SIMILAR PATTERNS OF AMINO ACIDS FOR 5M8R_B_MMSB514_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.
1ddk IMP-1 METALLO
BETA-LACTAMASE

(Pseudomonas
aeruginosa) 		PF00753
(Lactamase_B) 		4 HIS A 197
HIS A 139
HIS A  77
SER A  82
 ZN  A 501 ( 3.4A)
ZN  A 500 (-3.3A)
ZN  A 500 (-3.4A)
None
 1.02A 5m8rB-1ddkA:
undetectable		 5m8rB-1ddkA:
20.55
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.
1ex9 LACTONIZING LIPASE

(Pseudomonas
aeruginosa) 		PF00561
(Abhydrolase_1) 		4 SER A 211
HIS A 251
LEU A 252
SER A  82
 CA  A 286 ( 4.5A)
OCP  A 382 (-3.9A)
None
OCP  A 382 (-1.5A)
 0.95A 5m8rB-1ex9A:
undetectable		 5m8rB-1ex9A:
22.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1flc HAEMAGGLUTININ-ESTER
ASE-FUSION
GLYCOPROTEIN

(Influenza C
virus) 		PF02710
(Hema_HEFG)
PF03996
(Hema_esterase) 		4 HIS A 218
LEU A 217
VAL A 220
SER A 300
 None
 0.95A 5m8rB-1flcA:
undetectable		 5m8rB-1flcA:
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.
1fwx NITROUS OXIDE
REDUCTASE

(Paracoccus
denitrificans) 		PF13473
(Cupredoxin_1) 		4 HIS A 437
HIS A  80
ASN A  98
HIS A 128
 CUZ  A4801 (-3.0A)
CUZ  A4801 (-3.3A)
None
CUZ  A4801 (-3.2A)
 0.95A 5m8rB-1fwxA:
0.0		 5m8rB-1fwxA:
20.81
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.
1hcy ARTHROPODAN
HEMOCYANIN

(Panulirus
interruptus) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		4 HIS A 198
HIS A 344
ASN A 345
HIS A 348
 CU  A 665 (-3.1A)
CU  A 666 (-3.1A)
None
CU  A 666 (-3.8A)
 0.66A 5m8rB-1hcyA:
8.1		 5m8rB-1hcyA:
21.56
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.
1js8 HEMOCYANIN

(Enteroctopus
dofleini) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		4 HIS A2562
HIS A2671
ASN A2672
HIS A2675
 CUO  A 888 (-3.4A)
CUO  A 888 (-3.4A)
None
CUO  A 888 (-3.3A)
 0.40A 5m8rB-1js8A:
21.9		 5m8rB-1js8A:
22.29
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.
1kae HISTIDINOL
DEHYDROGENASE

(Escherichia
coli) 		PF00815
(Histidinol_dh) 		4 HIS A 262
SER A 347
HIS A 367
SER A 140
 ZN  A1101 ( 3.3A)
None
HSO  A1001 (-3.5A)
HSO  A1001 (-3.5A)
 1.00A 5m8rB-1kaeA:
undetectable		 5m8rB-1kaeA:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		4 SER A 104
ASN A 106
LEU A 585
SER A 590
 None
None
MGD  A1018 (-4.0A)
None
 0.91A 5m8rB-1kqfA:
0.0		 5m8rB-1kqfA:
17.80
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.
1lla HEMOCYANIN (SUBUNIT
TYPE II)

(Limulus
polyphemus) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		5 HIS A 177
HIS A 324
ASN A 325
HIS A 328
SER A 354
 CU  A 629 (-3.2A)
CU  A 630 (-3.3A)
None
CU  A 630 (-3.2A)
None
 0.69A 5m8rB-1llaA:
7.7		 5m8rB-1llaA:
20.76
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.
1lnl HEMOCYANIN

(Rapana venosa) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		4 HIS A  61
HIS A 181
ASN A 182
HIS A 185
 CU  A5001 (-3.6A)
CU  A5012 (-3.4A)
None
CU  A5012 (-3.2A)
 0.49A 5m8rB-1lnlA:
20.1		 5m8rB-1lnlA:
21.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nmw PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
NIMA-INTERACTING 1

(Homo sapiens) 		PF00639
(Rotamase) 		4 SER A 147
HIS A  59
HIS A 157
VAL A  62
 None
 0.95A 5m8rB-1nmwA:
undetectable		 5m8rB-1nmwA:
14.05
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.
1qni NITROUS-OXIDE
REDUCTASE

(Marinobacter
hydrocarbonoclasticus) 		no annotation 4 HIS A 437
HIS A  80
ASN A  98
HIS A 128
 CUZ  A 801 (-3.0A)
CUZ  A 801 (-3.3A)
None
CUZ  A 801 (-3.1A)
 0.95A 5m8rB-1qniA:
undetectable		 5m8rB-1qniA:
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.
1vph HYPOTHETICAL PROTEIN
SSO2532

(Sulfolobus
solfataricus) 		PF01894
(UPF0047) 		4 HIS A  79
HIS A  89
LEU A  90
SER A  46
 K  A 138 (-3.5A)
K  A 138 (-3.5A)
None
PO4  A 139 (-2.8A)
 0.90A 5m8rB-1vphA:
undetectable		 5m8rB-1vphA:
14.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wkc HB8 TT1367 PROTEIN

(Thermus
thermophilus) 		PF01812
(5-FTHF_cyc-lig) 		4 HIS A  46
SER A  23
ASN A  53
LEU A  19
 None
 1.03A 5m8rB-1wkcA:
undetectable		 5m8rB-1wkcA:
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.
1wx4 TYROSINASE

(Streptomyces
castaneoglobisporus) 		PF00264
(Tyrosinase) 		5 HIS A  54
HIS A 190
ASN A 191
HIS A 194
SER A 206
 CU  A 400 ( 3.3A)
CU  A 401 ( 3.2A)
None
CU  A 401 ( 3.2A)
PER  A 409 ( 4.1A)
 0.35A 5m8rB-1wx4A:
29.4		 5m8rB-1wx4A:
22.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wza ALPHA-AMYLASE A

(Halothermothrix
orenii) 		PF00128
(Alpha-amylase) 		4 HIS A 420
LEU A 417
VAL A 347
SER A 350
 None
 0.98A 5m8rB-1wzaA:
undetectable		 5m8rB-1wzaA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1x1b CRTF-RELATED PROTEIN

(Chlorobaculum
tepidum) 		PF00891
(Methyltransf_2) 		4 HIS A 150
SER A 247
HIS A 290
LEU A 302
 SAH  A4261 (-3.6A)
None
None
None
 1.03A 5m8rB-1x1bA:
undetectable		 5m8rB-1x1bA:
20.59
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.
1xm5 HYPOTHETICAL UPF0054
PROTEIN YBEY

(Escherichia
coli) 		PF02130
(UPF0054) 		5 HIS A1124
HIS A1118
LEU A1117
VAL A1067
SER A1069
 NI  A5001 (-3.3A)
NI  A5001 (-3.4A)
None
None
None
 1.43A 5m8rB-1xm5A:
undetectable		 5m8rB-1xm5A:
16.36
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.
1yr0 PHOSPHINOTHRICIN
ACETYLTRANSFERASE

(Agrobacterium
fabrum) 		PF13420
(Acetyltransf_4) 		4 HIS A  87
HIS A 135
LEU A 138
SER A 131
 None
 0.98A 5m8rB-1yr0A:
undetectable		 5m8rB-1yr0A:
17.30
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.
2dqb DEOXYGUANOSINETRIPHO
SPHATE
TRIPHOSPHOHYDROLASE,
PUTATIVE

(Thermus
thermophilus) 		PF01966
(HD)
PF13286
(HD_assoc) 		4 HIS A 108
LEU A 100
VAL A 192
SER A  87
 MG  A 506 (-4.6A)
None
None
None
 1.01A 5m8rB-2dqbA:
undetectable		 5m8rB-2dqbA:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gjx BETA-HEXOSAMINIDASE
ALPHA CHAIN

(Homo sapiens) 		PF00728
(Glyco_hydro_20)
PF14845
(Glycohydro_20b2) 		4 HIS A 204
HIS A 202
HIS A 318
LEU A 317
 None
 0.96A 5m8rB-2gjxA:
undetectable		 5m8rB-2gjxA:
20.60
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.
2gk1 BETA-HEXOSAMINIDASE
SUBUNIT ALPHA

(Homo sapiens) 		no annotation 4 HIS I 204
HIS I 202
HIS I 318
LEU I 317
 None
 0.91A 5m8rB-2gk1I:
undetectable		 5m8rB-2gk1I:
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.
2j8m ACETYLTRANSFERASE
PA4866 FROM P.
AERUGINOSA

(Pseudomonas
aeruginosa) 		PF13420
(Acetyltransf_4) 		4 HIS A  86
HIS A 134
LEU A 137
SER A 130
 None
None
None
AZI  A1174 ( 3.9A)
 0.97A 5m8rB-2j8mA:
undetectable		 5m8rB-2j8mA:
16.03
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.
2jbw 2,6-DIHYDROXY-PSEUDO
-OXYNICOTINE
HYDROLASE

(Paenarthrobacter
nicotinovorans) 		PF06500
(DUF1100) 		5 HIS A 329
HIS A 332
ASN A  15
LEU A  19
SER A 149
 None
 1.33A 5m8rB-2jbwA:
undetectable		 5m8rB-2jbwA:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jlm PUTATIVE
PHOSPHINOTHRICIN
N-ACETYLTRANSFERASE

(Acinetobacter
baylyi) 		PF13420
(Acetyltransf_4) 		4 HIS A  94
HIS A 142
LEU A 145
SER A 138
 None
 1.03A 5m8rB-2jlmA:
undetectable		 5m8rB-2jlmA:
16.59
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.
2p3x POLYPHENOL OXIDASE,
CHLOROPLAST

(Vitis vinifera) 		PF00264
(Tyrosinase)
PF12142
(PPO1_DWL) 		4 HIS A 108
HIS A 239
ASN A 240
HIS A 243
 C2O  A 340 (-3.3A)
C2O  A 340 (-3.2A)
None
C2O  A 340 (-3.3A)
 0.32A 5m8rB-2p3xA:
20.4		 5m8rB-2p3xA:
24.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q3o 12-OXOPHYTODIENOATE
REDUCTASE 3

(Arabidopsis
thaliana) 		PF00724
(Oxidored_FMN) 		4 HIS A 189
HIS A 279
LEU A 278
SER A 320
 FMN  A7401 (-4.4A)
None
None
FMN  A7401 ( 4.2A)
 0.74A 5m8rB-2q3oA:
undetectable		 5m8rB-2q3oA:
22.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wg8 PUTATIVE
PHOSPHOLIPASE A2

(Oryza sativa) 		no annotation 4 HIS A  61
ASN A  78
LEU A  82
VAL A 110
 None
 1.03A 5m8rB-2wg8A:
undetectable		 5m8rB-2wg8A:
14.00
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.
2wj3 1-H-3-HYDROXY-4-OXOQ
UINALDINE
2,4-DIOXYGENASE

(Paenarthrobacter
nitroguajacolicus) 		PF00561
(Abhydrolase_1) 		4 HIS A  38
SER A  17
ASN A  60
HIS A  64
 None
 1.03A 5m8rB-2wj3A:
undetectable		 5m8rB-2wj3A:
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.
2y9x POLYPHENOL OXIDASE

(Agaricus
bisporus) 		PF00264
(Tyrosinase) 		5 HIS A  85
HIS A 259
ASN A 260
HIS A 263
VAL A 283
 CU  A 400 (-3.3A)
CU  A 401 (-3.2A)
0TR  A 410 (-4.1A)
0TR  A 410 ( 3.1A)
0TR  A 410 (-4.0A)
 0.35A 5m8rB-2y9xA:
20.5		 5m8rB-2y9xA:
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.
3bzj UV ENDONUCLEASE

(Thermus
thermophilus) 		PF03851
(UvdE) 		4 HIS A 231
HIS A 143
LEU A 144
VAL A 141
 None
 0.91A 5m8rB-3bzjA:
undetectable		 5m8rB-3bzjA:
19.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bzj UV ENDONUCLEASE

(Thermus
thermophilus) 		PF03851
(UvdE) 		5 HIS A 231
HIS A 203
ASN A 176
HIS A 143
VAL A 141
 None
MN  A 281 (-3.3A)
None
None
None
 1.05A 5m8rB-3bzjA:
undetectable		 5m8rB-3bzjA:
19.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dr8 YNCA

(Salmonella
enterica) 		PF13420
(Acetyltransf_4) 		4 HIS A  83
HIS A 131
LEU A 134
SER A 127
 ACO  A1423 (-4.3A)
ACO  A1423 ( 4.5A)
None
ACO  A1423 (-3.4A)
 0.99A 5m8rB-3dr8A:
undetectable		 5m8rB-3dr8A:
16.46
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.
3fmq METHIONINE
AMINOPEPTIDASE 2

(Encephalitozoon
cuniculi) 		PF00557
(Peptidase_M24) 		4 HIS A 261
SER A 308
HIS A 297
LEU A 298
 FUG  A 481 ( 4.9A)
None
None
None
 0.93A 5m8rB-3fmqA:
undetectable		 5m8rB-3fmqA:
20.27
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.
3hhs PHENOLOXIDASE
SUBUNIT 1

(Manduca sexta) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		4 HIS B 213
HIS B 366
ASN B 367
HIS B 370
 CU  B 686 (-3.3A)
CU  B   1 (-3.3A)
None
CU  B   1 (-3.2A)
 0.67A 5m8rB-3hhsB:
8.5		 5m8rB-3hhsB:
20.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hhs PHENOLOXIDASE
SUBUNIT 2

(Manduca sexta) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		4 HIS A 219
HIS A 368
ASN A 369
HIS A 372
 CU  A 696 (-3.3A)
CU  A 697 (-3.2A)
None
CU  A 697 (-3.2A)
 0.63A 5m8rB-3hhsA:
4.9		 5m8rB-3hhsA:
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.
3hq0 CATECHOL
2,3-DIOXYGENASE

(Pseudomonas
alkylphenolica) 		PF00903
(Glyoxalase) 		4 SER A 197
HIS A 201
HIS A 154
SER A 218
 None
None
FE  A 310 (-3.3A)
FE  A 310 ( 4.1A)
 0.87A 5m8rB-3hq0A:
undetectable		 5m8rB-3hq0A:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ixw HEMOCYANIN AA6 CHAIN

(Androctonus
australis) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		4 HIS A 174
HIS A 321
ASN A 322
HIS A 325
 None
 0.89A 5m8rB-3ixwA:
6.7		 5m8rB-3ixwA:
20.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ixw HEMOCYANIN AA6 CHAIN

(Androctonus
australis) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		4 HIS A 321
ASN A 322
HIS A 325
SER A 351
 None
 0.76A 5m8rB-3ixwA:
6.7		 5m8rB-3ixwA:
20.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3no4 CREATININE
AMIDOHYDROLASE

(Nostoc
punctiforme) 		PF02633
(Creatininase) 		4 HIS A 110
SER A 171
HIS A  31
HIS A 167
 UNL  A 350 ( 4.3A)
None
NI  A 300 (-3.4A)
UNL  A 350 ( 4.4A)
 1.03A 5m8rB-3no4A:
undetectable		 5m8rB-3no4A:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o0k ALDO/KETO REDUCTASE

(Brucella
abortus) 		PF00248
(Aldo_ket_red) 		4 SER A 154
ASN A  31
HIS A  32
LEU A  27
 None
 0.96A 5m8rB-3o0kA:
undetectable		 5m8rB-3o0kA:
20.09
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.
3q34 YCEI-LIKE FAMILY
PROTEIN

(Pseudomonas
savastanoi) 		PF04264
(YceI) 		4 ASN A  27
HIS A  52
LEU A  25
VAL A  65
 GOL  A   3 (-4.3A)
None
None
None
 0.84A 5m8rB-3q34A:
undetectable		 5m8rB-3q34A:
16.48
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.
3sbq NITROUS-OXIDE
REDUCTASE

(Pseudomonas
stutzeri) 		no annotation 4 HIS A 494
HIS A 130
ASN A 148
HIS A 178
 CUK  A 702 (-3.3A)
CUK  A 702 (-3.2A)
None
CUK  A 702 (-3.1A)
 0.94A 5m8rB-3sbqA:
undetectable		 5m8rB-3sbqA:
21.57
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.
3tqo CYSTEINYL-TRNA
SYNTHETASE

(Coxiella
burnetii) 		PF01406
(tRNA-synt_1e)
PF09190
(DALR_2) 		4 SER A   8
HIS A 236
HIS A 225
VAL A  28
 None
 1.00A 5m8rB-3tqoA:
undetectable		 5m8rB-3tqoA:
19.10
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.
3w6q TYROSINASE

(Aspergillus
oryzae) 		PF00264
(Tyrosinase) 		5 HIS A  94
HIS A 328
ASN A 329
HIS A 332
VAL A 359
 None
 0.53A 5m8rB-3w6qA:
11.0		 5m8rB-3w6qA:
19.69
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.
3wiw GLYCOSYL HYDROLASE
FAMILY 88

(Pedobacter
heparinus) 		PF07470
(Glyco_hydro_88) 		4 HIS A 209
SER A 258
LEU A 179
SER A 161
 None
 0.88A 5m8rB-3wiwA:
undetectable		 5m8rB-3wiwA:
22.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wky PROPHENOLOXIDASE B

(Marsupenaeus
japonicus) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		5 HIS A 203
HIS A 357
ASN A 358
HIS A 361
VAL A 384
 CUO  A 708 (-3.5A)
CUO  A 708 (-3.3A)
None
CUO  A 708 (-3.2A)
None
 0.70A 5m8rB-3wkyA:
8.8		 5m8rB-3wkyA:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wky PROPHENOLOXIDASE B

(Marsupenaeus
japonicus) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		4 HIS A 361
HIS A 199
HIS A 203
LEU A 204
 CUO  A 708 (-3.2A)
CUO  A 708 (-3.3A)
CUO  A 708 (-3.5A)
None
 1.01A 5m8rB-3wkyA:
8.8		 5m8rB-3wkyA:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wwe OXIDIZED POLYVINYL
ALCOHOL HYDROLASE

(Pseudomonas sp.
VM15C) 		no annotation 4 HIS A 296
HIS A 298
LEU A 254
SER A 196
 None
 1.03A 5m8rB-3wweA:
undetectable		 5m8rB-3wweA:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bed HEMOCYANIN KLH1

(Megathura
crenulata) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		4 HIS A  60
HIS A 179
ASN A 180
HIS A 183
 CUO  A9001 (-3.1A)
CUO  A9001 (-3.4A)
None
CUO  A9001 (-3.4A)
 0.98A 5m8rB-4bedA:
7.2		 5m8rB-4bedA:
13.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bed HEMOCYANIN KLH1

(Megathura
crenulata) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		4 HIS A 482
HIS A 602
ASN A 603
HIS A 606
 CUO  A9002 (-3.4A)
CUO  A9002 (-3.4A)
None
CUO  A9002 (-3.3A)
 0.95A 5m8rB-4bedA:
7.2		 5m8rB-4bedA:
13.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bed HEMOCYANIN KLH1

(Megathura
crenulata) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		4 HIS B1725
HIS B1847
ASN B1848
HIS B1851
 CUO  B9005 (-3.1A)
CUO  B9005 (-3.2A)
None
CUO  B9005 (-3.2A)
 0.84A 5m8rB-4bedB:
20.8		 5m8rB-4bedB:
13.33
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.
4bed HEMOCYANIN KLH1

(Megathura
crenulata) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		4 HIS B2561
HIS B2670
ASN B2671
HIS B2674
 CUO  B9007 (-3.3A)
CUO  B9007 (-3.4A)
None
CUO  B9007 (-3.4A)
 0.87A 5m8rB-4bedB:
20.8		 5m8rB-4bedB:
13.33
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.
4bed HEMOCYANIN KLH1

(Megathura
crenulata) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		5 HIS B2974
HIS B3075
ASN B3076
HIS B3079
SER B3096
 CUO  B9008 (-2.9A)
CUO  B9008 (-2.8A)
None
CUO  B9008 (-3.5A)
CUO  B9008 ( 4.7A)
 1.27A 5m8rB-4bedB:
20.8		 5m8rB-4bedB:
13.33
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.
4cq1 POLYPYRIMIDINE
TRACT-BINDING
PROTEIN 2

(Homo sapiens) 		PF00076
(RRM_1)
PF13893
(RRM_5) 		4 SER A 454
HIS A 458
LEU A 457
SER A 460
 None
 0.92A 5m8rB-4cq1A:
undetectable		 5m8rB-4cq1A:
19.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4etp SPINDLE POLE
BODY-ASSOCIATED
PROTEIN VIK1

(Saccharomyces
cerevisiae) 		PF16796
(Microtub_bd) 		4 HIS B 416
ASN B 620
HIS B 453
SER B 455
 None
 0.90A 5m8rB-4etpB:
undetectable		 5m8rB-4etpB:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g09 HISTIDINOL
DEHYDROGENASE

(Brucella suis) 		PF00815
(Histidinol_dh) 		4 HIS A 262
SER A 348
HIS A 368
SER A 140
 ZN  A 501 (-3.3A)
None
0VD  A 505 (-3.6A)
0VD  A 505 (-3.2A)
 0.92A 5m8rB-4g09A:
undetectable		 5m8rB-4g09A:
22.38
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.
4gpg PROTEASE 1

(Achromobacter
lyticus) 		PF00089
(Trypsin) 		4 HIS A 148
LEU A 209
VAL A 188
SER A 158
 None
 0.62A 5m8rB-4gpgA:
undetectable		 5m8rB-4gpgA:
21.74
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.
4h14 SPIKE GLYCOPROTEIN

(Betacoronavirus
1) 		PF16451
(Spike_NTD) 		4 HIS A 143
LEU A 155
VAL A 139
SER A 158
 NAG  A1005 ( 4.1A)
None
None
None
 1.00A 5m8rB-4h14A:
undetectable		 5m8rB-4h14A:
20.76
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.
4j3q CATECHOL OXIDASE

(Aspergillus
oryzae) 		PF00264
(Tyrosinase) 		5 HIS A 110
HIS A 284
HIS A 288
VAL A 299
SER A 302
 CU  A1001 (-3.3A)
CU  A1002 (-3.2A)
CU  A1002 (-3.2A)
None
CU  A1001 ( 4.9A)
 0.76A 5m8rB-4j3qA:
26.8		 5m8rB-4j3qA:
23.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j3q CATECHOL OXIDASE

(Aspergillus
oryzae) 		PF00264
(Tyrosinase) 		5 HIS A 110
HIS A 312
HIS A 288
VAL A 299
SER A 302
 CU  A1001 (-3.3A)
CU  A1002 (-3.2A)
CU  A1002 (-3.2A)
None
CU  A1001 ( 4.9A)
 1.35A 5m8rB-4j3qA:
26.8		 5m8rB-4j3qA:
23.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j3q CATECHOL OXIDASE

(Aspergillus
oryzae) 		PF00264
(Tyrosinase) 		4 HIS A 288
HIS A 110
HIS A 119
LEU A 116
 CU  A1002 (-3.2A)
CU  A1001 (-3.3A)
CU  A1001 (-3.2A)
None
 0.96A 5m8rB-4j3qA:
26.8		 5m8rB-4j3qA:
23.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4le6 ORGANOPHOSPHORUS
HYDROLASE

(Pseudomonas
pseudoalcaligenes) 		PF00753
(Lactamase_B) 		4 HIS A 294
SER A 223
HIS A 226
HIS A 139
 ZN  A 406 (-3.2A)
EDO  A 403 ( 4.7A)
ZN  A 405 (-3.1A)
ZN  A 405 (-3.3A)
 0.92A 5m8rB-4le6A:
undetectable		 5m8rB-4le6A:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ly4 PEPTIDOGLYCAN
DEACETYLASE

(Helicobacter
pylori) 		PF01522
(Polysacc_deac_1) 		4 HIS A 247
SER A  65
HIS A  86
HIS A  90
 None
None
ZN  A 301 (-3.4A)
ZN  A 301 (-3.4A)
 0.98A 5m8rB-4ly4A:
undetectable		 5m8rB-4ly4A:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mbo SERINE-RICH REPEAT
ADHESION
GLYCOPROTEIN (SRR1)

(Streptococcus
agalactiae) 		PF10425
(SdrG_C_C) 		4 SER A 592
ASN A 503
VAL A 472
SER A 619
 None
 1.02A 5m8rB-4mboA:
undetectable		 5m8rB-4mboA:
21.41
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.
4n7w TRANSPORTER,
SODIUM/BILE ACID
SYMPORTER FAMILY

(Yersinia
frederiksenii) 		PF01758
(SBF) 		4 SER A 208
LEU A 277
VAL A 284
SER A 283
 None
None
None
CIT  A 401 (-3.0A)
 0.98A 5m8rB-4n7wA:
undetectable		 5m8rB-4n7wA:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nsy LYSYL ENDOPEPTIDASE

(Lysobacter
enzymogenes) 		PF13365
(Trypsin_2) 		4 HIS A 148
LEU A 209
VAL A 188
SER A 158
 None
2OY  A 301 ( 4.2A)
None
None
 0.59A 5m8rB-4nsyA:
undetectable		 5m8rB-4nsyA:
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.
4oje EFF-1A

(Caenorhabditis
elegans) 		PF14884
(EFF-AFF) 		4 HIS H 405
HIS H  39
LEU H 463
SER H 408
 None
None
NAG  H1101 ( 4.5A)
None
 1.02A 5m8rB-4ojeH:
undetectable		 5m8rB-4ojeH:
19.46
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.
4ojx 3',5'-CYCLIC-NUCLEOT
IDE
PHOSPHODIESTERASE 1

(Saccharomyces
cerevisiae) 		PF02112
(PDEase_II) 		4 HIS A 128
HIS A 326
HIS A 294
LEU A 295
 ZN  A 403 (-3.4A)
ZN  A 404 ( 3.3A)
G  A 402 (-3.6A)
None
 0.90A 5m8rB-4ojxA:
undetectable		 5m8rB-4ojxA:
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.
4ojx 3',5'-CYCLIC-NUCLEOT
IDE
PHOSPHODIESTERASE 1

(Saccharomyces
cerevisiae) 		PF02112
(PDEase_II) 		4 HIS A 213
HIS A 133
HIS A 326
SER A 281
 ZN  A 403 ( 3.3A)
ZN  A 404 (-3.3A)
ZN  A 404 ( 3.3A)
None
 0.96A 5m8rB-4ojxA:
undetectable		 5m8rB-4ojxA:
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.
4qiw DNA-DIRECTED RNA
POLYMERASE

(Thermococcus
kodakarensis) 		PF00562
(RNA_pol_Rpb2_6)
PF00623
(RNA_pol_Rpb1_2)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		4 HIS B 732
SER A 333
LEU B 878
VAL B 896
 None
 1.03A 5m8rB-4qiwB:
undetectable		 5m8rB-4qiwB:
15.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rkc AROMATIC AMINO ACID
AMINOTRANSFERASE

(Psychrobacter
sp. B6) 		PF00155
(Aminotran_1_2) 		4 SER A 241
HIS A 178
VAL A 125
SER A 126
 None
PMP  A 409 ( 4.6A)
None
None
 1.03A 5m8rB-4rkcA:
undetectable		 5m8rB-4rkcA:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rvh D-MYCAROSE
3-C-METHYLTRANSFERAS
E

(Streptomyces
argillaceus) 		PF08421
(Methyltransf_13)
PF08484
(Methyltransf_14)
PF13489
(Methyltransf_23) 		4 HIS A  90
HIS A 178
VAL A 254
SER A 258
 None
3YN  A 503 (-4.3A)
None
None
 1.02A 5m8rB-4rvhA:
undetectable		 5m8rB-4rvhA:
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.
4ubq BETA-LACTAMASE

(Acinetobacter
baumannii) 		no annotation 4 HIS A 198
HIS A 140
HIS A  78
SER A  83
 ZN  A 302 ( 3.8A)
ZN  A 301 ( 3.3A)
ZN  A 301 (-3.4A)
None
 1.01A 5m8rB-4ubqA:
undetectable		 5m8rB-4ubqA:
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.
4wjl INACTIVE DIPEPTIDYL
PEPTIDASE 10

(Homo sapiens) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		4 HIS A 581
LEU A 575
VAL A 596
SER A 550
 None
 0.96A 5m8rB-4wjlA:
undetectable		 5m8rB-4wjlA:
20.11
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.
4yfa PROTEIN RELATED TO
PENICILLIN ACYLASE

(Acidovorax sp.
MR-S7) 		PF01804
(Penicil_amidase) 		4 HIS C 396
SER C 403
VAL C 446
SER C 449
 None
 1.01A 5m8rB-4yfaC:
undetectable		 5m8rB-4yfaC:
21.19
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.
4yzw AGAP004976-PA

(Anopheles
gambiae) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		5 HIS A 227
HIS A 379
ASN A 380
HIS A 383
VAL A 406
 CU  A 801 (-3.2A)
CU  A 802 (-3.2A)
None
CU  A 802 (-3.2A)
None
 0.62A 5m8rB-4yzwA:
7.1		 5m8rB-4yzwA:
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.
4zr0 CERAMIDE VERY LONG
CHAIN FATTY ACID
HYDROXYLASE SCS7

(Saccharomyces
cerevisiae) 		PF04116
(FA_hydroxylase) 		5 HIS A 326
HIS A 268
HIS A 244
LEU A 243
VAL A 359
 ZN  A 401 (-3.4A)
ZN  A 402 (-3.5A)
ZN  A 402 (-3.7A)
None
None
 1.40A 5m8rB-4zr0A:
undetectable		 5m8rB-4zr0A:
20.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zr1 CERAMIDE VERY LONG
CHAIN FATTY ACID
HYDROXYLASE SCS7

(Saccharomyces
cerevisiae) 		PF04116
(FA_hydroxylase) 		5 HIS A 326
HIS A 268
HIS A 244
LEU A 243
VAL A 359
 ZN  A 401 (-3.5A)
ZN  A 402 (-3.3A)
ZN  A 402 (-3.5A)
None
None
 1.41A 5m8rB-4zr1A:
undetectable		 5m8rB-4zr1A:
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.
4zwv PUTATIVE
AMINOTRANSFERASE

(Actinomadura
melliaura) 		PF01041
(DegT_DnrJ_EryC1) 		4 HIS A 205
ASN A  45
LEU A  43
VAL A  49
 None
 1.02A 5m8rB-4zwvA:
undetectable		 5m8rB-4zwvA:
20.51
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.
5b3r IMP-18

(Pseudomonas
aeruginosa) 		no annotation 4 HIS A 215
HIS A 157
HIS A  95
SER A 100
 ZN  A2002 ( 3.0A)
ZN  A2001 ( 3.3A)
ZN  A2001 ( 3.4A)
None
 0.96A 5m8rB-5b3rA:
undetectable		 5m8rB-5b3rA:
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.
5ce9 POLYPHENOL OXIDASE

(Juglans regia) 		PF00264
(Tyrosinase)
PF12142
(PPO1_DWL) 		5 HIS A 108
HIS A 239
ASN A 240
HIS A 243
LEU A 244
 CU  A 402 ( 3.2A)
CU  A 401 ( 3.2A)
None
CU  A 401 ( 3.2A)
None
 0.25A 5m8rB-5ce9A:
20.1		 5m8rB-5ce9A:
23.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5djq CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCON1

(Pseudomonas
stutzeri) 		PF00115
(COX1) 		4 SER A 336
HIS A 260
ASN A 333
SER A 276
 HEM  A 501 ( 3.9A)
None
HEM  A 501 (-3.1A)
HEM  A 501 ( 4.2A)
 1.00A 5m8rB-5djqA:
undetectable		 5m8rB-5djqA:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5f1u 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE

(Campylobacter
jejuni) 		PF00701
(DHDPS) 		4 HIS A 122
LEU A 119
VAL A 107
SER A 106
 None
 1.00A 5m8rB-5f1uA:
undetectable		 5m8rB-5f1uA:
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.
5g0a TRANSAMINASE

(Bacillus
megaterium) 		PF00202
(Aminotran_3) 		4 SER A 302
ASN A  63
LEU A  64
VAL A 354
 None
 0.99A 5m8rB-5g0aA:
undetectable		 5m8rB-5g0aA:
21.31
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.
5gt5 PECTATE LYASE

(Paenibacillus
sp. 0602) 		no annotation 4 SER A 339
HIS A 267
ASN A 289
HIS A 266
 None
 0.78A 5m8rB-5gt5A:
undetectable		 5m8rB-5gt5A:
19.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hdh TOLL-LIKE RECEPTOR 8

(Homo sapiens) 		PF13855
(LRR_8) 		4 HIS A 593
ASN A 590
LEU A 613
SER A 647
 None
NAG  A 912 (-2.4A)
None
None
 1.02A 5m8rB-5hdhA:
undetectable		 5m8rB-5hdhA:
19.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5i3a TYROSINASE

(Bacillus
megaterium) 		PF00264
(Tyrosinase) 		5 HIS A  60
HIS A 204
ASN A 205
HIS A 208
VAL A 218
 ZN  A 301 ( 3.2A)
ZN  A 302 ( 3.4A)
HQE  A 303 (-3.4A)
HQE  A 303 ( 3.0A)
HQE  A 303 (-3.3A)
 0.21A 5m8rB-5i3aA:
33.4		 5m8rB-5i3aA:
25.39
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.
5lc5 NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
1
NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
6

(Bos taurus) 		PF00146
(NADHdh)
PF00499
(Oxidored_q3) 		4 SER J  50
ASN H  99
LEU H 100
SER H 163
 None
 0.93A 5m8rB-5lc5J:
undetectable		 5m8rB-5lc5J:
15.02
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5m8t 5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE

(Homo sapiens) 		PF00264
(Tyrosinase) 		8 HIS A 215
SER A 374
HIS A 377
ASN A 378
HIS A 381
LEU A 382
VAL A 391
SER A 394
 ZN  A 512 ( 3.3A)
None
ZN  A 511 ( 3.2A)
0TR  A 513 ( 4.4A)
ZN  A 511 ( 3.3A)
None
0TR  A 513 (-3.8A)
0TR  A 513 (-3.2A)
 0.42A 5m8rB-5m8tA:
68.2		 5m8rB-5m8tA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5m8t 5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE

(Homo sapiens) 		PF00264
(Tyrosinase) 		4 HIS A 381
HIS A 215
HIS A 224
LEU A 221
 ZN  A 511 ( 3.3A)
ZN  A 512 ( 3.3A)
ZN  A 512 (-3.5A)
None
 0.94A 5m8rB-5m8tA:
68.2		 5m8rB-5m8tA:
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.
5nd1 CAPSID PROTEIN

(Rosellinia
necatrix
quadrivirus 1) 		no annotation 4 HIS A 238
SER A 477
HIS A 107
VAL A 340
 None
 0.99A 5m8rB-5nd1A:
undetectable		 5m8rB-5nd1A:
11.55
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.
5or4 CATECHOL OXIDASE

(Aspergillus
oryzae) 		no annotation 5 HIS A 110
HIS A 284
HIS A 288
VAL A 299
SER A 302
 CU  A2001 (-3.3A)
CU  A2002 (-3.2A)
CU  A2002 (-3.2A)
None
None
 0.70A 5m8rB-5or4A:
26.4		 5m8rB-5or4A:
12.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tdx ANCESTRAL
HYDROXYNITRILE LYASE
1

(synthetic
construct) 		no annotation 5 HIS A  14
SER A 240
HIS A 235
LEU A 237
SER A  80
 GOL  A 300 ( 4.6A)
None
GOL  A 300 (-4.1A)
None
GOL  A 300 (-2.8A)
 1.49A 5m8rB-5tdxA:
undetectable		 5m8rB-5tdxA:
18.39
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.
5vld HISTIDINOL
DEHYDROGENASE,
CHLOROPLASTIC

(Medicago
truncatula) 		PF00815
(Histidinol_dh) 		4 HIS A 302
SER A 388
HIS A 408
SER A 176
 NAD  A 502 (-3.9A)
None
HIS  A 501 ( 3.4A)
HIS  A 501 (-3.4A)
 0.99A 5m8rB-5vldA:
undetectable		 5m8rB-5vldA:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5way TRANSCRIPTIONAL
ACTIVATOR

(Streptococcus
pneumoniae) 		PF05043
(Mga)
PF08270
(PRD_Mga)
PF08280
(HTH_Mga) 		4 HIS A 320
ASN A 321
HIS A 324
LEU A 325
 None
 0.80A 5m8rB-5wayA:
undetectable		 5m8rB-5wayA:
21.58
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.
5wp0 NH(3)-DEPENDENT
NAD(+) SYNTHETASE

(Aliivibrio
fischeri) 		PF02540
(NAD_synthase) 		4 HIS A 120
ASN A 119
HIS A 116
VAL A 139
 None
 0.71A 5m8rB-5wp0A:
undetectable		 5m8rB-5wp0A:
20.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6an0 HISTIDINOL
DEHYDROGENASE

(Elizabethkingia
anophelis) 		PF00815
(Histidinol_dh) 		4 HIS A 258
SER A 343
HIS A 363
SER A 134
 ZN  A 501 (-3.3A)
None
None
None
 1.01A 5m8rB-6an0A:
undetectable		 5m8rB-6an0A:
17.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6ewj PUTATIVE CAPSULAR
POLYSACCHARIDE
BIOSYNTHESIS PROTEIN

(Streptococcus
pneumoniae) 		no annotation 4 HIS A 344
SER A 310
HIS A 173
HIS A 313
 None
 1.01A 5m8rB-6ewjA:
undetectable		 5m8rB-6ewjA:
10.76
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.
6eys -

(-) 		no annotation 4 HIS B 220
HIS B 375
HIS B 379
SER B 422
 None
 0.63A 5m8rB-6eysB:
7.3		 5m8rB-6eysB:
undetectable