SIMILAR PATTERNS OF AMINO ACIDS FOR 5TL8_A_X2NA502_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.
1bg6 N-(1-D-CARBOXYLETHYL
)-L-NORVALINE
DEHYDROGENASE

(Arthrobacter
sp. 1C) 		PF02317
(Octopine_DH)
PF02558
(ApbA) 		5 ALA A  32
ALA A 185
ALA A 169
THR A 131
LEU A 104
 None
 1.17A 5tl8A-1bg6A:
undetectable		 5tl8A-1bg6A:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ct8 LONG CHAIN
7C8 FAB FRAGMENT

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ALA B  16
PHE B 146
TYR B 145
LEU B 108
THR B  83
 None
 1.10A 5tl8A-1ct8B:
undetectable		 5tl8A-1ct8B:
22.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1emt IGG ANTIBODY (HEAVY
CHAIN)

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ALA H  16
PHE H 149
TYR H 148
LEU H 111
THR H  87
 None
 1.15A 5tl8A-1emtH:
undetectable		 5tl8A-1emtH:
16.88
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.
1fsk ANTIBODY HEAVY CHAIN
FAB

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ALA C  16
PHE C 151
TYR C 150
LEU C 113
THR C  87
 None
 1.15A 5tl8A-1fskC:
undetectable		 5tl8A-1fskC:
15.85
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.
1fvf SEC1

(Doryteuthis
pealeii) 		PF00995
(Sec1) 		5 PHE A 198
ALA A 199
ALA A   2
ALA A   6
THR A 179
 None
 1.20A 5tl8A-1fvfA:
0.0		 5tl8A-1fvfA:
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.
1h39 SQUALENE--HOPENE
CYCLASE

(Alicyclobacillus
acidocaldarius) 		PF13243
(SQHop_cyclase_C)
PF13249
(SQHop_cyclase_N) 		5 ALA A 317
ALA A 550
THR A 584
LEU A 581
MET A 561
 None
 1.23A 5tl8A-1h39A:
undetectable		 5tl8A-1h39A:
21.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jxi PHOSPHOMETHYLPYRIMID
INE KINASE

(Salmonella
enterica) 		PF08543
(Phos_pyr_kin) 		5 ALA A  32
ALA A  82
ALA A  40
THR A  12
THR A  26
 None
 1.25A 5tl8A-1jxiA:
0.0		 5tl8A-1jxiA:
20.75
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.
1k5d RAN-SPECIFIC
GTPASE-ACTIVATING
PROTEIN

(Homo sapiens) 		PF00638
(Ran_BP1) 		5 PHE B 142
ALA B 148
ALA B  85
MET B  90
THR B 153
 PHE  B 142 ( 1.3A)
ALA  B 148 ( 0.0A)
ALA  B  85 ( 0.0A)
MET  B  90 ( 0.0A)
THR  B 153 ( 0.8A)
 1.25A 5tl8A-1k5dB:
undetectable		 5tl8A-1k5dB:
17.67
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.
1lk3 9D7 HEAVY CHAIN

(Rattus
norvegicus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ALA H  16
PHE H 152
ALA H 174
LEU H 114
THR H  87
 None
 1.17A 5tl8A-1lk3H:
undetectable		 5tl8A-1lk3H:
17.56
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.
1mj8 IMMUNOGLOBULIN
MS6-126

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ALA H  16
PHE H 148
TYR H 147
LEU H 108
THR H  83
 None
 1.11A 5tl8A-1mj8H:
undetectable		 5tl8A-1mj8H:
17.28
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.
1nav HORMONE RECEPTOR
ALPHA 1, THRA1

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 PHE A 232
ALA A 174
PHE A 349
PHE A 363
ALA A 308
 None
 1.19A 5tl8A-1navA:
undetectable		 5tl8A-1navA:
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.
1nr6 CYTOCHROME P450 2C5

(Oryctolagus
cuniculus) 		PF00067
(p450) 		6 ALA A  47
PHE A 114
ALA A 113
ALA A 294
THR A 298
LEU A 359
 None
DIF  A 501 (-4.5A)
DIF  A 501 (-3.6A)
DIF  A 501 ( 3.3A)
HEM  A 500 ( 3.6A)
DIF  A 501 (-4.4A)
 1.38A 5tl8A-1nr6A:
34.9		 5tl8A-1nr6A:
28.71
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.
1q87 39 KDA INITIATOR
BINDING PROTEIN

(Trichomonas
vaginalis) 		PF11422
(IBP39) 		5 PHE A 276
ALA A 212
ALA A 209
LEU A 245
THR A 236
 None
 1.16A 5tl8A-1q87A:
undetectable		 5tl8A-1q87A:
18.24
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.
1qju PROTEIN VP1

(Rhinovirus A) 		PF00073
(Rhv) 		5 PHE 1 118
ALA 1 116
THR 1 208
MET 1 103
THR 1 216
 None
 1.27A 5tl8A-1qju1:
undetectable		 5tl8A-1qju1:
19.05
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.
1qr5 PHOSPHOCARRIER
PROTEIN HPR

(Staphylococcus
carnosus) 		PF00381
(PTS-HPr) 		5 ALA A  71
ALA A  65
LEU A  44
MET A  21
THR A   7
 None
 1.22A 5tl8A-1qr5A:
undetectable		 5tl8A-1qr5A:
13.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1r5l PROTEIN
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)

(Homo sapiens) 		PF00650
(CRAL_TRIO)
PF03765
(CRAL_TRIO_N) 		5 PHE A 237
PHE A 158
ALA A 176
ALA A 180
THR A 184
 None
VIV  A 301 (-3.9A)
None
None
None
 1.24A 5tl8A-1r5lA:
undetectable		 5tl8A-1r5lA:
18.72
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.
1svv THREONINE ALDOLASE

(Leishmania
major) 		PF01212
(Beta_elim_lyase) 		5 PHE A 266
ALA A 190
LEU A 182
MET A 209
THR A  76
 None
 1.16A 5tl8A-1svvA:
undetectable		 5tl8A-1svvA:
23.22
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.
1t3q QUINOLINE
2-OXIDOREDUCTASE
MEDIUM SUBUNIT

(Pseudomonas
putida) 		PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C) 		5 ALA C 148
ALA C 240
ALA C 244
THR C 248
LEU C 213
 None
 1.12A 5tl8A-1t3qC:
undetectable		 5tl8A-1t3qC:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ub7 3-OXOACYL-[ACYL-CARR
IER PROTEIN]
SYNTHASE

(Thermus
thermophilus) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 ALA A  44
PHE A 306
ALA A 218
THR A  36
LEU A 154
 None
 1.26A 5tl8A-1ub7A:
undetectable		 5tl8A-1ub7A:
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.
1w07 ACYL-COA OXIDASE

(Arabidopsis
thaliana) 		PF01756
(ACOX)
PF02770
(Acyl-CoA_dh_M)
PF14749
(Acyl-CoA_ox_N) 		5 ALA A 290
PHE A  16
ALA A  14
THR A 304
LEU A 338
 None
 1.03A 5tl8A-1w07A:
undetectable		 5tl8A-1w07A:
21.07
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.
1wkm METHIONINE
AMINOPEPTIDASE

(Pyrococcus
furiosus) 		PF00557
(Peptidase_M24) 		5 ALA A 110
PHE A  50
ALA A  49
ALA A  92
THR A 294
 None
MET  A1298 (-3.8A)
None
None
None
 1.25A 5tl8A-1wkmA:
undetectable		 5tl8A-1wkmA:
21.59
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.
1x0l HOMOISOCITRATE
DEHYDROGENASE

(Thermus
thermophilus) 		PF00180
(Iso_dh) 		5 ALA A 244
THR A  28
LEU A 285
MET A 283
THR A 275
 None
 1.18A 5tl8A-1x0lA:
undetectable		 5tl8A-1x0lA:
20.34
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.
2bkl PROLYL ENDOPEPTIDASE

(Myxococcus
xanthus) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		5 ALA A 641
ALA A 481
ALA A 479
THR A 448
LEU A 527
 None
 1.25A 5tl8A-2bklA:
undetectable		 5tl8A-2bklA:
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.
2c9e PERIDININ-CHLOROPHYL
L A PROTEIN

(Amphidinium
carterae) 		PF02429
(PCP) 		5 PHE A 109
ALA A 110
PHE A  21
ALA A  30
THR A 114
 PID  A1330 ( 3.5A)
PID  A1331 ( 3.8A)
PID  A1329 (-4.1A)
PID  A1329 (-3.9A)
None
 1.23A 5tl8A-2c9eA:
undetectable		 5tl8A-2c9eA:
20.34
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.
2cb1 O-ACETYL HOMOSERINE
SULFHYDRYLASE

(Thermus
thermophilus) 		PF01053
(Cys_Met_Meta_PP) 		5 TYR A 308
ALA A 316
ALA A 320
LEU A 185
MET A 286
 None
 1.23A 5tl8A-2cb1A:
undetectable		 5tl8A-2cb1A:
23.05
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.
2fex CONSERVED
HYPOTHETICAL PROTEIN

(Agrobacterium
fabrum) 		PF01965
(DJ-1_PfpI) 		5 ALA A  58
PHE A 161
ALA A 153
ALA A 104
THR A  36
 None
 1.26A 5tl8A-2fexA:
undetectable		 5tl8A-2fexA:
16.63
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.
2ffi 2-PYRONE-4,6-DICARBO
XYLIC ACID
HYDROLASE, PUTATIVE

(Pseudomonas
putida) 		PF04909
(Amidohydro_2) 		5 PHE A 277
PHE A 182
ALA A 221
LEU A 231
MET A 232
 None
 1.25A 5tl8A-2ffiA:
undetectable		 5tl8A-2ffiA:
21.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fon PEROXISOMAL ACYL-COA
OXIDASE 1A

(Solanum
lycopersicum) 		PF01756
(ACOX)
PF02770
(Acyl-CoA_dh_M)
PF14749
(Acyl-CoA_ox_N) 		5 ALA A 290
PHE A  16
ALA A  14
THR A 304
LEU A 338
 None
 1.04A 5tl8A-2fonA:
undetectable		 5tl8A-2fonA:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2mqa MINOR AMPULLATE
FIBROIN 1

(Nephila
antipodiana) 		PF12042
(RP1-2) 		5 ALA A  47
PHE A  20
ALA A 116
ALA A 119
THR A  52
 None
 1.23A 5tl8A-2mqaA:
undetectable		 5tl8A-2mqaA:
15.51
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.
2oz4 FAB FRAGMENT, HEAVY
CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ALA H  16
PHE H 147
TYR H 146
LEU H 109
THR H  87
 None
 1.20A 5tl8A-2oz4H:
undetectable		 5tl8A-2oz4H:
17.56
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.
2q9u A-TYPE FLAVOPROTEIN

(Giardia
intestinalis) 		no annotation 5 ALA A 302
PHE A  30
ALA A  91
ALA A  86
THR A 200
 None
NO3  A 501 (-4.7A)
None
None
None
 1.21A 5tl8A-2q9uA:
undetectable		 5tl8A-2q9uA:
22.31
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.
2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE

(Escherichia
coli) 		PF00275
(EPSP_synthase) 		5 PHE A 276
ALA A 277
ALA A 426
ALA A  10
THR A 286
 None
 1.23A 5tl8A-2qfqA:
undetectable		 5tl8A-2qfqA:
22.85
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.
2qyt 2-DEHYDROPANTOATE
2-REDUCTASE

(Porphyromonas
gingivalis) 		PF02558
(ApbA)
PF08546
(ApbA_C) 		5 PHE A 199
ALA A 117
LEU A 298
MET A 300
MET A 304
 None
 1.04A 5tl8A-2qytA:
undetectable		 5tl8A-2qytA:
22.03
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.
2vos FOLYLPOLYGLUTAMATE
SYNTHASE PROTEIN
FOLC

(Mycobacterium
tuberculosis) 		PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		5 ALA A  81
ALA A 395
ALA A 365
THR A 367
LEU A 341
 None
 1.26A 5tl8A-2vosA:
undetectable		 5tl8A-2vosA:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vr3 CLUMPING FACTOR A

(Staphylococcus
aureus) 		PF10425
(SdrG_C_C) 		5 ALA A 528
TYR A 261
ALA A 361
ALA A 353
LEU A 283
 None
 1.23A 5tl8A-2vr3A:
undetectable		 5tl8A-2vr3A:
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.
2vxo GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG]

(Homo sapiens) 		PF00117
(GATase)
PF00958
(GMP_synt_C)
PF02540
(NAD_synthase) 		5 ALA A 299
PHE A 438
ALA A 595
ALA A 591
THR A 587
 None
 1.11A 5tl8A-2vxoA:
undetectable		 5tl8A-2vxoA:
21.66
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.
3bqu 3H6 FAB HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ALA D  16
PHE D 157
TYR D 156
LEU D 117
THR D  87
 None
 1.16A 5tl8A-3bquD:
undetectable		 5tl8A-3bquD:
17.23
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.
3c3j PUTATIVE
TAGATOSE-6-PHOSPHATE
KETOSE/ALDOSE
ISOMERASE

(Escherichia
coli) 		PF01380
(SIS) 		5 ALA A  10
PHE A 281
ALA A 239
ALA A 243
MET A 352
 None
 1.24A 5tl8A-3c3jA:
2.3		 5tl8A-3c3jA:
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.
3d85 FAB OF ANTIBODY
7G10, HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ALA B  16
PHE B 148
TYR B 147
LEU B 110
THR B  87
 None
 1.09A 5tl8A-3d85B:
undetectable		 5tl8A-3d85B:
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.
3if2 AMINOTRANSFERASE

(Psychrobacter
arcticus) 		PF00155
(Aminotran_1_2) 		5 ALA A 290
PHE A 251
ALA A 315
LEU A 110
THR A 104
 None
 1.25A 5tl8A-3if2A:
undetectable		 5tl8A-3if2A:
21.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ksw STEROL 14-ALPHA
DEMETHYLASE

(Trypanosoma
cruzi) 		PF00067
(p450) 		5 ALA A 287
ALA A 291
THR A 295
MET A 358
MET A 360
 VNF  A 490 ( 3.9A)
VNF  A 490 ( 4.0A)
VNF  A 490 ( 4.0A)
None
None
 1.18A 5tl8A-3kswA:
38.1		 5tl8A-3kswA:
36.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ksw STEROL 14-ALPHA
DEMETHYLASE

(Trypanosoma
cruzi) 		PF00067
(p450) 		5 PHE A  48
ALA A 291
LEU A 356
MET A 358
MET A 360
 None
VNF  A 490 ( 4.0A)
None
None
None
 1.11A 5tl8A-3kswA:
38.1		 5tl8A-3kswA:
36.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ksw STEROL 14-ALPHA
DEMETHYLASE

(Trypanosoma
cruzi) 		PF00067
(p450) 		5 PHE A  48
ALA A 291
THR A 295
MET A 358
MET A 360
 None
VNF  A 490 ( 4.0A)
VNF  A 490 ( 4.0A)
None
None
 1.08A 5tl8A-3kswA:
38.1		 5tl8A-3kswA:
36.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l4d STEROL 14-ALPHA
DEMETHYLASE

(Leishmania
infantum) 		PF00067
(p450) 		7 PHE A  48
ALA A 286
ALA A 290
THR A 294
LEU A 355
MET A 357
MET A 359
 None
TPF  A 490 (-3.4A)
TPF  A 490 ( 3.4A)
TPF  A 490 ( 3.5A)
TPF  A 490 (-4.4A)
None
None
 1.09A 5tl8A-3l4dA:
46.7		 5tl8A-3l4dA:
36.02
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l4d STEROL 14-ALPHA
DEMETHYLASE

(Leishmania
infantum) 		PF00067
(p450) 		9 PHE A 104
PHE A 109
TYR A 115
ALA A 286
ALA A 290
THR A 294
LEU A 355
MET A 357
MET A 359
 None
TPF  A 490 (-4.5A)
HEM  A 481 ( 4.9A)
TPF  A 490 (-3.4A)
TPF  A 490 ( 3.4A)
TPF  A 490 ( 3.5A)
TPF  A 490 (-4.4A)
None
None
 1.03A 5tl8A-3l4dA:
46.7		 5tl8A-3l4dA:
36.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lxy 4-HYDROXYTHREONINE-4
-PHOSPHATE
DEHYDROGENASE

(Yersinia pestis) 		PF04166
(PdxA) 		5 PHE A 114
ALA A  46
ALA A  48
LEU A  74
THR A 119
 None
 1.25A 5tl8A-3lxyA:
undetectable		 5tl8A-3lxyA:
19.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sr6 XANTHINE
DEHYDROGENASE/OXIDAS
E

(Bos taurus) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 PHE C1013
PHE C1009
ALA C1079
THR C 803
LEU C 648
 None
None
RMO  C1317 ( 3.6A)
None
None
 1.13A 5tl8A-3sr6C:
undetectable		 5tl8A-3sr6C:
20.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tt1 MOUSE MONOCLONAL
1GG2A FAB FRAGMENT,
KAPPA LIGHT CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ALA H  16
PHE H 154
TYR H 153
THR H  41
THR H  87
 None
 1.19A 5tl8A-3tt1H:
undetectable		 5tl8A-3tt1H:
18.53
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.
3tt3 MOUSE MONOCLONAL
1GG1 FAB FRAGMENT,
KAPPA LIGHT CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ALA H  16
PHE H 152
TYR H 151
LEU H 114
THR H  87
 None
 1.16A 5tl8A-3tt3H:
undetectable		 5tl8A-3tt3H:
21.20
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.
3ujt AB-52 HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ALA H  16
PHE H 146
TYR H 145
LEU H 108
THR H  83
 None
 1.17A 5tl8A-3ujtH:
undetectable		 5tl8A-3ujtH:
15.42
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.
3zgq INTERFERON-INDUCED
PROTEIN WITH
TETRATRICOPEPTIDE
REPEATS 5

(Homo sapiens) 		PF07719
(TPR_2)
PF13181
(TPR_8)
PF13374
(TPR_10)
PF13424
(TPR_12) 		5 ALA A 101
ALA A 161
ALA A 159
LEU A  24
THR A  96
 None
 0.92A 5tl8A-3zgqA:
0.5		 5tl8A-3zgqA:
23.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zyt ESTERASE A

(Paenarthrobacter
nitroguajacolicus) 		PF00144
(Beta-lactamase) 		5 ALA A 372
PHE A  10
ALA A 255
ALA A 259
THR A 263
 None
 1.03A 5tl8A-3zytA:
undetectable		 5tl8A-3zytA:
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.
4cp8 ALLOPHANATE
HYDROLASE

(Pseudomonas sp.
ADP) 		PF01425
(Amidase) 		5 ALA A 218
ALA A 174
ALA A 172
THR A 133
THR A 140
 None
None
None
None
MLI  A1466 ( 4.9A)
 1.22A 5tl8A-4cp8A:
undetectable		 5tl8A-4cp8A:
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.
4dnx SULFATE
ADENYLYLTRANSFERASE

(Allochromatium
vinosum) 		PF01747
(ATP-sulfurylase)
PF14306
(PUA_2) 		5 PHE A 255
ALA A 251
ALA A 277
ALA A 281
MET A 216
 None
 1.07A 5tl8A-4dnxA:
undetectable		 5tl8A-4dnxA:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4e7w GLYCOGEN SYNTHASE
KINASE 3

(Ustilago maydis) 		PF00069
(Pkinase) 		5 PHE A 320
ALA A 294
THR A 133
MET A 331
THR A 119
 None
 1.08A 5tl8A-4e7wA:
undetectable		 5tl8A-4e7wA:
24.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4g3j STEROL
14-ALPHA-DEMETHYLASE

(Trypanosoma
brucei) 		PF00067
(p450) 		9 PHE A  48
PHE A 110
TYR A 116
ALA A 287
ALA A 291
THR A 295
LEU A 356
MET A 358
MET A 360
 VNT  A 502 (-4.2A)
VNT  A 502 (-4.4A)
HEM  A 501 ( 4.5A)
VNT  A 502 ( 3.9A)
HEM  A 501 ( 3.5A)
VNT  A 502 ( 3.2A)
VNT  A 502 ( 4.5A)
VNT  A 502 (-4.9A)
VNT  A 502 (-4.5A)
 1.26A 5tl8A-4g3jA:
29.2		 5tl8A-4g3jA:
36.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4g3j STEROL
14-ALPHA-DEMETHYLASE

(Trypanosoma
brucei) 		PF00067
(p450) 		8 PHE A 105
PHE A 110
TYR A 116
ALA A 287
ALA A 291
THR A 295
LEU A 356
MET A 360
 VNT  A 502 (-4.8A)
VNT  A 502 (-4.4A)
HEM  A 501 ( 4.5A)
VNT  A 502 ( 3.9A)
HEM  A 501 ( 3.5A)
VNT  A 502 ( 3.2A)
VNT  A 502 ( 4.5A)
VNT  A 502 (-4.5A)
 0.90A 5tl8A-4g3jA:
29.2		 5tl8A-4g3jA:
36.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4g3j STEROL
14-ALPHA-DEMETHYLASE

(Trypanosoma
brucei) 		PF00067
(p450) 		6 PHE A 110
TYR A 103
ALA A 287
ALA A 291
THR A 295
LEU A 356
 VNT  A 502 (-4.4A)
VNT  A 502 ( 4.8A)
VNT  A 502 ( 3.9A)
HEM  A 501 ( 3.5A)
VNT  A 502 ( 3.2A)
VNT  A 502 ( 4.5A)
 1.05A 5tl8A-4g3jA:
29.2		 5tl8A-4g3jA:
36.32
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.
4gn2 OXACILLINASE

(Pseudomonas
aeruginosa) 		PF00905
(Transpeptidase) 		5 PHE A 240
ALA A 241
ALA A  82
THR A 106
THR A  64
 None
 1.13A 5tl8A-4gn2A:
undetectable		 5tl8A-4gn2A:
17.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hou INTERFERON-INDUCED
PROTEIN WITH
TETRATRICOPEPTIDE
REPEATS 1

(Homo sapiens) 		PF13181
(TPR_8)
PF13424
(TPR_12) 		5 ALA A 102
ALA A 162
ALA A 160
LEU A  25
THR A  97
 None
 1.10A 5tl8A-4houA:
undetectable		 5tl8A-4houA:
19.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4iwm UPF0135 PROTEIN
MJ0927

(Methanocaldococcus
jannaschii) 		PF01784
(NIF3) 		5 PHE A  18
ALA A  19
ALA A 219
LEU A 117
THR A 104
 None
 0.80A 5tl8A-4iwmA:
undetectable		 5tl8A-4iwmA:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jre IMMUNOGLOBULIN
GAMMA-2A, HEAVY
CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 PHE B  95
PHE B 151
TYR B 180
ALA B 119
THR B  88
 None
 1.24A 5tl8A-4jreB:
undetectable		 5tl8A-4jreB:
17.13
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.
4kjd INTESTINAL-TYPE
ALKALINE PHOSPHATASE
1

(Rattus
norvegicus) 		PF00245
(Alk_phosphatase) 		5 ALA A 261
ALA A 139
ALA A 136
LEU A 299
THR A 244
 None
 1.26A 5tl8A-4kjdA:
undetectable		 5tl8A-4kjdA:
22.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mnr PEPTIDOGLYCAN
GLYCOSYLTRANSFERASE

(Eggerthella
lenta) 		PF00905
(Transpeptidase) 		5 PHE A 352
PHE A 269
ALA A 128
ALA A 143
LEU A 110
 None
 1.15A 5tl8A-4mnrA:
undetectable		 5tl8A-4mnrA:
19.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mrm GAMMA-AMINOBUTYRIC
ACID TYPE B RECEPTOR
SUBUNIT 1

(Homo sapiens) 		PF01094
(ANF_receptor) 		5 ALA A 139
ALA A  74
THR A 169
LEU A 148
THR A 134
 None
 1.15A 5tl8A-4mrmA:
undetectable		 5tl8A-4mrmA:
22.63
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.
4mz0 CURL

(Moorea
producens) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 PHE A 537
ALA A 233
ALA A 231
THR A 154
LEU A 149
 None
 1.21A 5tl8A-4mz0A:
undetectable		 5tl8A-4mz0A:
18.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nnq PUTATIVE ENOYL-COA
HYDRATASE

(Streptomyces
atroolivaceus) 		PF00378
(ECH_1) 		5 ALA A 195
PHE A  66
ALA A  37
ALA A  40
LEU A  57
 None
 1.22A 5tl8A-4nnqA:
undetectable		 5tl8A-4nnqA:
17.62
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.
4oii HEAVY CHAIN OF FAB
FRAGMENT OF 22NS1
ANTIBODY

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ALA H  16
PHE H 148
TYR H 147
LEU H 108
THR H  83
 None
 1.10A 5tl8A-4oiiH:
undetectable		 5tl8A-4oiiH:
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.
4oko RAPID ENCYSTMENT
PHENOTYPE PROTEIN 34
KDA

(Francisella
tularensis) 		PF00246
(Peptidase_M14) 		5 ALA A 295
ALA A 150
ALA A 153
LEU A  80
MET A 166
 None
 1.12A 5tl8A-4okoA:
undetectable		 5tl8A-4okoA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oon PENICILLIN-BINDING
PROTEIN 1A

(Pseudomonas
aeruginosa) 		PF00905
(Transpeptidase)
PF00912
(Transgly)
PF17092
(PCB_OB) 		5 ALA A 738
PHE A 544
ALA A 665
THR A 669
THR A 696
 None
None
None
None
2U4  A 901 (-3.7A)
 1.22A 5tl8A-4oonA:
undetectable		 5tl8A-4oonA:
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.
4oqj PKS

(Streptomyces
albus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 PHE A  52
ALA A  75
ALA A 259
ALA A 216
THR A 371
 None
 1.16A 5tl8A-4oqjA:
undetectable		 5tl8A-4oqjA:
19.19
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.
4p47 TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Ochrobactrum
anthropi) 		PF03480
(DctP) 		5 PHE A  34
ALA A  35
ALA A 107
ALA A 104
LEU A 136
 None
 1.27A 5tl8A-4p47A:
undetectable		 5tl8A-4p47A:
22.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p5p THIJ/PFPI FAMILY
PROTEIN

(Francisella
tularensis) 		PF01965
(DJ-1_PfpI) 		5 PHE A 215
ALA A 212
PHE A 108
LEU A   5
THR A  29
 None
 0.87A 5tl8A-4p5pA:
undetectable		 5tl8A-4p5pA:
17.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4plj 8G12 HEAVY CHAIN

(Mus musculus) 		no annotation 5 ALA H  14
PHE H 156
TYR H 155
LEU H 116
THR H  85
 None
 1.10A 5tl8A-4pljH:
undetectable		 5tl8A-4pljH:
17.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rhz CRY23AA1
CRY37AA1

(Bacillus
thuringiensis) 		PF03318
(ETX_MTX2)
no annotation 		5 TYR B 121
ALA B  29
THR A 247
LEU A 249
THR A  55
 None
 1.16A 5tl8A-4rhzB:
undetectable		 5tl8A-4rhzB:
15.45
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.
4rye D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Mycobacterium
tuberculosis) 		PF00768
(Peptidase_S11) 		5 ALA A  42
ALA A 189
ALA A 194
THR A 197
THR A 240
 None
 1.15A 5tl8A-4ryeA:
undetectable		 5tl8A-4ryeA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u6h HEAVY CHAIN OF
MURINE ANTI-VACCINIA
L1 IGG2A ANTIBODY
M12B9

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ALA A  16
PHE A 152
TYR A 151
LEU A 114
THR A  87
 None
 1.10A 5tl8A-4u6hA:
undetectable		 5tl8A-4u6hA:
17.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4y1g UNCHARACTERIZED
PROTEIN SAV1875

(Staphylococcus
aureus) 		PF01965
(DJ-1_PfpI) 		5 ALA A  39
ALA A  28
ALA A  24
LEU A  69
THR A  52
 None
 1.22A 5tl8A-4y1gA:
undetectable		 5tl8A-4y1gA:
18.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zrs ESTERASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 ALA A 282
ALA A 162
THR A 218
LEU A 222
MET A 223
 None
None
None
GOL  A 301 (-4.5A)
None
 1.23A 5tl8A-4zrsA:
undetectable		 5tl8A-4zrsA:
21.21
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.
5cma ANTIBODY CH8H9 FAB
HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ALA B  16
PHE B 151
TYR B 150
LEU B 113
THR B  87
 None
 1.11A 5tl8A-5cmaB:
undetectable		 5tl8A-5cmaB:
18.52
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.
5dk6 5'-METHYLTHIOADENOSI
NE/S-ADENOSYLHOMOCYS
TEINE NUCLEOSIDASE

(Colwellia
psychrerythraea) 		PF01048
(PNP_UDP_1) 		5 ALA A 146
ALA A 187
ALA A 183
THR A 153
THR A 148
 None
 1.18A 5tl8A-5dk6A:
undetectable		 5tl8A-5dk6A:
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.
5f2o FATTY ACID
O-METHYLTRANSFERASE

(Mycobacterium
marinum) 		PF03492
(Methyltransf_7) 		5 PHE A 336
PHE A 222
TYR A 224
ALA A 258
ALA A 154
 None
None
5UF  A 401 ( 4.3A)
None
5UF  A 401 ( 4.9A)
 1.10A 5tl8A-5f2oA:
undetectable		 5tl8A-5f2oA:
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.
5h5v FLAGELLAR
HOOK-ASSOCIATED
PROTEIN 2

(Escherichia
coli) 		PF02465
(FliD_N)
PF07195
(FliD_C) 		5 PHE A 289
ALA A  53
THR A  55
LEU A 398
THR A 388
 None
 1.10A 5tl8A-5h5vA:
undetectable		 5tl8A-5h5vA:
21.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hs1 LANOSTEROL 14-ALPHA
DEMETHYLASE

(Saccharomyces
cerevisiae) 		PF00067
(p450) 		5 PHE A 134
TYR A 140
THR A 318
LEU A 380
THR A 507
 VOR  A 602 (-4.7A)
HEM  A 601 (-4.3A)
HEM  A 601 (-3.4A)
VOR  A 602 (-4.0A)
None
 0.86A 5tl8A-5hs1A:
43.0		 5tl8A-5hs1A:
32.59
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.
5ic7 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Chaetomium
thermophilum) 		no annotation 5 ALA A 276
ALA A 307
ALA A 305
THR A 266
LEU A 613
 None
 1.25A 5tl8A-5ic7A:
undetectable		 5tl8A-5ic7A:
22.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5jlc LANOSTEROL 14-ALPHA
DEMETHYLASE

([Candida]
glabrata) 		PF00067
(p450) 		5 PHE A 135
TYR A 141
THR A 319
LEU A 381
THR A 510
 1YN  A 602 ( 4.6A)
HEM  A 601 (-4.2A)
HEM  A 601 ( 3.5A)
1YN  A 602 ( 4.7A)
1YN  A 602 (-3.8A)
 0.93A 5tl8A-5jlcA:
42.4		 5tl8A-5jlcA:
32.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ldf GLUTAMINE SYNTHETASE

(Salmonella
enterica) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		5 PHE A 126
ALA A 275
ALA A 121
THR A 118
LEU A 379
 None
 1.13A 5tl8A-5ldfA:
undetectable		 5tl8A-5ldfA:
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.
5mue ALPHA-TOCOPHEROL
TRANSFER PROTEIN

(Homo sapiens) 		PF00650
(CRAL_TRIO)
PF03765
(CRAL_TRIO_N) 		5 PHE A 237
PHE A 158
ALA A 176
ALA A 180
THR A 184
 None
VIV  A 302 (-3.9A)
None
None
None
 1.25A 5tl8A-5mueA:
undetectable		 5tl8A-5mueA:
17.91
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.
5n0g PRECORRIN-8X
METHYLMUTASE

(Rhodobacter
capsulatus) 		no annotation 5 ALA A 119
ALA A  56
ALA A 177
LEU A 145
MET A 147
 None
 1.08A 5tl8A-5n0gA:
undetectable		 5tl8A-5n0gA:
10.64
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.
5ndl CRH-LIKE PROTEIN

(Aspergillus
fumigatus) 		no annotation 5 PHE A 137
PHE A  72
ALA A  70
LEU A 202
THR A 134
 NAG  A 304 ( 4.3A)
None
None
None
None
 1.16A 5tl8A-5ndlA:
undetectable		 5tl8A-5ndlA:
10.47
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.
5nhb XYLOSE ISOMERASE

(Piromyces sp.
E2) 		no annotation 5 ALA A 183
ALA A 363
ALA A 365
MET A  91
THR A 334
 None
 0.84A 5tl8A-5nhbA:
undetectable		 5tl8A-5nhbA:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tj6 HIGH CONDUCTANCE
CALCIUM-ACTIVATED
POTASSIUM CHANNEL

(Aplysia
californica) 		PF00520
(Ion_trans)
PF03493
(BK_channel_a) 		5 PHE A 768
ALA A 765
TYR A1025
ALA A 920
THR A 952
 None
 1.22A 5tl8A-5tj6A:
undetectable		 5tl8A-5tj6A:
18.38
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.
5tqa DH270.6 FAB HEAVY
CHAIN

(Homo sapiens) 		no annotation 5 ALA H  16
PHE H 160
TYR H 159
LEU H 122
THR H  87
 None
 1.25A 5tl8A-5tqaH:
undetectable		 5tl8A-5tqaH:
19.36
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.
5ybp PRHA

(Penicillium
brasilianum) 		no annotation 5 PHE A 244
PHE A 160
TYR A 206
ALA A 166
ALA A 216
 None
None
None
None
AKG  A 302 (-3.3A)
 1.09A 5tl8A-5ybpA:
undetectable		 5tl8A-5ybpA:
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.
5ybp PRHA

(Penicillium
brasilianum) 		no annotation 5 PHE A 244
PHE A 160
TYR A 206
ALA A 166
THR A  70
 None
 1.25A 5tl8A-5ybpA:
undetectable		 5tl8A-5ybpA:
9.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6ay4 CYP51, STEROL
14ALPHA-DEMETHYLASE

(Naegleria
fowleri) 		no annotation 12 PHE A  53
ALA A  54
PHE A 109
PHE A 114
TYR A 120
ALA A 289
ALA A 293
THR A 297
LEU A 358
MET A 360
MET A 362
THR A 465
 None
None
None
TPF  A 506 (-4.4A)
None
TPF  A 506 (-3.5A)
TPF  A 506 ( 3.2A)
HEM  A 501 (-3.4A)
TPF  A 506 ( 4.4A)
None
None
None
 0.49A 5tl8A-6ay4A:
63.0		 5tl8A-6ay4A:
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.
6c6k INTERFERON-INDUCED
PROTEIN WITH
TETRATRICOPEPTIDE
REPEATS 1

(Homo sapiens) 		no annotation 5 ALA A 104
ALA A 164
ALA A 162
LEU A  27
THR A  99
 None
 1.06A 5tl8A-6c6kA:
undetectable		 5tl8A-6c6kA:
11.89
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.
6c7s PUTATIVE RIFAMPIN
MONOOXYGENASE

(Nocardia
farcinica) 		no annotation 5 PHE A  75
ALA A  76
ALA A 263
ALA A 278
LEU A 291
 None
 1.21A 5tl8A-6c7sA:
undetectable		 5tl8A-6c7sA:
17.00
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.
6eyn -

(-) 		no annotation 5 ALA H  16
PHE H 152
TYR H 151
LEU H 114
THR H  87
 None
 1.11A 5tl8A-6eynH:
undetectable		 5tl8A-6eynH:
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.
6fb3 TENEURIN-2

(Gallus gallus) 		no annotation 5 ALA A2317
PHE A2350
TYR A2364
ALA A2115
THR A2315
 None
 1.07A 5tl8A-6fb3A:
undetectable		 5tl8A-6fb3A:
10.85