SIMILAR PATTERNS OF AMINO ACIDS FOR 2ZZN_B_SAMB402_0

List of similar pattern of amino acids derived from ASSAM search

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

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1a88 CHLOROPEROXIDASE L

(Streptomyces
lividans) 		PF00561
(Abhydrolase_1) 		5 LEU A  85
ARG A  50
GLY A  89
PRO A  23
ASP A 215
 None
 1.33A 2zznB-1a88A:
undetectable		 2zznB-1a88A:
18.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1a9x CARBAMOYL PHOSPHATE
SYNTHETASE (SMALL
CHAIN)

(Escherichia
coli) 		PF00117
(GATase)
PF00988
(CPSase_sm_chain) 		5 LEU B1837
GLY B1852
ILE B1705
ASN B1740
PHE B1870
 None
None
None
CYG  B1769 ( 4.6A)
None
 1.43A 2zznB-1a9xB:
undetectable		 2zznB-1a9xB:
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.
1b25 PROTEIN
(FORMALDEHYDE
FERREDOXIN
OXIDOREDUCTASE)

(Pyrococcus
furiosus) 		PF01314
(AFOR_C)
PF02730
(AFOR_N) 		5 TYR A 262
PHE A 263
ARG A 256
GLY A 261
ILE A 420
 None
 1.31A 2zznB-1b25A:
undetectable		 2zznB-1b25A:
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.
1c7t BETA-N-ACETYLHEXOSAM
INIDASE

(Serratia
marcescens) 		PF00728
(Glyco_hydro_20)
PF02838
(Glyco_hydro_20b)
PF03173
(CHB_HEX)
PF03174
(CHB_HEX_C) 		5 PHE A 597
LEU A 593
GLY A 538
PRO A 450
ASP A 640
 None
 1.33A 2zznB-1c7tA:
undetectable		 2zznB-1c7tA:
17.74
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.
1coy CHOLESTEROL OXIDASE

(Brevibacterium
sterolicum) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 TYR A 219
GLY A 220
ILE A  55
ASN A 222
ASP A  47
 None
 1.46A 2zznB-1coyA:
2.3		 2zznB-1coyA:
19.45
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.
1gju MALTODEXTRIN
GLYCOSYLTRANSFERASE

(Thermotoga
maritima) 		PF00128
(Alpha-amylase)
PF09083
(DUF1923) 		5 PHE A 439
LEU A 559
PRO A 497
ILE A 452
ASP A 451
 None
 1.33A 2zznB-1gjuA:
undetectable		 2zznB-1gjuA:
21.96
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.
1i41 CYSTATHIONINE
GAMMA-SYNTHASE

(Nicotiana
tabacum) 		PF01053
(Cys_Met_Meta_PP) 		5 PHE A 426
LEU A 310
PHE A 389
GLY A 391
ASP A 397
 None
None
HEN  A 500 ( 4.9A)
None
None
 1.43A 2zznB-1i41A:
3.4		 2zznB-1i41A:
22.61
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.
1iwp GLYCEROL DEHYDRATASE
ALPHA SUBUNIT

(Klebsiella
pneumoniae) 		PF02286
(Dehydratase_LU) 		5 ARG A 134
PHE A 362
GLY A 399
PRO A 139
ASP A 384
 None
 1.39A 2zznB-1iwpA:
undetectable		 2zznB-1iwpA:
20.43
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.
1j5x GLUCOSAMINE-6-PHOSPH
ATE DEAMINASE

(Thermotoga
maritima) 		PF01380
(SIS) 		5 PHE A  45
GLY A  47
PRO A  74
ILE A 121
PHE A  62
 None
 1.07A 2zznB-1j5xA:
undetectable		 2zznB-1j5xA:
26.01
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.
1j5x GLUCOSAMINE-6-PHOSPH
ATE DEAMINASE

(Thermotoga
maritima) 		PF01380
(SIS) 		5 PHE A  45
LEU A 105
GLY A  47
ILE A  58
PHE A 139
 None
 1.16A 2zznB-1j5xA:
undetectable		 2zznB-1j5xA:
26.01
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.
1jwi BITISCETIN

(Bitis arietans) 		PF00059
(Lectin_C) 		5 PHE A 101
LEU A 115
PHE A 123
GLY A  69
PHE A  19
 None
 1.42A 2zznB-1jwiA:
undetectable		 2zznB-1jwiA:
16.41
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.
1p4p OUTER SURFACE
PROTEIN B

(Borreliella
burgdorferi) 		PF00820
(Lipoprotein_1) 		5 LEU A 168
PHE A 260
GLY A 264
ILE A 285
ASN A 188
 None
 1.34A 2zznB-1p4pA:
undetectable		 2zznB-1p4pA:
19.53
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.
1q6y HYPOTHETICAL PROTEIN
YFDW

(Escherichia
coli) 		PF02515
(CoA_transf_3) 		5 PHE A  15
LEU A 186
ARG A 189
ILE A 104
ASP A 105
 COA  A 500 (-4.6A)
None
None
None
None
 1.34A 2zznB-1q6yA:
2.9		 2zznB-1q6yA:
22.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1svd RIBULOSE-1,5-BISPHOS
PHATE
CARBOXYLASE/OXYGENAS
E LARGE SUBUNIT
RIBULOSE
BISPHOSPHATE
CARBOXYLASE SMALL
CHAIN

(Halothiobacillus
neapolitanus;
Halothiobacillus
neapolitanus) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N)
PF00101
(RuBisCO_small) 		5 PHE A 395
LEU A 417
GLY A 409
ASN A 406
ASP M   6
 None
 1.35A 2zznB-1svdA:
undetectable		 2zznB-1svdA:
20.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uw4 UPF3X
REGULATOR OF
NONSENSE TRANSCRIPTS
2

(Homo sapiens;
Homo sapiens) 		PF03467
(Smg4_UPF3)
PF02854
(MIF4G) 		5 PHE A 136
PHE A  83
GLY B 848
ILE B 843
ASP B 840
 None
 1.30A 2zznB-1uw4A:
undetectable		 2zznB-1uw4A:
13.74
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.
1ve3 HYPOTHETICAL PROTEIN
PH0226

(Pyrococcus
horikoshii) 		PF13649
(Methyltransf_25) 		5 TYR A  13
GLY A  48
ILE A  68
ASP A  93
PHE A 116
 SAM  A 302 (-3.4A)
SAM  A 302 (-3.6A)
SAM  A 302 (-3.7A)
SAM  A 302 (-3.4A)
SAM  A 302 (-4.4A)
 1.41A 2zznB-1ve3A:
16.0		 2zznB-1ve3A:
23.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yi7 BETA-XYLOSIDASE,
FAMILY 43 GLYCOSYL
HYDROLASE

(Clostridium
acetobutylicum) 		PF04616
(Glyco_hydro_43) 		5 TYR A 412
PHE A 510
LEU A 346
GLY A 512
ILE A 421
 None
 1.31A 2zznB-1yi7A:
undetectable		 2zznB-1yi7A:
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.
2a7s PROBABLE
PROPIONYL-COA
CARBOXYLASE BETA
CHAIN 5

(Mycobacterium
tuberculosis) 		PF01039
(Carboxyl_trans) 		5 PHE A 113
LEU A  40
GLY A  97
PRO A  42
ILE A 132
 None
 1.35A 2zznB-2a7sA:
undetectable		 2zznB-2a7sA:
21.94
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.
2b5d ALPHA-AMYLASE

(Thermotoga
maritima) 		PF03065
(Glyco_hydro_57)
PF09210
(DUF1957) 		5 PHE X 358
GLY X 288
ILE X 285
ASN X 286
ASP X 279
 None
 1.46A 2zznB-2b5dX:
undetectable		 2zznB-2b5dX:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d5w PEPTIDE ABC
TRANSPORTER,
PEPTIDE-BINDING
PROTEIN

(Thermus
thermophilus) 		PF00496
(SBP_bac_5) 		5 TYR A 209
LEU A  19
PHE A 213
GLY A 211
ASN A 231
 None
 1.38A 2zznB-2d5wA:
undetectable		 2zznB-2d5wA:
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.
2e1m L-GLUTAMATE OXIDASE
L-GLUTAMATE OXIDASE

(Streptomyces
sp. X-119-6;
Streptomyces
sp. X-119-6) 		PF01593
(Amino_oxidase)
PF01593
(Amino_oxidase) 		5 LEU C 649
PHE C 642
GLY C 644
ILE B 405
PHE B 419
 None
None
FAD  A 801 (-3.0A)
FAD  A 801 (-3.2A)
None
 1.25A 2zznB-2e1mC:
undetectable		 2zznB-2e1mC:
17.40
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.
2eer NAD-DEPENDENT
ALCOHOL
DEHYDROGENASE

(Sulfurisphaera
tokodaii) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 PHE A  49
LEU A  52
GLY A 271
ASN A 248
PHE A 291
 None
None
NAD  A 401 (-3.5A)
NAD  A 401 (-3.4A)
None
 1.35A 2zznB-2eerA:
6.7		 2zznB-2eerA:
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.
2ek6 RNA-BINDING PROTEIN
12

(Homo sapiens) 		PF00076
(RRM_1) 		5 PHE A  23
GLY A  56
PRO A  54
ASN A  20
PHE A  34
 None
 1.14A 2zznB-2ek6A:
2.8		 2zznB-2ek6A:
12.31
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.
2fvm DIHYDROPYRIMIDINASE

(Lachancea
kluyveri) 		PF01979
(Amidohydro_1) 		5 TYR A 503
LEU A 473
GLY A  90
PRO A 402
ASP A 129
 None
 1.40A 2zznB-2fvmA:
undetectable		 2zznB-2fvmA:
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.
2h8a MICROSOMAL
GLUTATHIONE
S-TRANSFERASE 1

(Rattus
norvegicus) 		PF01124
(MAPEG) 		5 PHE A 134
PHE A 109
GLY A 136
ILE A  82
ASN A  81
 None
 1.25A 2zznB-2h8aA:
undetectable		 2zznB-2h8aA:
21.28
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.
2p5d UPF0310 PROTEIN
MJECL36

(Methanocaldococcus
jannaschii) 		PF01878
(EVE) 		5 PHE A 102
TYR A  60
PHE A 108
ILE A 144
ASP A 140
 PHE  A 102 ( 1.3A)
TYR  A  60 ( 1.3A)
PHE  A 108 ( 1.3A)
ILE  A 144 ( 0.7A)
ASP  A 140 ( 0.6A)
 1.33A 2zznB-2p5dA:
undetectable		 2zznB-2p5dA:
20.18
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.
2qtn NICOTINATE
(NICOTINAMIDE)
NUCLEOTIDE
ADENYLYLTRANSFERASE

(Bacillus
anthracis) 		PF01467
(CTP_transf_like) 		5 ARG A  56
PHE A  36
GLY A   9
ILE A 104
PHE A  70
 None
None
GOL  A 191 ( 4.0A)
None
None
 1.33A 2zznB-2qtnA:
undetectable		 2zznB-2qtnA:
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.
2qw5 XYLOSE
ISOMERASE-LIKE TIM
BARREL

(Trichormus
variabilis) 		PF01261
(AP_endonuc_2) 		5 PHE A  93
GLY A  88
ILE A 184
ASP A 215
PHE A 282
 None
XLS  A 401 ( 4.7A)
XLS  A 401 ( 4.3A)
ZN  A 400 (-3.3A)
XLS  A 401 (-4.6A)
 1.45A 2zznB-2qw5A:
undetectable		 2zznB-2qw5A:
22.42
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.
2w3p BENZOYL-COA-DIHYDROD
IOL LYASE

(Paraburkholderia
xenovorans) 		PF00378
(ECH_1) 		5 PHE A  90
LEU A 171
GLY A  93
ILE A  36
ASP A  37
 None
None
None
BME  A 602 (-3.9A)
None
 1.31A 2zznB-2w3pA:
undetectable		 2zznB-2w3pA:
21.38
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.
2wk2 CHITINASE A

(Serratia
marcescens) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		5 PHE A 224
PHE A 300
ILE A 200
ASP A 202
PHE A 211
 None
 1.32A 2zznB-2wk2A:
undetectable		 2zznB-2wk2A:
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.
2zyj ALPHA-AMINODIPATE
AMINOTRANSFERASE

(Thermus
thermophilus) 		PF00155
(Aminotran_1_2) 		5 LEU A 305
PHE A 172
ILE A 169
ASN A 174
ASP A 203
 None
None
PGU  A 500 ( 4.3A)
PGU  A 500 (-3.5A)
None
 1.34A 2zznB-2zyjA:
undetectable		 2zznB-2zyjA:
24.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3a27 UNCHARACTERIZED
PROTEIN MJ1557

(Methanocaldococcus
jannaschii) 		PF02475
(Met_10) 		6 ARG A  87
PHE A 104
GLY A 106
ASN A 129
ASP A 154
PHE A 178
 SAM  A 250 (-4.7A)
SAM  A 250 (-4.7A)
SAM  A 250 (-3.6A)
None
SAM  A 250 (-3.2A)
SAM  A 250 (-4.6A)
 0.79A 2zznB-3a27A:
25.7		 2zznB-3a27A:
31.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ay0 UNCHARACTERIZED
PROTEIN MJ0883

(Methanocaldococcus
jannaschii) 		PF02475
(Met_10) 		11 TYR A 177
PHE A 178
LEU A 182
ARG A 186
PHE A 203
GLY A 205
PRO A 208
ILE A 224
ASN A 225
ASP A 251
PHE A 273
 ADN  A 401 (-4.3A)
None
None
None
ADN  A 401 (-4.9A)
ADN  A 401 ( 4.0A)
None
ADN  A 401 (-3.7A)
ADN  A 401 (-4.9A)
ADN  A 401 (-3.8A)
ADN  A 401 (-4.6A)
 0.68A 2zznB-3ay0A:
35.9		 2zznB-3ay0A:
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.
3fa3 2,3-DIMETHYLMALATE
LYASE

(Aspergillus
niger) 		PF13714
(PEP_mutase) 		5 PHE A 113
ARG A 235
PHE A 189
PRO A 210
ILE A 115
 None
 1.33A 2zznB-3fa3A:
undetectable		 2zznB-3fa3A:
23.76
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.
3g1n E3 UBIQUITIN-PROTEIN
LIGASE HUWE1

(Homo sapiens) 		PF00632
(HECT) 		5 LEU A4249
PHE A4299
GLY A4302
ASN A4343
ASP A4346
 None
None
NA  A5001 ( 4.9A)
NA  A5001 (-3.2A)
None
 1.27A 2zznB-3g1nA:
undetectable		 2zznB-3g1nA:
21.50
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.
3g23 LD-CARBOXYPEPTIDASE
A

(Novosphingobium
aromaticivorans) 		PF02016
(Peptidase_S66) 		5 TYR A  78
ARG A  55
GLY A  76
ASN A 167
ASP A 226
 None
 1.46A 2zznB-3g23A:
undetectable		 2zznB-3g23A:
23.81
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.
3jb9 PRE-MRNA-SPLICING
FACTOR CWF10

(Schizosaccharomyces
pombe) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF03144
(GTP_EFTU_D2)
PF03764
(EFG_IV)
PF16004
(EFTUD2) 		5 PHE B 144
GLY B 236
PRO B 264
ILE B 215
ASP B 216
 None
 1.21A 2zznB-3jb9B:
3.2		 2zznB-3jb9B:
16.29
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.
3jbz SERINE/THREONINE-PRO
TEIN KINASE MTOR

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08771
(FRB_dom) 		5 PHE A2182
LEU A2174
GLY A2238
ILE A2356
ASP A2357
 None
None
None
ADP  A2601 (-4.0A)
MG  A2603 ( 2.3A)
 1.43A 2zznB-3jbzA:
undetectable		 2zznB-3jbzA:
14.07
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.
3k6r PUTATIVE TRANSFERASE
PH0793

(Pyrococcus
horikoshii) 		PF02475
(Met_10) 		6 PHE A 108
ARG A 116
PHE A 133
GLY A 135
ASP A 183
PHE A 207
 None
 0.79A 2zznB-3k6rA:
26.1		 2zznB-3k6rA:
29.18
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.
3mru AMINOACYL-HISTIDINE
DIPEPTIDASE

(Vibrio
alginolyticus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 PHE A 267
GLY A 256
ILE A 262
ASN A 230
ASP A 223
 None
 1.25A 2zznB-3mruA:
undetectable		 2zznB-3mruA:
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.
3n7z ACETYLTRANSFERASE,
GNAT FAMILY

(Bacillus
anthracis) 		PF13527
(Acetyltransf_9)
PF13530
(SCP2_2) 		5 TYR A 353
ARG A 126
PHE A 280
GLY A 282
ILE A  69
 None
 1.17A 2zznB-3n7zA:
undetectable		 2zznB-3n7zA:
23.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3of7 REGULATOR OF
CHROMOSOME
CONDENSATION

(Saccharomyces
cerevisiae) 		PF00415
(RCC1)
PF13540
(RCC1_2) 		5 PHE A  78
LEU A  61
PHE A  89
PRO A 150
ILE A  87
 None
 1.17A 2zznB-3of7A:
undetectable		 2zznB-3of7A:
21.34
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.
3p40 NEUROFASCIN

(Homo sapiens) 		PF13927
(Ig_3) 		5 PHE A 219
LEU A 141
GLY A 167
PRO A 165
ILE A  52
 None
 1.17A 2zznB-3p40A:
undetectable		 2zznB-3p40A:
19.95
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.
3pig BETA-FRUCTOFURANOSID
ASE

(Bifidobacterium
longum) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		5 PHE A 195
TYR A 129
PHE A 127
PHE A 113
GLY A 115
 None
 1.37A 2zznB-3pigA:
undetectable		 2zznB-3pigA:
18.77
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.
3qvi HISTO-ASPARTIC
PROTEASE

(Plasmodium
falciparum) 		PF00026
(Asp) 		5 LEU A 140
PHE A  29
GLY A 122
ASN A  37
PHE A  27
 LEU  A 140 ( 0.6A)
PHE  A  29 ( 1.3A)
GLY  A 122 ( 0.0A)
ASN  A  37 ( 0.6A)
PHE  A  27 ( 1.3A)
 1.40A 2zznB-3qviA:
undetectable		 2zznB-3qviA:
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.
3tz6 ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		5 LEU A 341
ARG A 120
PHE A  84
GLY A  88
PHE A  35
 None
SO4  A 408 (-2.6A)
None
None
None
 1.34A 2zznB-3tz6A:
4.5		 2zznB-3tz6A:
22.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u2k DNA GYRASE SUBUNIT B

(Staphylococcus
aureus) 		PF02518
(HATPase_c) 		5 TYR A  63
ARG A 144
GLY A  83
ILE A 209
ASN A  65
 None
087  A   1 (-2.5A)
None
None
MG  A   2 ( 4.7A)
 1.09A 2zznB-3u2kA:
undetectable		 2zznB-3u2kA:
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.
3ubo ADENOSINE KINASE

(Sinorhizobium
meliloti) 		PF00294
(PfkB) 		5 TYR A 154
PHE A 155
GLY A  10
ILE A  94
ASP A  93
 None
 1.17A 2zznB-3uboA:
2.8		 2zznB-3uboA:
22.00
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.
4asi ACETYL-COA
CARBOXYLASE 1

(Homo sapiens) 		PF01039
(Carboxyl_trans) 		5 TYR A2253
LEU A1949
PHE A1992
ILE A1960
PHE A2080
 None
 1.29A 2zznB-4asiA:
undetectable		 2zznB-4asiA:
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.
4biz SENSOR PROTEIN CPXA

(Escherichia
coli) 		PF00512
(HisKA)
PF00672
(HAMP)
PF02518
(HATPase_c) 		5 PHE A 400
LEU A 291
GLY A 418
ILE A 399
ASP A 395
 None
None
ADP  A 501 (-3.3A)
ADP  A 501 (-4.4A)
None
 1.35A 2zznB-4bizA:
undetectable		 2zznB-4bizA:
22.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4biz SENSOR PROTEIN CPXA

(Escherichia
coli) 		PF00512
(HisKA)
PF00672
(HAMP)
PF02518
(HATPase_c) 		5 PHE A 400
LEU A 291
GLY A 420
ILE A 399
ASP A 395
 None
None
ADP  A 501 (-3.6A)
ADP  A 501 (-4.4A)
None
 1.43A 2zznB-4bizA:
undetectable		 2zznB-4bizA:
22.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cmw DITERPENE SYNTHASE

(Mycobacterium
tuberculosis) 		no annotation 5 PHE A 158
TYR A 194
GLY A 122
ILE A  78
PHE A 213
 None
 1.29A 2zznB-4cmwA:
undetectable		 2zznB-4cmwA:
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.
4crn ERF3 IN RIBOSOME
BOUND
ERF1-ERF3-GDPNP
COMPLEX

(Saccharomyces
cerevisiae) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2) 		5 ARG P 337
GLY P 255
ILE P 533
ASN P 535
PHE P 489
 None
 1.43A 2zznB-4crnP:
undetectable		 2zznB-4crnP:
25.11
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.
4czb NA(+)/H(+)
ANTIPORTER 1

(Methanocaldococcus
jannaschii) 		PF00999
(Na_H_Exchanger) 		5 PHE A 289
LEU A  46
PHE A 291
GLY A 293
PRO A  44
 None
 1.40A 2zznB-4czbA:
undetectable		 2zznB-4czbA:
23.09
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.
4czb NA(+)/H(+)
ANTIPORTER 1

(Methanocaldococcus
jannaschii) 		PF00999
(Na_H_Exchanger) 		5 PHE A 289
PHE A 291
GLY A 293
PRO A  44
ILE A 288
 None
 1.35A 2zznB-4czbA:
undetectable		 2zznB-4czbA:
23.09
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.
4e3a SUGAR KINASE PROTEIN

(Rhizobium etli) 		PF00294
(PfkB) 		5 TYR A 152
PHE A 153
GLY A   8
ILE A  92
ASP A  91
 None
 1.26A 2zznB-4e3aA:
3.4		 2zznB-4e3aA:
23.72
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.
4g0r CAPSID PROTEIN VP1

(Rodent
protoparvovirus
1) 		PF00740
(Parvo_coat) 		5 PHE A 382
PRO A 194
ILE A 468
ASN A 471
ASP A 466
 None
 1.41A 2zznB-4g0rA:
undetectable		 2zznB-4g0rA:
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.
4gl8 OLIGOPEPTIDE ABC
TRANSPORTER OPPAIV

(Borreliella
burgdorferi) 		PF00496
(SBP_bac_5) 		5 LEU A  44
ARG A 215
ILE A 263
ASN A 266
PHE A  33
 None
 1.32A 2zznB-4gl8A:
undetectable		 2zznB-4gl8A:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hzu ENERGY-COUPLING
FACTOR TRANSPORTER
ATP-BINDING PROTEIN
ECFA 2
PREDICTED MEMBRANE
PROTEIN
ENERGY-COUPLING
FACTOR TRANSPORTER
TRANSMEMBRANE
PROTEIN ECFT

(Lactobacillus
brevis;
Lactobacillus
brevis;
Lactobacillus
brevis) 		PF00005
(ABC_tran)
PF07155
(ECF-ribofla_trS)
PF02361
(CbiQ) 		5 PHE T 213
LEU S 161
PRO S 163
ASN A  92
ASP A 165
 None
 1.44A 2zznB-4hzuT:
undetectable		 2zznB-4hzuT:
21.84
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.
4lfy DIHYDROOROTASE

(Burkholderia
cenocepacia) 		PF01979
(Amidohydro_1) 		5 LEU A 252
PHE A 264
GLY A 266
ILE A  55
PHE A 320
 None
 1.25A 2zznB-4lfyA:
undetectable		 2zznB-4lfyA:
22.39
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.
4mvt E3 SUMO-PROTEIN
LIGASE PIAS3

(Homo sapiens) 		PF02891
(zf-MIZ)
PF14324
(PINIT) 		5 PHE A 134
PRO A 362
ILE A 244
ASN A 243
PHE A 194
 None
 1.32A 2zznB-4mvtA:
undetectable		 2zznB-4mvtA:
22.82
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.
4myc IRON-SULFUR CLUSTERS
TRANSPORTER ATM1,
MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane) 		5 LEU A 339
ARG A 280
PHE A 391
GLY A 393
ILE A 239
 None
 1.38A 2zznB-4mycA:
undetectable		 2zznB-4mycA:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ng3 5-CARBOXYVANILLATE
DECARBOXYLASE

(Sphingomonas
paucimobilis) 		PF04909
(Amidohydro_2) 		5 PHE A 266
LEU A 279
GLY A 228
ILE A 222
PHE A 331
 None
 1.31A 2zznB-4ng3A:
undetectable		 2zznB-4ng3A:
20.22
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.
4pev MEMBRANE LIPOPROTEIN
FAMILY PROTEIN

(Aeropyrum
pernix) 		PF02608
(Bmp) 		5 PHE A  94
GLY A  90
ASN A  95
ASP A 327
PHE A 367
 ADN  A 501 (-3.9A)
None
ADN  A 501 (-3.5A)
None
None
 1.10A 2zznB-4pevA:
undetectable		 2zznB-4pevA:
21.99
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.
4pnh D,D-HEPTOSE
1,7-BISPHOSPHATE
PHOSPHATASE

(Burkholderia
thailandensis) 		PF13242
(Hydrolase_like) 		5 PHE A 145
LEU A 159
PHE A 177
GLY A 131
PHE A 181
 None
 1.23A 2zznB-4pnhA:
undetectable		 2zznB-4pnhA:
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.
4r0c ABGT PUTATIVE
TRANSPORTER FAMILY

(Alcanivorax
borkumensis) 		PF03806
(ABG_transport) 		5 PHE A 382
GLY A 428
ILE A 389
ASN A 390
PHE A 407
 None
None
None
NA  A 801 (-2.9A)
None
 1.31A 2zznB-4r0cA:
undetectable		 2zznB-4r0cA:
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.
4urm DNA GYRASE SUBUNIT B

(Staphylococcus
aureus) 		PF02518
(HATPase_c) 		5 TYR A  63
ARG A 144
GLY A  83
ILE A 209
ASN A  65
 None
 1.18A 2zznB-4urmA:
undetectable		 2zznB-4urmA:
20.63
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.
4uyp CELLULOSOMAL
SCAFFOLDIN ANCHORING
PROTEIN C

(Acetivibrio
cellulolyticus) 		PF00963
(Cohesin) 		5 TYR A  66
GLY A  71
ILE A 112
ASP A 136
PHE A  36
 SO4  A1147 (-4.8A)
None
None
None
None
 1.37A 2zznB-4uypA:
undetectable		 2zznB-4uypA:
18.26
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.
4uzy FLAGELLAR ASSOCIATED
PROTEIN

(Chlamydomonas
reinhardtii) 		PF12895
(ANAPC3)
PF13174
(TPR_6) 		5 PHE A 367
LEU A 349
GLY A 417
ILE A 424
ASP A 427
 None
FLC  A1647 (-3.9A)
None
None
None
 1.29A 2zznB-4uzyA:
undetectable		 2zznB-4uzyA:
18.95
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.
4win GMP SYNTHETASE

(Plasmodium
falciparum) 		PF00117
(GATase) 		5 TYR A  18
PHE A  19
GLY A  57
PRO A  59
ILE A  54
 NO3  A1002 (-4.8A)
NO3  A1001 (-4.3A)
NO3  A1002 (-3.9A)
NO3  A1002 ( 4.5A)
None
 1.29A 2zznB-4winA:
undetectable		 2zznB-4winA:
19.83
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.
4zoh PUTATIVE
OXIDOREDUCTASE
MOLYBDOPTERIN-BINDIN
G SUBUNIT

(Sulfurisphaera
tokodaii) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 TYR A 331
PHE A 215
GLY A 333
ASN A 297
PHE A 342
 None
MCN  A 801 (-3.5A)
None
1PE  A 803 (-4.5A)
None
 1.40A 2zznB-4zohA:
undetectable		 2zznB-4zohA:
20.32
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.
5df0 AC-CHIA

(Autographa
californica
multiple
nucleopolyhedrovirus) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		5 PHE A 214
PHE A 290
ILE A 190
ASP A 192
PHE A 201
 None
 1.34A 2zznB-5df0A:
undetectable		 2zznB-5df0A:
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.
5dgq PUTATIVE
ENDOGLUCANASE-RELATE
D PROTEIN

(Photobacterium
profundum) 		PF00759
(Glyco_hydro_9) 		5 TYR A 564
LEU A 489
GLY A 521
ILE A 558
ASP A 139
 None
 1.37A 2zznB-5dgqA:
undetectable		 2zznB-5dgqA:
19.45
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.
5e72 N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE

(Thermococcus
kodakarensis) 		PF01170
(UPF0020)
PF02926
(THUMP) 		5 LEU A 165
PHE A 187
GLY A 189
ILE A 209
ASP A 235
 None
SAM  A 400 (-4.7A)
SAM  A 400 (-3.3A)
SAM  A 400 (-3.9A)
SAM  A 400 (-3.4A)
 1.08A 2zznB-5e72A:
15.9		 2zznB-5e72A:
23.47
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.
5eqi SOLUTE CARRIER
FAMILY 2,
FACILITATED GLUCOSE
TRANSPORTER MEMBER 1

(Homo sapiens) 		PF00083
(Sugar_tr) 		5 PHE A  26
PHE A 291
GLY A  31
ILE A 164
PHE A 379
 None
5RH  A 501 ( 4.9A)
None
5RH  A 501 (-4.3A)
5RH  A 501 ( 4.5A)
 1.43A 2zznB-5eqiA:
undetectable		 2zznB-5eqiA:
20.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ffj ENDONUCLEASE AND
METHYLASE LLAGI

(Lactococcus
lactis) 		PF00271
(Helicase_C)
PF02384
(N6_Mtase)
PF04851
(ResIII) 		5 PHE A 868
PHE A 904
GLY A 906
ILE A 945
ASP A 981
 None
 0.97A 2zznB-5ffjA:
10.7		 2zznB-5ffjA:
13.23
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.
5fjj BETA-GLUCOSIDASE

(Aspergillus
oryzae) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 PHE A 173
PHE A 107
LEU A 392
PRO A 108
PHE A 801
 None
 1.43A 2zznB-5fjjA:
undetectable		 2zznB-5fjjA:
15.40
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.
5fww KREMEN PROTEIN 1

(Homo sapiens) 		PF00051
(Kringle)
PF00431
(CUB)
PF01822
(WSC) 		5 PHE B 207
LEU B 301
GLY B 212
ILE B 144
ASP B 193
 None
 1.25A 2zznB-5fwwB:
undetectable		 2zznB-5fwwB:
20.33
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.
5gpr CHITINASE

(Ostrinia
furnacalis) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		5 PHE A 217
PHE A 293
ILE A 193
ASP A 195
PHE A 204
 PHE  A 217 ( 1.3A)
PHE  A 293 ( 1.3A)
ILE  A 193 ( 0.4A)
ASP  A 195 ( 0.6A)
PHE  A 204 ( 1.3A)
 1.23A 2zznB-5gprA:
undetectable		 2zznB-5gprA:
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.
5hke BILE SALT HYDROLASE

(Lactobacillus
salivarius) 		PF02275
(CBAH) 		5 PHE A  80
PHE A  65
LEU A  63
PHE A 102
GLY A  77
 None
 1.31A 2zznB-5hkeA:
undetectable		 2zznB-5hkeA:
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.
5hpl RSP5

(Saccharomyces
cerevisiae) 		PF00632
(HECT) 		5 LEU A 686
PHE A 736
GLY A 739
ASN A 779
ASP A 782
 None
 1.41A 2zznB-5hplA:
undetectable		 2zznB-5hplA:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j8j HISTONE DEACETYLASE
HDA1

(Saccharomyces
cerevisiae) 		PF09757
(Arb2) 		5 LEU A 469
PHE A 537
GLY A 541
ILE A 695
PHE A 621
 None
 1.21A 2zznB-5j8jA:
undetectable		 2zznB-5j8jA:
21.93
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.
5k6o B-GLUCOSIDASE

(metagenome) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 TYR A 271
LEU A 197
GLY A 276
ASN A 389
ASP A 605
 None
 1.31A 2zznB-5k6oA:
undetectable		 2zznB-5k6oA:
16.87
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.
5kkb MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E IA

(Mus musculus) 		PF01532
(Glyco_hydro_47) 		5 LEU A 250
GLY A 290
ILE A 285
ASN A 634
PHE A 235
 None
 1.31A 2zznB-5kkbA:
undetectable		 2zznB-5kkbA:
22.80
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.
5lp8 E3 UBIQUITIN-PROTEIN
LIGASE HUWE1

(Homo sapiens) 		no annotation 5 LEU B4249
PHE B4299
GLY B4302
ASN B4343
ASP B4346
 None
 1.28A 2zznB-5lp8B:
undetectable		 2zznB-5lp8B:
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.
5mew LACCASE 2

(Steccherinum
murashkinskyi) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 TYR A 247
LEU A 309
ILE A 216
ASP A 217
PHE A 300
 None
 1.35A 2zznB-5mewA:
undetectable		 2zznB-5mewA:
21.27
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.
5mjs TUBULIN BETA CHAIN

(Schizosaccharomyces
pombe) 		no annotation 5 GLY A 140
PRO A 171
ILE A 100
ASN A  99
PHE A 407
 GDP  A 500 (-3.6A)
None
None
None
None
 1.34A 2zznB-5mjsA:
undetectable		 2zznB-5mjsA:
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.
5njf METALLOPROTEASE PMBA

(Escherichia
coli) 		PF01523
(PmbA_TldD) 		5 LEU B 376
ARG B 390
PHE B 257
GLY B 258
ASN B 434
 None
 1.42A 2zznB-5njfB:
undetectable		 2zznB-5njfB:
23.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1

(Homo sapiens) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		5 PHE A3701
PHE A3698
GLY A3518
ILE A3589
PHE A3688
 None
 1.22A 2zznB-5nugA:
undetectable		 2zznB-5nugA:
5.44
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.
5nz7 CELLODEXTRIN
PHOSPHORYLASE

(Ruminiclostridium
thermocellum) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		5 TYR A 456
PHE A 457
GLY A 454
ASN A 452
PHE A 483
 None
 1.35A 2zznB-5nz7A:
undetectable		 2zznB-5nz7A:
16.93
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.
5tfq BETA-LACTAMASE

(Bacteroides
cellulosilyticus) 		PF13354
(Beta-lactamase2) 		5 PHE A 187
LEU A 137
GLY A  55
ILE A 191
PHE A 235
 GOL  A 303 ( 4.7A)
None
None
None
None
 1.20A 2zznB-5tfqA:
undetectable		 2zznB-5tfqA:
21.08
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.
5wt3 TRNA
(GUANINE(37)-N1)-MET
HYLTRANSFERASE TRM5A

(Pyrococcus
abyssi) 		no annotation 8 PHE A 166
ARG A 174
PHE A 191
GLY A 193
PRO A 196
ILE A 214
ASN A 215
ASP A 243
 None
None
MTA  A 401 (-4.4A)
MTA  A 401 (-3.6A)
None
MTA  A 401 (-3.7A)
None
MTA  A 401 (-3.3A)
 0.66A 2zznB-5wt3A:
28.2		 2zznB-5wt3A:
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.
5xao UNCHARACTERIZED
PROTEIN

(Parastagonospora
nodorum) 		PF01266
(DAO) 		5 PHE A 151
PHE A 263
PRO A 254
ASN A 258
ASP A 277
 None
 1.16A 2zznB-5xaoA:
undetectable		 2zznB-5xaoA:
23.74
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.
5xjj MULTI DRUG EFFLUX
TRANSPORTER

(Camelina sativa) 		PF01554
(MatE) 		5 PHE A 127
LEU A 136
GLY A 147
ILE A 154
PHE A  78
 None
 1.30A 2zznB-5xjjA:
undetectable		 2zznB-5xjjA:
22.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5yac TRNA
(GUANINE(37)-N1)-MET
HYLTRANSFERASE TRM5B

(Pyrococcus
abyssi) 		PF02475
(Met_10) 		10 TYR A 164
PHE A 165
LEU A 169
ARG A 173
PHE A 190
GLY A 192
PRO A 195
ASN A 213
ASP A 238
PHE A 260
 None
 0.68A 2zznB-5yacA:
23.7		 2zznB-5yacA:
42.58
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.
5zl9 CHITINASE AB

(Serratia
marcescens) 		no annotation 5 PHE A 224
PHE A 300
ILE A 200
ASP A 202
PHE A 211
 None
 1.34A 2zznB-5zl9A:
undetectable		 2zznB-5zl9A:
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.
6bk7 ELONGATION FACTOR G

(Enterococcus
faecalis) 		no annotation 5 PHE A 313
ARG A 130
GLY A  14
ILE A 373
ASP A 372
 None
 1.45A 2zznB-6bk7A:
undetectable		 2zznB-6bk7A:
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.
6cwo RIBONUCLEOTIDE
REDUCTASE

(Flavobacterium
johnsoniae) 		no annotation 5 TYR A 204
GLY A 202
ILE A 197
ASN A 200
ASP A 194
 None
 1.35A 2zznB-6cwoA:
undetectable		 2zznB-6cwoA:
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.
6cwp RIBONUCLEOTIDE
REDUCTASE

(Flavobacterium
johnsoniae) 		no annotation 5 TYR A 204
GLY A 202
ILE A 197
ASN A 200
ASP A 194
 None
 1.34A 2zznB-6cwpA:
undetectable		 2zznB-6cwpA:
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.
6gnf -

(-) 		no annotation 5 LEU A 318
PHE A 335
GLY A 388
ILE A 349
ASP A 346
 None
 1.39A 2zznB-6gnfA:
undetectable		 2zznB-6gnfA:
undetectable