
1i18B-3bo7A:
undetectable		 1i18A-3bo7A:
20.53
1i18B-3bo7A:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3f6t ASPARTATE
AMINOTRANSFERASE

(Lactobacillus
acidophilus) 		PF00155
(Aminotran_1_2) 		5 LEU A 183
LEU A 189
ILE A 244
THR A 304
ILE A 280
 None
 1.42A 1i18A-3f6tA:
undetectable
1i18B-3f6tA:
undetectable		 1i18A-3f6tA:
10.84
1i18B-3f6tA:
10.84
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.
3g3l PUTATIVE
UNCHARACTERIZED
MEMBRANE-ASSOCIATED
PROTEIN

(Bacteroides
fragilis) 		PF12985
(DUF3869) 		5 LEU A 184
ASP A 185
LEU A 188
ILE A 221
THR A 285
 None
 1.27A 1i18A-3g3lA:
undetectable
1i18B-3g3lA:
undetectable		 1i18A-3g3lA:
16.34
1i18B-3g3lA:
16.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g8d BIOTIN CARBOXYLASE

(Escherichia
coli) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 LEU A 215
LEU A 308
THR A 300
ILE A 303
THR A 304
 None
 1.01A 1i18A-3g8dA:
undetectable
1i18B-3g8dA:
undetectable		 1i18A-3g8dA:
12.67
1i18B-3g8dA:
12.67
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.
3h6e CARBOHYDRATE KINASE,
FGGY

(Novosphingobium
aromaticivorans) 		PF00370
(FGGY_N) 		5 LEU A 264
ASP A 285
LEU A 236
ILE A 260
ILE A 383
 None
 1.29A 1i18A-3h6eA:
undetectable
1i18B-3h6eA:
undetectable		 1i18A-3h6eA:
11.46
1i18B-3h6eA:
11.46
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.
3h8f CYTOSOL
AMINOPEPTIDASE

(Pseudomonas
putida) 		PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N) 		5 LEU A 403
LEU A 392
THR A 390
ILE A 465
THR A 488
 None
 1.29A 1i18A-3h8fA:
undetectable
1i18B-3h8fA:
undetectable		 1i18A-3h8fA:
12.55
1i18B-3h8fA:
12.55
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.
3mjq UNCHARACTERIZED
PROTEIN

(Desulfitobacterium
hafniense) 		PF13426
(PAS_9) 		5 LEU A  63
LEU A  60
ILE A  47
THR A  48
ILE A 104
 None
 1.30A 1i18A-3mjqA:
undetectable
1i18B-3mjqA:
undetectable		 1i18A-3mjqA:
20.16
1i18B-3mjqA:
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.
3odp PUTATIVE
TAGATOSE-6-PHOSPHATE
KETOSE/ALDOSE
ISOMERASE

(Clostridium
novyi) 		PF01380
(SIS) 		5 CYH A 187
LEU A 188
THR A  34
ILE A  37
ILE A 142
 None
 1.29A 1i18A-3odpA:
undetectable
1i18B-3odpA:
undetectable		 1i18A-3odpA:
13.88
1i18B-3odpA:
13.88
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.
3oet ERYTHRONATE-4-PHOSPH
ATE DEHYDROGENASE

(Salmonella
enterica) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C)
PF11890
(DUF3410) 		5 LEU A 304
ASP A 305
LEU A 309
THR A 299
ILE A 298
 None
 1.26A 1i18A-3oetA:
undetectable
1i18B-3oetA:
undetectable		 1i18A-3oetA:
15.30
1i18B-3oetA:
15.30
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.
3omn CYTOCHROME C
OXIDASE, AA3 TYPE,
SUBUNIT I

(Rhodobacter
sphaeroides) 		PF00115
(COX1) 		5 LEU A 401
ASP A 407
THR A 352
ILE A 355
PHE A 420
 HEA  A   2 (-3.8A)
HEA  A   2 (-2.5A)
HEA  A   2 (-4.2A)
None
HEA  A   2 ( 4.0A)
 1.34A 1i18A-3omnA:
undetectable
1i18B-3omnA:
undetectable		 1i18A-3omnA:
10.53
1i18B-3omnA:
10.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p2n 3,6-ANHYDRO-ALPHA-L-
GALACTOSIDASE

(Zobellia
galactanivorans) 		PF04616
(Glyco_hydro_43) 		5 LEU A 373
LEU A 359
ILE A 311
THR A 333
ILE A 324
 None
 1.25A 1i18A-3p2nA:
undetectable
1i18B-3p2nA:
undetectable		 1i18A-3p2nA:
11.30
1i18B-3p2nA:
11.30
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.
3p52 NH(3)-DEPENDENT
NAD(+) SYNTHETASE

(Campylobacter
jejuni) 		PF02540
(NAD_synthase) 		5 LEU A  28
LEU A  30
ILE A  34
PHE A 151
ILE A 154
 None
 1.32A 1i18A-3p52A:
undetectable
1i18B-3p52A:
undetectable		 1i18A-3p52A:
16.67
1i18B-3p52A:
16.67
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.
3pl0 UNCHARACTERIZED
PROTEIN

(Methylibium
petroleiphilum) 		PF10014
(2OG-Fe_Oxy_2) 		5 LEU A 209
LEU A 202
ILE A 177
THR A 239
PHE A 130
 None
 1.39A 1i18A-3pl0A:
undetectable
1i18B-3pl0A:
undetectable		 1i18A-3pl0A:
17.79
1i18B-3pl0A:
17.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r24 2'-O-METHYL
TRANSFERASE

(Severe acute
respiratory
syndrome-related
coronavirus) 		PF06460
(NSP13) 		5 LEU A 180
LEU A 153
ILE A 128
THR A 191
ILE A 207
 None
 1.41A 1i18A-3r24A:
undetectable
1i18B-3r24A:
undetectable		 1i18A-3r24A:
14.24
1i18B-3r24A:
14.24
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.
3r7w GTP-BINDING PROTEIN
GTR1

(Saccharomyces
cerevisiae) 		PF04670
(Gtr1_RagA) 		5 CYH A 284
LEU A 207
LEU A 193
ILE A 199
ILE A 302
 None
 1.32A 1i18A-3r7wA:
undetectable
1i18B-3r7wA:
undetectable		 1i18A-3r7wA:
15.72
1i18B-3r7wA:
15.72
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.
3sdq ALPHA-BISABOLENE
SYNTHASE

(Abies grandis) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		5 ASP A 566
LEU A 565
ILE A 606
PHE A 555
THR A 556
 None
 1.41A 1i18A-3sdqA:
undetectable
1i18B-3sdqA:
undetectable		 1i18A-3sdqA:
8.19
1i18B-3sdqA:
8.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tr1 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE

(Coxiella
burnetii) 		PF00275
(EPSP_synthase) 		5 LEU A  29
LEU A 176
THR A 197
PHE A  43
ILE A  23
 None
 1.33A 1i18A-3tr1A:
undetectable
1i18B-3tr1A:
undetectable		 1i18A-3tr1A:
12.10
1i18B-3tr1A:
12.10
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.
3tz6 ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		5 LEU A  21
LEU A 332
THR A 334
ILE A  92
ILE A   5
 None
 1.32A 1i18A-3tz6A:
undetectable
1i18B-3tz6A:
undetectable		 1i18A-3tz6A:
16.56
1i18B-3tz6A:
16.56
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.
3uo7 G/T
MISMATCH-SPECIFIC
THYMINE DNA
GLYCOSYLASE

(Homo sapiens) 		PF03167
(UDG) 		5 LEU A 132
THR A 264
ILE A 259
PHE A 189
ILE A 137
 None
 1.27A 1i18A-3uo7A:
undetectable
1i18B-3uo7A:
undetectable		 1i18A-3uo7A:
17.50
1i18B-3uo7A:
17.50
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.
3zf8 MANNAN POLYMERASE
COMPLEXES SUBUNIT
MNN9

(Saccharomyces
cerevisiae) 		PF03452
(Anp1) 		5 LEU A 134
LEU A 137
THR A 242
PHE A 126
ILE A 240
 None
 1.10A 1i18A-3zf8A:
undetectable
1i18B-3zf8A:
undetectable		 1i18A-3zf8A:
16.06
1i18B-3zf8A:
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.
4ay7 METHYLCOBALAMIN:
COENZYME M
METHYLTRANSFERASE

(Methanosarcina
mazei) 		PF01208
(URO-D) 		5 LEU A 226
LEU A 239
THR A 237
ILE A 201
ILE A 187
 None
 1.17A 1i18A-4ay7A:
undetectable
1i18B-4ay7A:
undetectable		 1i18A-4ay7A:
15.17
1i18B-4ay7A:
15.17
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.
4e0f RIBOFLAVIN SYNTHASE
SUBUNIT ALPHA

(Brucella
abortus) 		PF00677
(Lum_binding) 		5 LEU A 150
LEU A 164
THR A 172
THR A   3
ILE A   5
 None
 1.26A 1i18A-4e0fA:
11.0
1i18B-4e0fA:
10.7		 1i18A-4e0fA:
24.29
1i18B-4e0fA:
24.29
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.
4f1n KPAGO

(Vanderwaltozyma
polyspora) 		PF02171
(Piwi) 		5 LEU A 959
LEU A 958
ILE A 953
PHE A1000
THR A 998
 None
 1.29A 1i18A-4f1nA:
undetectable
1i18B-4f1nA:
undetectable		 1i18A-4f1nA:
6.85
1i18B-4f1nA:
6.85
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.
4g41 MTA/SAH NUCLEOSIDASE

(Streptococcus
pyogenes) 		PF01048
(PNP_UDP_1) 		5 LEU A  16
LEU A 222
ILE A  71
THR A  35
ILE A  44
 LEU  A  16 ( 0.6A)
LEU  A 222 ( 0.6A)
ILE  A  71 ( 0.7A)
THR  A  35 ( 0.8A)
ILE  A  44 ( 0.5A)
 1.39A 1i18A-4g41A:
undetectable
1i18B-4g41A:
undetectable		 1i18A-4g41A:
18.61
1i18B-4g41A:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gk5 DNA REPAIR PROTEIN
REV1

(Homo sapiens) 		PF16727
(REV1_C) 		5 LEU E1171
LEU E1159
ILE E1232
THR E1177
ILE E1176
 None
 1.32A 1i18A-4gk5E:
undetectable
1i18B-4gk5E:
undetectable		 1i18A-4gk5E:
18.98
1i18B-4gk5E:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4grh AMINODEOXYCHORISMATE
SYNTHASE

(Stenotrophomonas
maltophilia) 		PF00425
(Chorismate_bind)
PF04715
(Anth_synt_I_N) 		5 LEU A 404
ASP A 403
LEU A 402
THR A 360
THR A 390
 None
 1.34A 1i18A-4grhA:
undetectable
1i18B-4grhA:
undetectable		 1i18A-4grhA:
11.93
1i18B-4grhA:
11.93
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.
4i2w PROTEIN UNC-45

(Caenorhabditis
elegans) 		PF11701
(UNC45-central) 		5 LEU A 168
THR A 215
ILE A 216
THR A 205
ILE A 209
 None
 1.24A 1i18A-4i2wA:
undetectable
1i18B-4i2wA:
undetectable		 1i18A-4i2wA:
7.63
1i18B-4i2wA:
7.63
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.
4iss ALLOPHANATE
HYDROLASE

(Kluyveromyces
lactis) 		PF01425
(Amidase) 		5 ASP A 474
LEU A 473
ILE A 188
THR A 468
ILE A 467
 None
 1.31A 1i18A-4issA:
undetectable
1i18B-4issA:
undetectable		 1i18A-4issA:
9.45
1i18B-4issA:
9.45
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.
4jp0 43.8 KDA
INSECTICIDAL CRYSTAL
PROTEIN

(Bacillus
thuringiensis) 		PF05431
(Toxin_10) 		5 LEU A 353
LEU A 356
ILE A 367
THR A 368
THR A 344
 None
 1.16A 1i18A-4jp0A:
undetectable
1i18B-4jp0A:
undetectable		 1i18A-4jp0A:
13.18
1i18B-4jp0A:
13.18
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.
4kdi UBIQUITIN
THIOESTERASE OTU1

(Saccharomyces
cerevisiae) 		no annotation 5 LEU C   3
LEU C  16
ILE C  26
THR C  71
ILE C  72
 None
 1.28A 1i18A-4kdiC:
undetectable
1i18B-4kdiC:
undetectable		 1i18A-4kdiC:
25.00
1i18B-4kdiC:
25.00
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.
4krg PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE
1

(Haemonchus
contortus) 		PF08241
(Methyltransf_11) 		5 LEU A  47
LEU A  69
ILE A  58
THR A 230
ILE A 150
 None
 1.30A 1i18A-4krgA:
undetectable
1i18B-4krgA:
undetectable		 1i18A-4krgA:
11.31
1i18B-4krgA:
11.31
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.
4l15 FIDGETIN-LIKE
PROTEIN 1

(Caenorhabditis
elegans) 		PF00004
(AAA)
PF09336
(Vps4_C) 		5 ASP A 418
LEU A 421
ILE A 435
PHE A 413
ILE A 380
 None
 1.08A 1i18A-4l15A:
undetectable
1i18B-4l15A:
undetectable		 1i18A-4l15A:
14.15
1i18B-4l15A:
14.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mh0 RAP GUANINE
NUCLEOTIDE EXCHANGE
FACTOR 4

(Mus musculus) 		PF00027
(cNMP_binding)
PF00617
(RasGEF)
PF00618
(RasGEF_N) 		5 LEU E 797
LEU E 769
ILE E 805
THR E 717
ILE E 718
 None
 1.37A 1i18A-4mh0E:
undetectable
1i18B-4mh0E:
undetectable		 1i18A-4mh0E:
8.93
1i18B-4mh0E:
8.93
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.
4mp3 PUTATIVE ORNITHINE
CYCLODEAMINASE

(Staphylococcus
aureus) 		PF02423
(OCD_Mu_crystall) 		5 LEU A 304
ASP A 254
LEU A 284
ILE A 292
PHE A 245
 None
 1.31A 1i18A-4mp3A:
undetectable
1i18B-4mp3A:
undetectable		 1i18A-4mp3A:
14.41
1i18B-4mp3A:
14.41
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.
4nuz ENDO-BETA-N-ACETYLGL
UCOSAMINIDASE F2

(Streptococcus
pyogenes) 		no annotation 5 LEU A 518
LEU A 565
ILE A 618
PHE A 573
ILE A 594
 None
 1.39A 1i18A-4nuzA:
undetectable
1i18B-4nuzA:
undetectable		 1i18A-4nuzA:
7.79
1i18B-4nuzA:
7.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ol0 TRANSPORTIN-3

(Homo sapiens) 		PF08389
(Xpo1) 		5 LEU B 376
LEU B 372
ILE B 414
PHE B 442
ILE B 447
 None
 1.37A 1i18A-4ol0B:
undetectable
1i18B-4ol0B:
undetectable		 1i18A-4ol0B:
9.31
1i18B-4ol0B:
9.31
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.
4q6r SPHINGOSINE-1-PHOSPH
ATE LYASE 1

(Homo sapiens) 		PF00282
(Pyridoxal_deC) 		5 LEU A 434
LEU A 453
PHE A 429
THR A 426
ILE A 487
 None
 1.41A 1i18A-4q6rA:
undetectable
1i18B-4q6rA:
undetectable		 1i18A-4q6rA:
11.99
1i18B-4q6rA:
11.99
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.
4xgn 3-HYDROXYACYL-COA
DEHYDROGENASE

(Burkholderia
thailandensis) 		PF00106
(adh_short) 		5 LEU A   9
LEU A  77
ILE A 181
THR A 115
ILE A 119
 None
 1.40A 1i18A-4xgnA:
undetectable
1i18B-4xgnA:
undetectable		 1i18A-4xgnA:
17.58
1i18B-4xgnA:
17.58
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.
4xjx HSDR

(Escherichia
coli) 		PF04313
(HSDR_N)
PF04851
(ResIII)
PF12008
(EcoR124_C) 		5 LEU A 521
THR A 517
ILE A 516
THR A 578
ILE A 654
 None
 1.42A 1i18A-4xjxA:
undetectable
1i18B-4xjxA:
undetectable		 1i18A-4xjxA:
6.08
1i18B-4xjxA:
6.08
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.
4yg8 CHITIN BIOSYNTHESIS
PROTEIN CHS6

(Saccharomyces
cerevisiae) 		PF09295
(ChAPs) 		5 LEU B 250
LEU B 227
THR B 288
ILE B 291
THR B 292
 None
 1.38A 1i18A-4yg8B:
undetectable
1i18B-4yg8B:
undetectable		 1i18A-4yg8B:
8.87
1i18B-4yg8B:
8.87
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.
4zng PROLIDASE

(Lactococcus
lactis) 		no annotation 5 LEU C  44
LEU C  27
ILE C 104
PHE C  47
ILE C  97
 None
 1.31A 1i18A-4zngC:
undetectable
1i18B-4zngC:
undetectable		 1i18A-4zngC:
13.73
1i18B-4zngC:
13.73
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.
5a42 UNCHARACTERIZED
LIPOPROTEIN YFHM

(Escherichia
coli) 		PF00207
(A2M)
PF01835
(A2M_N)
PF07703
(A2M_N_2)
PF11974
(MG1) 		5 LEU A1075
THR A1044
ILE A1022
PHE A1084
THR A1040
 None
 1.25A 1i18A-5a42A:
undetectable
1i18B-5a42A:
undetectable		 1i18A-5a42A:
4.58
1i18B-5a42A:
4.58
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.
5d6s EPOXYQUEUOSINE
REDUCTASE

(Streptococcus
thermophilus) 		PF08331
(DUF1730)
PF13484
(Fer4_16) 		5 LEU A 268
LEU A 265
ILE A 309
THR A 325
ILE A 316
 None
 1.39A 1i18A-5d6sA:
undetectable
1i18B-5d6sA:
undetectable		 1i18A-5d6sA:
15.06
1i18B-5d6sA:
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.
5gnc AVH146

(Phytophthora
sojae) 		no annotation 5 LEU A 288
ASP A 287
THR A 341
THR A 344
THR A 296
 None
 1.25A 1i18A-5gncA:
undetectable
1i18B-5gncA:
undetectable		 1i18A-5gncA:
11.48
1i18B-5gncA:
11.48
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.
5hmm EXODEOXYRIBONUCLEASE

(Escherichia
virus T5) 		PF01367
(5_3_exonuc)
PF02739
(5_3_exonuc_N) 		5 LEU A 262
LEU A 159
ILE A 136
PHE A  74
ILE A 270
 None
 1.11A 1i18A-5hmmA:
undetectable
1i18B-5hmmA:
undetectable		 1i18A-5hmmA:
16.73
1i18B-5hmmA:
16.73
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.
5i8i UREA AMIDOLYASE

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF01425
(Amidase)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 ASP A 474
LEU A 473
ILE A 188
THR A 468
ILE A 467
 None
 1.30A 1i18A-5i8iA:
2.3
1i18B-5i8iA:
2.3		 1i18A-5i8iA:
4.55
1i18B-5i8iA:
4.55
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.
5iy9 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1

(Homo sapiens) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		5 LEU A 640
LEU A 635
ILE A 591
THR A 541
ILE A 676
 None
 1.29A 1i18A-5iy9A:
undetectable
1i18B-5iy9A:
undetectable		 1i18A-5iy9A:
4.69
1i18B-5iy9A:
4.69
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.
5j4r WELO5

(Hapalosiphon
welwitschii) 		no annotation 5 LEU A 178
LEU A 182
PHE A 100
THR A 146
ILE A 138
 None
 1.36A 1i18A-5j4rA:
undetectable
1i18B-5j4rA:
undetectable		 1i18A-5j4rA:
16.67
1i18B-5j4rA:
16.67
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.
5jlc LANOSTEROL 14-ALPHA
DEMETHYLASE

([Candida]
glabrata) 		PF00067
(p450) 		5 CYH A 480
LEU A 367
ILE A 488
PHE A 164
ILE A 171
 None
 1.43A 1i18A-5jlcA:
undetectable
1i18B-5jlcA:
undetectable		 1i18A-5jlcA:
14.45
1i18B-5jlcA:
14.45
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.
5kom PUTATIVE FLUORIDE
ION TRANSPORTER CRCB

(Escherichia
coli) 		PF02537
(CRCB) 		5 CYH A  74
LEU A  77
LEU A  18
THR A  70
ILE A  69
 None
 1.42A 1i18A-5komA:
undetectable
1i18B-5komA:
undetectable		 1i18A-5komA:
25.66
1i18B-5komA:
25.66
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.
5mvh BACCELL_00856

(Bacteroides
cellulosilyticus) 		PF15892
(BNR_4) 		5 LEU A 103
LEU A 125
THR A  80
PHE A 146
ILE A  93
 None
 1.39A 1i18A-5mvhA:
undetectable
1i18B-5mvhA:
undetectable		 1i18A-5mvhA:
11.06
1i18B-5mvhA:
11.06
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.
5opt 40S RIBOSOMAL
PROTEIN S5, PUTATIVE
RIBOSOMAL PROTEIN
S25, PUTATIVE

(Trypanosoma
cruzi) 		no annotation 5 LEU O 155
ILE a  70
THR a  67
THR O  82
ILE O  85
 U  E1990 ( 3.5A)
None
None
None
None
 1.31A 1i18A-5optO:
undetectable
1i18B-5optO:
undetectable		 1i18A-5optO:
20.62
1i18B-5optO:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5owg PCYX_EBK42635

(marine
metagenome) 		no annotation 5 CYH A  71
LEU A  70
LEU A 165
ILE A 172
PHE A 224
 None
 1.09A 1i18A-5owgA:
undetectable
1i18B-5owgA:
undetectable		 1i18A-5owgA:
14.75
1i18B-5owgA:
14.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5t88 PROLYL ENDOPEPTIDASE

(Pyrococcus
furiosus) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		5 LEU A 109
ILE A 137
THR A 123
THR A 145
ILE A 144
 None
None
TRS  A 706 ( 3.9A)
None
TRS  A 706 (-3.6A)
 1.37A 1i18A-5t88A:
undetectable
1i18B-5t88A:
undetectable		 1i18A-5t88A:
11.32
1i18B-5t88A:
11.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u1d ANTIGEN PEPTIDE
TRANSPORTER 1

(Homo sapiens) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane) 		5 LEU A 316
LEU A 317
THR A 328
THR A 331
THR A 446
 None
 1.22A 1i18A-5u1dA:
undetectable
1i18B-5u1dA:
undetectable		 1i18A-5u1dA:
9.50
1i18B-5u1dA:
9.50
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.
5udb CELL DIVISION
CONTROL PROTEIN 6

(Saccharomyces
cerevisiae) 		PF09079
(Cdc6_C)
PF13401
(AAA_22) 		5 ASP 9 487
THR 9 463
ILE 9 464
THR 9 420
ILE 9 417
 None
 1.34A 1i18A-5udb9:
undetectable
1i18B-5udb9:
undetectable		 1i18A-5udb9:
11.11
1i18B-5udb9:
11.11
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.
5xyi 40S RIBOSOMAL
PROTEIN S5-B,
PUTATIVE

(Trichomonas
vaginalis) 		PF00177
(Ribosomal_S7) 		5 LEU F  61
LEU F 140
ILE F  28
PHE F   7
ILE F  98
 None
 1.35A 1i18A-5xyiF:
undetectable
1i18B-5xyiF:
undetectable		 1i18A-5xyiF:
20.20
1i18B-5xyiF:
20.20
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.
5yy3 -

(-) 		no annotation 5 CYH A 221
LEU A 220
LEU A 490
ILE A 485
ILE A 633
 None
 1.40A 1i18A-5yy3A:
undetectable
1i18B-5yy3A:
undetectable		 1i18A-5yy3A:
undetectable
1i18B-5yy3A:
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.
6cn1 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Pseudomonas
putida) 		no annotation 5 LEU A 266
THR A 238
ILE A  18
THR A 257
ILE A 261
 None
 1.42A 1i18A-6cn1A:
undetectable
1i18B-6cn1A:
undetectable		 1i18A-6cn1A:
24.74
1i18B-6cn1A:
24.74
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.
6en3 ENDO-BETA-N-ACETYLGL
UCOSAMINIDASE
F2,MULTIFUNCTIONAL-A
UTOPROCESSING
REPEATS-IN-TOXIN

(Streptococcus
pyogenes;
Vibrio cholerae) 		no annotation 5 LEU A 518
LEU A 565
ILE A 618
PHE A 573
ILE A 594
 None
 1.35A 1i18A-6en3A:
undetectable
1i18B-6en3A:
undetectable		 1i18A-6en3A:
19.59
1i18B-6en3A:
19.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6f7s SERRATE RNA EFFECTOR
MOLECULE
HOMOLOG,SERRATE RNA
EFFECTOR MOLECULE
HOMOLOG

(Homo sapiens) 		no annotation 5 LEU C 612
ASP C 609
LEU C 608
ILE C 515
ILE C 506
 None
 1.35A 1i18A-6f7sC:
undetectable
1i18B-6f7sC:
undetectable		 1i18A-6f7sC:
16.33
1i18B-6f7sC:
16.33
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.
6gsa -

(-) 		no annotation 5 CYH D 426
LEU D 476
ILE D 392
THR D 422
ILE D 418
 None
 1.40A 1i18A-6gsaD:
undetectable
1i18B-6gsaD:
undetectable		 1i18A-6gsaD:
undetectable
1i18B-6gsaD:
undetectable