SIMILAR PATTERNS OF AMINO ACIDS FOR 4POO_B_SAMB301_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.
1al8 GLYCOLATE OXIDASE

(Spinacia
oleracea) 		PF01070
(FMN_dh) 		5 GLY A 286
ASN A  38
ASP A 293
ASP A 285
ILE A 250
 FMN  A 360 (-3.3A)
None
None
FMN  A 360 (-2.7A)
None
 1.29A 4pooB-1al8A:
undetectable		 4pooB-1al8A:
20.77
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.
1cem CELLULASE CELA
(1,4-BETA-D-GLUCAN-G
LUCANOHYDROLASE)

(Ruminiclostridium
thermocellum) 		PF01270
(Glyco_hydro_8) 		5 GLY A 128
HIS A 190
ASP A 203
SER A 122
HIS A 123
 None
 1.39A 4pooB-1cemA:
undetectable		 4pooB-1cemA:
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.
1d5t GUANINE NUCLEOTIDE
DISSOCIATION
INHIBITOR

(Bos taurus) 		PF00996
(GDI) 		5 GLY A  13
HIS A  32
ASP A  34
ILE A  77
SER A 384
 None
 1.38A 4pooB-1d5tA:
undetectable		 4pooB-1d5tA:
19.58
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.
1f4h BETA-GALACTOSIDASE

(Escherichia
coli) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		5 GLY A 543
HIS A 614
ASP A 790
ILE A 793
ASN A 935
 None
 1.34A 4pooB-1f4hA:
undetectable		 4pooB-1f4hA:
11.65
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.
1g8x MYOSIN II HEAVY
CHAIN FUSED TO
ALPHA-ACTININ 3

(Dictyostelium
discoideum) 		PF00063
(Myosin_head)
PF00435
(Spectrin)
PF02736
(Myosin_N) 		5 ASN A 219
ASP A 454
ILE A 455
SER A 456
ASN A 235
 None
MG  A1101 ( 4.3A)
None
None
None
 1.36A 4pooB-1g8xA:
undetectable		 4pooB-1g8xA:
12.19
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.
1hkg HEXOKINASE A

(Saccharomyces
cerevisiae) 		PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2) 		5 GLY A 207
HIS A 191
ASP A 189
ILE A 426
ASN A 215
 None
 1.33A 4pooB-1hkgA:
undetectable		 4pooB-1hkgA:
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.
1ljy MGP-40

(Capra hircus) 		PF00704
(Glyco_hydro_18) 		5 GLY A 204
ASN A 205
ASP A 207
GLN A 294
SER A 199
 None
 1.25A 4pooB-1ljyA:
undetectable		 4pooB-1ljyA:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pie GALACTOKINASE

(Lactococcus
lactis) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg) 		5 THR A  44
GLY A  48
ASN A 201
HIS A 282
SER A 315
 None
 1.05A 4pooB-1pieA:
undetectable		 4pooB-1pieA:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vb3 THREONINE SYNTHASE

(Escherichia
coli) 		PF00291
(PALP)
PF14821
(Thr_synth_N) 		5 THR A 137
GLY A 135
HIS A 353
ILE A 155
SER A 210
 KPA  A 500 (-2.9A)
KPA  A 500 ( 4.2A)
None
None
None
 1.27A 4pooB-1vb3A:
2.2		 4pooB-1vb3A:
19.33
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.
1vyh PLATELET-ACTIVATING
FACTOR
ACETYLHYDROLASE IB
BETA SUBUNIT

(Homo sapiens) 		PF13472
(Lipase_GDSL_2) 		5 GLY A 103
ASN A 105
HIS A 107
ILE A 121
ASN A 109
 None
 1.40A 4pooB-1vyhA:
3.4		 4pooB-1vyhA:
22.36
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.
1w18 LEVANSUCRASE

(Gluconacetobacter
diazotrophicus) 		PF02435
(Glyco_hydro_68) 		5 GLY A 492
HIS A 408
SER A 496
HIS A 486
SER A 483
 None
SO4  A1555 (-3.8A)
None
None
None
 0.95A 4pooB-1w18A:
undetectable		 4pooB-1w18A:
18.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xc6 BETA-GALACTOSIDASE

(Penicillium sp.) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		5 THR A 349
GLY A 347
HIS A  68
ASN A 350
SER A 948
 None
None
None
None
EDO  A9004 (-2.9A)
 1.38A 4pooB-1xc6A:
undetectable		 4pooB-1xc6A:
11.43
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.
1y79 PEPTIDYL-DIPEPTIDASE
DCP

(Escherichia
coli) 		PF01432
(Peptidase_M3) 		5 THR 1 490
GLY 1 650
SER 1 501
HIS 1 473
ASN 1 491
 None
None
ZN  1 700 (-3.6A)
ZN  1 700 ( 3.3A)
None
 1.36A 4pooB-1y791:
undetectable		 4pooB-1y791:
15.35
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.
1yd9 CORE HISTONE
MACRO-H2A.1

(Rattus
norvegicus) 		PF01661
(Macro) 		5 THR A  40
GLY A  48
HIS A  96
ASN A  41
SER A  84
 None
 1.36A 4pooB-1yd9A:
2.1		 4pooB-1yd9A:
23.11
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.
2azq CATECHOL
1,2-DIOXYGENASE

(Pseudomonas
putida) 		PF00775
(Dioxygenase_C)
PF04444
(Dioxygenase_N) 		5 THR A 234
ASP A  84
ILE A 225
SER A 226
HIS A 232
 None
 1.15A 4pooB-2azqA:
undetectable		 4pooB-2azqA:
20.69
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.
2c1l RESTRICTION
ENDONUCLEASE

(Bacillus firmus) 		PF13091
(PLDc_2) 		5 THR A 171
GLY A  92
ILE A  68
HIS A  96
ASN A 172
 None
 1.25A 4pooB-2c1lA:
3.6		 4pooB-2c1lA:
20.83
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.
2d3r LECTIN ALPHA CHAIN

(Cratylia
argentea) 		PF00139
(Lectin_legB) 		5 THR A  97
GLY A 226
ASP A 207
ASN A 167
SER A 200
 None
 1.00A 4pooB-2d3rA:
undetectable		 4pooB-2d3rA:
19.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ibu ACETYL-COA
ACETYLTRANSFERASE

(Homo sapiens) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 THR A 185
ASP A 182
ASP A 186
ILE A 191
SER A 195
 None
 1.28A 4pooB-2ibuA:
undetectable		 4pooB-2ibuA:
19.26
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.
2iq7 ENDOPOLYGALACTURONAS
E

(Colletotrichum
lupini) 		PF00295
(Glyco_hydro_28) 		5 GLY A 220
ASN A 197
ASP A 250
ASN A 248
SER A 319
 None
 1.39A 4pooB-2iq7A:
undetectable		 4pooB-2iq7A:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2okj GLUTAMATE
DECARBOXYLASE 1

(Homo sapiens) 		PF00282
(Pyridoxal_deC) 		5 GLY A 378
HIS A 510
SER A 398
HIS A 371
SER A 259
 None
 1.20A 4pooB-2okjA:
4.7		 4pooB-2okjA:
17.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pz1 RHO GUANINE
NUCLEOTIDE EXCHANGE
FACTOR 4

(Homo sapiens) 		PF00018
(SH3_1)
PF00169
(PH)
PF00621
(RhoGEF) 		5 THR A 328
GLY A 331
ASN A 332
SER A 322
ASN A 384
 None
 1.27A 4pooB-2pz1A:
undetectable		 4pooB-2pz1A:
19.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q27 OXALYL-COA
DECARBOXYLASE

(Escherichia
coli) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 THR A 398
GLY A 395
ASP A 400
ILE A 471
ASN A 397
 TPP  A3001 (-3.7A)
TPP  A3001 (-3.2A)
None
None
TPP  A3001 (-3.9A)
 1.36A 4pooB-2q27A:
3.3		 4pooB-2q27A:
16.96
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.
2qk4 TRIFUNCTIONAL PURINE
BIOSYNTHETIC PROTEIN
ADENOSINE-3

(Homo sapiens) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		5 THR A  48
GLY A  35
ASN A  36
ILE A  52
SER A  51
 None
 1.33A 4pooB-2qk4A:
undetectable		 4pooB-2qk4A:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vdw VACCINIA VIRUS
CAPPING ENZYME D1
SUBUNIT

(Vaccinia virus) 		PF03291
(Pox_MCEL) 		5 GLY A 600
ASN A 601
ASP A 604
ASP A 620
SER A 684
 SAH  A1846 (-3.2A)
SO4  A1845 (-4.1A)
SAH  A1846 ( 4.5A)
SAH  A1846 (-2.6A)
None
 1.05A 4pooB-2vdwA:
11.6		 4pooB-2vdwA:
24.84
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.
2vr5 GLYCOGEN OPERON
PROTEIN GLGX

(Sulfolobus
solfataricus) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C)
PF02922
(CBM_48) 		5 GLY A 295
ASN A 296
HIS A 297
ILE A 228
GLN A 230
 None
None
None
None
A16  A1722 (-4.4A)
 1.31A 4pooB-2vr5A:
undetectable		 4pooB-2vr5A:
13.46
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.
2vun ENAMIDASE

(Eubacterium
barkeri) 		PF01979
(Amidohydro_1) 		5 THR A 338
GLY A 349
ASP A 355
ASP A 346
SER A  57
 None
 1.39A 4pooB-2vunA:
undetectable		 4pooB-2vunA:
20.10
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.
2wgh RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
LARGE SUBUNIT

(Homo sapiens) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC) 		5 ASN A 484
ASP A 482
SER A 175
HIS A 179
ASN A 478
 None
 1.33A 4pooB-2wghA:
undetectable		 4pooB-2wghA:
14.48
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.
2wt9 NICOTINAMIDASE

(Acinetobacter
baumannii) 		PF00857
(Isochorismatase) 		5 GLY A  20
HIS A 100
ASP A  96
HIS A  56
SER A  62
 None
None
None
ZN  A1212 (-3.4A)
ZN  A1212 ( 4.4A)
 1.35A 4pooB-2wt9A:
4.2		 4pooB-2wt9A:
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.
2xsg CCMAN5

(Cellulosimicrobium
cellulans) 		PF07971
(Glyco_hydro_92) 		5 THR A 165
GLY A  77
ASN A  66
ASP A  78
SER A 173
 None
 1.38A 4pooB-2xsgA:
undetectable		 4pooB-2xsgA:
13.34
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.
2xwx GLCNAC-BINDING
PROTEIN A

(Vibrio cholerae) 		PF03067
(LPMO_10) 		5 GLY A  33
ASN A  32
ILE A 106
GLN A 111
ASN A  47
 None
 1.26A 4pooB-2xwxA:
undetectable		 4pooB-2xwxA:
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.
3bh2 ACETOACETATE
DECARBOXYLASE

(Clostridium
acetobutylicum) 		PF06314
(ADC) 		5 THR A 144
GLY A 131
ASP A 125
ILE A  34
SER A 224
 None
 1.31A 4pooB-3bh2A:
undetectable		 4pooB-3bh2A:
23.26
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.
3cjt RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE

(Thermus
thermophilus) 		PF06325
(PrmA) 		5 GLY A 130
ASP A 149
ILE A 150
SER A 175
ASN A 191
 SAH  A 258 (-3.6A)
SAH  A 258 (-2.8A)
SAH  A 258 (-4.0A)
SAH  A 258 (-2.6A)
SAH  A 258 ( 3.8A)
 0.55A 4pooB-3cjtA:
15.0		 4pooB-3cjtA:
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.
3czc RMPB

(Streptococcus
mutans) 		PF02302
(PTS_IIB) 		5 GLY A  74
ASN A  58
HIS A  59
ILE A  53
SER A  36
 None
 1.36A 4pooB-3czcA:
undetectable		 4pooB-3czcA:
20.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3eey PUTATIVE RRNA
METHYLASE

(Ruminiclostridium
thermocellum) 		PF06962
(rRNA_methylase) 		9 THR A  28
GLY A  30
ASN A  31
ASP A  34
ASP A  52
ILE A  53
GLN A  54
HIS A  81
ASN A  98
 SAM  A 300 (-4.1A)
SAM  A 300 (-3.4A)
SAM  A 300 (-4.7A)
SAM  A 300 (-3.9A)
SAM  A 300 (-2.9A)
SAM  A 300 (-4.0A)
SAM  A 300 (-3.8A)
SAM  A 300 (-3.1A)
SAM  A 300 (-4.2A)
 0.67A 4pooB-3eeyA:
25.9		 4pooB-3eeyA:
44.39
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.
3fdg DIPEPTIDASE AC.
METALLO PEPTIDASE.
MEROPS FAMILY M19

(Rhodobacter
sphaeroides) 		PF01244
(Peptidase_M19) 		5 ASP A 306
SER A 232
HIS A 231
ASN A  12
SER A 209
 None
None
MG  A 356 (-3.5A)
None
None
 1.36A 4pooB-3fdgA:
undetectable		 4pooB-3fdgA:
19.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g8m SERINE
HYDROXYMETHYLTRANSFE
RASE

(Escherichia
coli) 		PF00464
(SHMT) 		5 GLY A 146
ASN A 120
HIS A 123
ASP A 157
GLN A 161
 None
 1.39A 4pooB-3g8mA:
5.2		 4pooB-3g8mA:
20.48
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.
3gaf 7-ALPHA-HYDROXYSTERO
ID DEHYDROGENASE

(Brucella
abortus) 		PF13561
(adh_short_C2) 		5 THR A 170
GLY A 241
ILE A 141
SER A 126
ASN A 167
 None
 1.39A 4pooB-3gafA:
8.7		 4pooB-3gafA:
22.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gaz ALCOHOL
DEHYDROGENASE
SUPERFAMILY PROTEIN

(Novosphingobium
aromaticivorans) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A 320
ASP A 323
ILE A 331
GLN A 327
ASN A 322
 None
None
None
CA  A 401 (-4.0A)
None
 1.36A 4pooB-3gazA:
9.3		 4pooB-3gazA:
20.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3grz RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE

(Lactobacillus
delbrueckii) 		PF06325
(PrmA) 		5 GLY A 186
ASP A 206
ILE A 207
SER A 233
ASN A 248
 None
GOL  A 322 (-3.5A)
GOL  A 322 (-4.1A)
GOL  A 322 ( 4.3A)
None
 0.60A 4pooB-3grzA:
16.3		 4pooB-3grzA:
22.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3lby PUTATIVE
UNCHARACTERIZED
PROTEIN SMU.1697C

(Streptococcus
mutans) 		PF06962
(rRNA_methylase) 		7 THR A  27
GLY A  29
ASN A  30
ASP A  33
ASP A  48
HIS A  76
ASN A  93
 SAH  A4630 (-4.2A)
SAH  A4630 (-3.6A)
None
None
SAH  A4630 (-2.9A)
SAH  A4630 (-3.1A)
None
 0.60A 4pooB-3lbyA:
25.1		 4pooB-3lbyA:
41.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3lby PUTATIVE
UNCHARACTERIZED
PROTEIN SMU.1697C

(Streptococcus
mutans) 		PF06962
(rRNA_methylase) 		7 THR A  27
GLY A  29
ASN A  30
ASP A  48
GLN A  50
HIS A  76
ASN A  93
 SAH  A4630 (-4.2A)
SAH  A4630 (-3.6A)
None
SAH  A4630 (-2.9A)
SAH  A4630 (-3.8A)
SAH  A4630 (-3.1A)
None
 0.80A 4pooB-3lbyA:
25.1		 4pooB-3lbyA:
41.03
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.
3lzd DPH2

(Pyrococcus
horikoshii) 		PF01866
(Diphthamide_syn) 		5 GLY A 325
ASP A 151
ILE A 154
SER A 155
SER A  80
 None
 1.23A 4pooB-3lzdA:
3.0		 4pooB-3lzdA:
22.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3mti RRNA METHYLASE

(Streptococcus
thermophilus) 		PF06962
(rRNA_methylase) 		6 THR A  27
GLY A  29
ASN A  30
ASP A  48
GLN A  50
HIS A  76
 None
 0.98A 4pooB-3mtiA:
25.1		 4pooB-3mtiA:
40.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3mti RRNA METHYLASE

(Streptococcus
thermophilus) 		PF06962
(rRNA_methylase) 		7 THR A  27
GLY A  29
ASP A  33
ASP A  48
GLN A  50
HIS A  76
ASN A  93
 None
 0.86A 4pooB-3mtiA:
25.1		 4pooB-3mtiA:
40.00
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.
3nda SERPIN-2

(Ixodes ricinus) 		PF00079
(Serpin) 		5 THR A 242
GLY A 193
ASN A 192
GLN A 373
ASN A 241
 None
 1.37A 4pooB-3ndaA:
undetectable		 4pooB-3ndaA:
21.32
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.
3om5 LEVANSUCRASE

(Bacillus
megaterium) 		PF02435
(Glyco_hydro_68) 		5 THR A 277
GLY A 280
ASN A 345
ASP A 279
ILE A 234
 None
 1.36A 4pooB-3om5A:
undetectable		 4pooB-3om5A:
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.
3rjy ENDOGLUCANASE
FNCEL5A

(Fervidobacterium
nodosum) 		PF00150
(Cellulase) 		5 ASN A 192
ASP A 218
ILE A 122
ASN A 220
SER A 312
 None
 1.19A 4pooB-3rjyA:
undetectable		 4pooB-3rjyA:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s9v ABIETADIENE
SYNTHASE,
CHLOROPLASTIC

(Abies grandis) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		5 THR A 406
GLY A 393
ASN A 398
ASP A 388
ASP A 405
 None
 1.07A 4pooB-3s9vA:
undetectable		 4pooB-3s9vA:
15.22
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.
3teu FIBCON

(-) 		PF00041
(fn3) 		5 THR A  16
GLY A  91
HIS A  95
ILE A  18
GLN A  88
 None
 1.25A 4pooB-3teuA:
undetectable		 4pooB-3teuA:
17.35
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.
3tlx ADENYLATE KINASE 2

(Plasmodium
falciparum) 		PF00406
(ADK)
PF05191
(ADK_lid) 		5 GLY A 137
ILE A 236
SER A 237
HIS A  52
SER A  51
 None
 1.32A 4pooB-3tlxA:
2.9		 4pooB-3tlxA:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tx8 SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Corynebacterium
glutamicum) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 GLY A  98
ASN A  86
ASP A  24
ILE A  95
GLN A 350
 None
 1.16A 4pooB-3tx8A:
undetectable		 4pooB-3tx8A:
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.
3ufx SUCCINYL-COA
SYNTHETASE BETA
SUBUNIT

(Thermus
aquaticus) 		PF00549
(Ligase_CoA)
PF08442
(ATP-grasp_2) 		5 GLY B 248
ASN B 249
ASP B 299
ASP B 247
ASN B 276
 None
 1.26A 4pooB-3ufxB:
2.1		 4pooB-3ufxB:
22.69
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.
3vab DIAMINOPIMELATE
DECARBOXYLASE 1

(Brucella
melitensis) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		5 THR A 372
GLY A 374
ASN A  63
ILE A 370
ASN A 284
 None
 1.18A 4pooB-3vabA:
undetectable		 4pooB-3vabA:
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.
3wdj TYPE I PULLULANASE

(Anoxybacillus
sp. LM18-11) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 THR A 456
GLY A 443
ILE A 417
ASN A 460
SER A 385
 None
 1.37A 4pooB-3wdjA:
2.2		 4pooB-3wdjA:
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.
4a54 EDC3

(Schizosaccharomyces
pombe) 		no annotation 5 GLY A  23
ASN A  10
ILE A  47
SER A  46
ASN A  41
 None
 1.39A 4pooB-4a54A:
undetectable		 4pooB-4a54A:
17.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4anj UNCONVENTIONAL
MYOSIN-VI, GREEN
FLUORESCENT PROTEIN

(Aequorea
victoria;
Sus scrofa) 		PF00063
(Myosin_head)
PF01353
(GFP) 		5 GLY A 644
ASN A 645
ASP A 599
SER A 467
ASN A 598
 None
 1.35A 4pooB-4anjA:
3.1		 4pooB-4anjA:
11.23
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.
4ckb MRNA-CAPPING ENZYME
CATALYTIC SUBUNIT

(Vaccinia virus) 		PF03291
(Pox_MCEL)
PF10640
(Pox_ATPase-GT) 		5 GLY A 600
ASN A 601
ASP A 604
ASP A 620
SER A 684
 SAH  A1845 (-3.4A)
None
SAH  A1845 ( 4.2A)
SAH  A1845 (-2.7A)
SAH  A1845 ( 4.8A)
 0.93A 4pooB-4ckbA:
13.2		 4pooB-4ckbA:
13.44
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.
4dfe 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Paraburkholderia
xenovorans) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 GLY A 323
HIS A 191
ILE A 292
SER A 291
HIS A 256
 None
None
None
None
CSO  A 123 ( 3.7A)
 1.35A 4pooB-4dfeA:
undetectable		 4pooB-4dfeA:
20.72
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.
4e5v PUTATIVE THUA-LIKE
PROTEIN

(Parabacteroides
merdae) 		PF06283
(ThuA) 		5 GLY A  35
HIS A  45
ASP A  88
SER A  93
ASN A  37
 None
 1.27A 4pooB-4e5vA:
undetectable		 4pooB-4e5vA:
23.45
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.
4h0g 2D10 SCFV

(Mus musculus) 		PF07686
(V-set) 		5 GLY A 208
SER A 233
HIS A 178
ASN A 197
SER A 235
 None
 1.27A 4pooB-4h0gA:
undetectable		 4pooB-4h0gA:
21.67
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.
4iob DIGUANYLATE CYCLASE
TPBB

(Pseudomonas
aeruginosa) 		PF00990
(GGDEF) 		5 THR A 305
GLY A 303
ASN A 295
HIS A 300
ILE A 360
 None
None
None
TBU  A 501 (-4.1A)
None
 1.40A 4pooB-4iobA:
undetectable		 4pooB-4iobA:
22.92
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.
4iug BETA-GALACTOSIDASE A

(Aspergillus
oryzae) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		5 THR A 348
GLY A 346
HIS A  68
ASN A 349
SER A 942
 None
None
None
None
NAG  A1132 (-3.6A)
 1.38A 4pooB-4iugA:
undetectable		 4pooB-4iugA:
11.47
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.
4keq 4-PYRIDOXOLACTONASE

(Mesorhizobium
japonicum) 		PF00753
(Lactamase_B) 		5 ASN A 105
ASP A  50
ILE A 206
SER A 251
HIS A 252
 None
None
None
ZN  A 301 ( 4.9A)
ZN  A 301 ( 3.3A)
 1.26A 4pooB-4keqA:
undetectable		 4pooB-4keqA:
20.42
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.
4mb5 CHITINASE 60

(Moritella
marina) 		PF00704
(Glyco_hydro_18)
PF16403
(DUF5011) 		5 GLY A  49
ASP A 278
ILE A 277
GLN A  47
ASN A 323
 None
 0.93A 4pooB-4mb5A:
undetectable		 4pooB-4mb5A:
17.90
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.
4mb5 CHITINASE 60

(Moritella
marina) 		PF00704
(Glyco_hydro_18)
PF16403
(DUF5011) 		5 GLY A  49
ASP A 278
ILE A 277
GLN A  47
ASN A 324
 None
 1.00A 4pooB-4mb5A:
undetectable		 4pooB-4mb5A:
17.90
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.
4myo VIRGINIAMYCIN A
ACETYLTRANSFERASE

(Staphylococcus
aureus) 		PF00132
(Hexapep) 		5 GLY A  63
ASN A  34
HIS A  58
SER A 109
ASN A  83
 None
 1.40A 4pooB-4myoA:
undetectable		 4pooB-4myoA:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oo3 HYPOTHETICAL PROTEIN

(Parabacteroides
merdae) 		PF01408
(GFO_IDH_MocA)
PF16490
(Oxidoreduct_C) 		5 GLY A 237
ASN A 122
ASP A 232
ILE A 240
ASN A 234
 None
 1.33A 4pooB-4oo3A:
5.1		 4pooB-4oo3A:
17.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pdx PUTATIVE
ALKYL/ARYL-SULFATASE
YJCS

(Escherichia
coli) 		PF00753
(Lactamase_B)
PF14863
(Alkyl_sulf_dimr)
PF14864
(Alkyl_sulf_C) 		5 THR A 340
GLY A 345
ASN A 346
ASP A 342
HIS A 297
 None
 1.39A 4pooB-4pdxA:
undetectable		 4pooB-4pdxA:
16.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4poo PUTATIVE RNA
METHYLASE

(Bacillus
subtilis) 		PF06962
(rRNA_methylase) 		6 ASN A  60
ASP A  52
ILE A  53
GLN A  54
SER A  79
HIS A  80
 None
SAM  A 301 (-2.9A)
SAM  A 301 (-3.7A)
SAM  A 301 (-3.7A)
SAM  A 301 (-2.9A)
SAM  A 301 (-3.1A)
 1.42A 4pooB-4pooA:
30.9		 4pooB-4pooA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4poo PUTATIVE RNA
METHYLASE

(Bacillus
subtilis) 		PF06962
(rRNA_methylase) 		5 GLY A  30
ASN A  31
HIS A  33
ILE A 112
ASN A 101
 SAM  A 301 (-3.5A)
SAM  A 301 (-4.5A)
SAM  A 301 (-4.2A)
None
SAM  A 301 (-4.1A)
 1.37A 4pooB-4pooA:
30.9		 4pooB-4pooA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4poo PUTATIVE RNA
METHYLASE

(Bacillus
subtilis) 		PF06962
(rRNA_methylase) 		11 THR A  28
GLY A  30
ASN A  31
HIS A  33
ASP A  34
ASP A  52
ILE A  53
SER A  79
HIS A  80
ASN A 101
SER A 118
 SAM  A 301 (-4.1A)
SAM  A 301 (-3.5A)
SAM  A 301 (-4.5A)
SAM  A 301 (-4.2A)
SAM  A 301 (-3.7A)
SAM  A 301 (-2.9A)
SAM  A 301 (-3.7A)
SAM  A 301 (-2.9A)
SAM  A 301 (-3.1A)
SAM  A 301 (-4.1A)
SAM  A 301 ( 3.8A)
 0.43A 4pooB-4pooA:
30.9		 4pooB-4pooA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4poo PUTATIVE RNA
METHYLASE

(Bacillus
subtilis) 		PF06962
(rRNA_methylase) 		9 THR A  28
GLY A  30
HIS A  33
ASP A  52
ILE A  53
GLN A  54
SER A  79
HIS A  80
SER A 118
 SAM  A 301 (-4.1A)
SAM  A 301 (-3.5A)
SAM  A 301 (-4.2A)
SAM  A 301 (-2.9A)
SAM  A 301 (-3.7A)
SAM  A 301 (-3.7A)
SAM  A 301 (-2.9A)
SAM  A 301 (-3.1A)
SAM  A 301 ( 3.8A)
 0.68A 4pooB-4pooA:
30.9		 4pooB-4pooA:
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.
4q1v PUTATIVE DIPEPTIDYL
AMINOPEPTIDASE IV

(Bacteroides
ovatus) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		5 HIS A 710
ASP A 679
ILE A 637
SER A 237
HIS A 238
 None
 1.37A 4pooB-4q1vA:
2.3		 4pooB-4q1vA:
14.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4utg SUGAR KINASE

(Burkholderia
pseudomallei) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		5 THR A 335
GLY A 171
ASN A 173
HIS A 333
ASN A 337
 None
 1.34A 4pooB-4utgA:
undetectable		 4pooB-4utgA:
18.82
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.
4w5z CHITINASE 60

(Moritella
marina) 		PF00704
(Glyco_hydro_18) 		5 GLY A  49
ASP A 278
ILE A 277
GLN A  47
ASN A 324
 None
 0.98A 4pooB-4w5zA:
undetectable		 4pooB-4w5zA:
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.
4yai C
ALPHA-DEHYDROGENASE

(Sphingobium sp.
SYK-6) 		PF00106
(adh_short) 		5 THR A  11
GLY A  13
ASP A  36
ILE A  37
SER A  66
 None
None
NAI  A 500 (-2.2A)
NAI  A 500 (-3.7A)
NAI  A 500 ( 4.1A)
 1.09A 4pooB-4yaiA:
8.7		 4pooB-4yaiA:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yvd PLEIOTROPIC
REGULATOR 1

(Homo sapiens) 		PF00400
(WD40) 		5 THR A 435
GLY A 464
ILE A 416
SER A 429
HIS A 437
 None
 1.20A 4pooB-4yvdA:
undetectable		 4pooB-4yvdA:
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.
4zgv FERREDOXIN RECEPTOR

(Pectobacterium
atrosepticum) 		PF07715
(Plug) 		5 THR A 795
GLY A 793
ILE A 773
SER A 772
SER A 846
 None
 1.35A 4pooB-4zgvA:
undetectable		 4pooB-4zgvA:
12.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zpd RNA-DIRECTED RNA
POLYMERASE

(Enterovirus B) 		PF00680
(RdRP_1) 		5 GLY A 192
ASN A 193
GLN A 189
SER A 184
SER A 179
 None
 1.25A 4pooB-4zpdA:
undetectable		 4pooB-4zpdA:
18.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zwn MONOGLYCERIDE LIPASE

(Saccharomyces
cerevisiae) 		PF12146
(Hydrolase_4) 		5 GLY A 125
HIS A  47
ILE A 152
SER A 259
HIS A 247
 None
 1.23A 4pooB-4zwnA:
2.4		 4pooB-4zwnA:
22.60
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.
5a5t EUKARYOTIC
TRANSLATION
INITIATION FACTOR 3
SUBUNIT F

(Oryctolagus
cuniculus) 		PF01398
(JAB)
PF13012
(MitMem_reg) 		5 THR F 143
ASN F 153
HIS F 180
SER F 148
ASN F 186
 None
 1.25A 4pooB-5a5tF:
undetectable		 4pooB-5a5tF:
20.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5az3 ABC-TYPE
TRANSPORTER,
PERIPLASMIC
COMPONENT

(Corynebacterium
glutamicum) 		PF01497
(Peripla_BP_2) 		5 THR A 104
GLY A 339
ASP A 193
GLN A 334
SER A 125
 None
 1.38A 4pooB-5az3A:
undetectable		 4pooB-5az3A:
20.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bza BETA-N-ACETYLHEXOSAM
INIDASE

(Thermotoga
neapolitana) 		PF00933
(Glyco_hydro_3) 		5 GLY A 323
ASN A 321
ILE A 453
SER A 454
SER A 449
 None
 1.26A 4pooB-5bzaA:
undetectable		 4pooB-5bzaA:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5d68 KREV INTERACTION
TRAPPED PROTEIN 1

(Homo sapiens) 		PF00373
(FERM_M)
PF13857
(Ank_5) 		5 THR A 380
GLY A 439
ASP A 381
ILE A 384
SER A 357
 None
 1.32A 4pooB-5d68A:
undetectable		 4pooB-5d68A:
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.
5ep8 PYRIMIDINE-NUCLEOSID
E PHOSPHORYLASE

(Bacillus
subtilis) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C) 		5 GLY A 225
ASN A 226
ASP A  52
ILE A 184
SER A 183
 GLY  A 225 ( 0.0A)
ASN  A 226 ( 0.6A)
ASP  A  52 ( 0.6A)
ILE  A 184 ( 0.4A)
SER  A 183 ( 0.0A)
 1.32A 4pooB-5ep8A:
undetectable		 4pooB-5ep8A:
19.35
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.
5evj ARSENITE
METHYLTRANSFERASE

(Chlamydomonas
reinhardtii) 		PF13847
(Methyltransf_31) 		5 GLY A  93
ASP A  97
ASP A 115
ASN A 169
SER A 175
 None
 1.39A 4pooB-5evjA:
12.0		 4pooB-5evjA:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5f7u CYCLOALTERNAN-FORMIN
G ENZYME

(Listeria
monocytogenes) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
PF16338
(DUF4968)
PF16990
(CBM_35) 		5 GLY A 744
ASN A 743
ASP A 380
SER A 651
ASN A 377
 None
None
MG  A1102 ( 4.9A)
None
MG  A1102 (-2.6A)
 1.30A 4pooB-5f7uA:
undetectable		 4pooB-5f7uA:
11.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fir 5'-3'
EXORIBONUCLEASE 2
HOMOLOG

(Caenorhabditis
elegans) 		PF03159
(XRN_N) 		5 HIS A 228
ASP A  49
ILE A 710
HIS A 716
SER A 718
 None
 1.25A 4pooB-5firA:
3.8		 4pooB-5firA:
14.60
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.
5fr8 TONB-DEPENDENT
SIDEROPHORE RECEPTOR

(Acinetobacter
baumannii) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 THR A 714
GLY A  77
ASN A  79
GLN A  75
SER A 670
 None
 1.38A 4pooB-5fr8A:
undetectable		 4pooB-5fr8A:
14.44
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.
5ihr PROBABLE
BETA-GALACTOSIDASE A

(Aspergillus
niger) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		5 THR A 348
GLY A 346
HIS A  68
ASN A 349
SER A 944
 None
None
None
None
NAG  A1374 (-3.7A)
 1.36A 4pooB-5ihrA:
undetectable		 4pooB-5ihrA:
12.01
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.
5ik2 ATP SYNTHASE SUBUNIT
ALPHA

(Caldalkalibacillus
thermarum) 		PF00006
(ATP-synt_ab)
PF00306
(ATP-synt_ab_C)
PF02874
(ATP-synt_ab_N) 		5 GLY A  72
ASN A  65
ILE A  32
GLN A  33
HIS A  42
 None
 1.38A 4pooB-5ik2A:
3.1		 4pooB-5ik2A:
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.
5j98 VP2

(Slow bee
paralysis virus) 		PF00073
(Rhv) 		5 THR B  99
ASN B 103
ASP B  89
ILE B 109
ASN B 100
 None
 1.39A 4pooB-5j98B:
undetectable		 4pooB-5j98B:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kca CEREBELLIN-1,CEREBEL
LIN-1,CEREBELLIN-1,G
LUTAMATE RECEPTOR
IONOTROPIC, DELTA-2

(Homo sapiens) 		PF00386
(C1q)
PF01094
(ANF_receptor) 		5 THR A 629
GLY A 877
ASN A 876
HIS A 602
SER A 581
 None
 1.22A 4pooB-5kcaA:
2.7		 4pooB-5kcaA:
14.94
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.
5ko3 ORF1A

(Middle East
respiratory
syndrome-related
coronavirus) 		PF08715
(Viral_protease) 		5 THR A 159
GLY A 161
ASN A 109
ASP A 164
SER A  85
 None
None
CME  A 111 ( 3.9A)
None
None
 1.36A 4pooB-5ko3A:
undetectable		 4pooB-5ko3A:
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.
5l2e GLUTAMATE RECEPTOR
IONOTROPIC,
DELTA-2,GLUTAMATE
RECEPTOR IONOTROPIC,
DELTA-2

(Rattus
norvegicus) 		PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		5 THR A 143
GLY A 391
ASN A 390
HIS A 116
SER A  95
 None
 1.26A 4pooB-5l2eA:
2.4		 4pooB-5l2eA:
15.65
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.
5ti1 FUMARYLACETOACETATE
HYDROLASE

(Paraburkholderia
xenovorans) 		PF01557
(FAA_hydrolase)
PF09298
(FAA_hydrolase_N) 		5 THR A 144
GLY A 142
ASP A 363
ILE A 225
ASN A 179
 None
 1.33A 4pooB-5ti1A:
undetectable		 4pooB-5ti1A:
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.
5vwn TRIOSEPHOSPHATE
ISOMERASE

(Trichomonas
vaginalis) 		no annotation 5 THR A  84
ASN A   9
HIS A  88
ILE A  81
ASN A  64
 None
 1.39A 4pooB-5vwnA:
undetectable		 4pooB-5vwnA:
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.
5xwy A TYPE VI-A
CRISPR-CAS
RNA-GUIDED RNA
RIBONUCLEASE, CAS13A

(Leptotrichia
buccalis) 		no annotation 5 ASN A 347
ASP A 342
ASP A 974
ILE A 970
ASN A 339
 U  B  26 ( 4.4A)
None
None
None
C  B   8 ( 3.5A)
 1.34A 4pooB-5xwyA:
undetectable		 4pooB-5xwyA:
10.78
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.
6ao8 ARGININE--TRNA
LIGASE

(Neisseria
gonorrhoeae) 		PF00750
(tRNA-synt_1d)
PF03485
(Arg_tRNA_synt_N)
PF05746
(DALR_1) 		5 GLY A 160
ASN A 123
HIS A 132
ASP A 161
ASN A 157
 ARG  A 601 ( 4.6A)
ARG  A 601 (-3.4A)
ARG  A 601 (-4.0A)
None
None
 1.36A 4pooB-6ao8A:
2.1		 4pooB-6ao8A:
18.01
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.
6eoj PROTEIN CFT1

(Saccharomyces
cerevisiae) 		no annotation 5 GLY A1146
ASP A1189
ASP A1142
ILE A1124
SER A1088
 None
 1.33A 4pooB-6eojA:
undetectable		 4pooB-6eojA:
10.64