SIMILAR PATTERNS OF AMINO ACIDS FOR 5HFJ_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.
1boo PROTEIN (N-4
CYTOSINE-SPECIFIC
METHYLTRANSFERASE
PVU II)

(Proteus
vulgaris) 		PF01555
(N6_N4_Mtase) 		6 HIS A 246
PHE A 273
GLY A 275
SER A 276
THR A 278
TYR A 299
 SAH  A 401 (-4.0A)
SAH  A 401 (-4.6A)
SAH  A 401 (-3.5A)
SAH  A 401 (-2.7A)
SAH  A 401 (-4.0A)
SAH  A 401 (-4.2A)
 0.73A 5hfjB-1booA:
19.9		 5hfjB-1booA:
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.
1boo PROTEIN (N-4
CYTOSINE-SPECIFIC
METHYLTRANSFERASE
PVU II)

(Proteus
vulgaris) 		PF01555
(N6_N4_Mtase) 		6 PRO A  55
HIS A 246
PHE A 273
GLY A 275
THR A 278
TYR A 299
 SAH  A 401 (-3.9A)
SAH  A 401 (-4.0A)
SAH  A 401 (-4.6A)
SAH  A 401 (-3.5A)
SAH  A 401 (-4.0A)
SAH  A 401 (-4.2A)
 0.53A 5hfjB-1booA:
19.9		 5hfjB-1booA:
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.
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 ALA A 514
ASP A 428
HIS A 468
GLY A 463
SER A 462
 None
 1.18A 5hfjB-1f4hA:
undetectable		 5hfjB-1f4hA:
12.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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 ALA A 514
HIS A 468
GLY A 463
SER A 462
THR A 417
 None
 1.17A 5hfjB-1f4hA:
undetectable		 5hfjB-1f4hA:
12.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fi4 MEVALONATE
5-DIPHOSPHATE
DECARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00288
(GHMP_kinases_N) 		5 ALA A 166
GLN A 380
GLY A 162
SER A 377
SER A  36
 None
 1.22A 5hfjB-1fi4A:
undetectable		 5hfjB-1fi4A:
17.77
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.
1g60 ADENINE-SPECIFIC
METHYLTRANSFERASE
MBOIIA

(Moraxella bovis) 		PF01555
(N6_N4_Mtase) 		5 ASP A  30
PHE A 220
GLY A 222
THR A 225
TYR A 246
 SAM  A 500 (-3.7A)
SAM  A 500 (-4.6A)
SAM  A 500 (-3.2A)
SAM  A 500 (-3.4A)
SAM  A 500 (-4.4A)
 0.60A 5hfjB-1g60A:
23.0		 5hfjB-1g60A:
29.63
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.
1g60 ADENINE-SPECIFIC
METHYLTRANSFERASE
MBOIIA

(Moraxella bovis) 		PF01555
(N6_N4_Mtase) 		5 ASP A  30
PRO A  32
PHE A 220
GLY A 222
THR A 225
 SAM  A 500 (-3.7A)
None
SAM  A 500 (-4.6A)
SAM  A 500 (-3.2A)
SAM  A 500 (-3.4A)
 0.72A 5hfjB-1g60A:
23.0		 5hfjB-1g60A:
29.63
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.
1g60 ADENINE-SPECIFIC
METHYLTRANSFERASE
MBOIIA

(Moraxella bovis) 		PF01555
(N6_N4_Mtase) 		5 PHE A 220
GLY A 222
SER A 223
THR A 225
TYR A 246
 SAM  A 500 (-4.6A)
SAM  A 500 (-3.2A)
SAM  A 500 (-2.8A)
SAM  A 500 (-3.4A)
SAM  A 500 (-4.4A)
 0.76A 5hfjB-1g60A:
23.0		 5hfjB-1g60A:
29.63
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.
1g60 ADENINE-SPECIFIC
METHYLTRANSFERASE
MBOIIA

(Moraxella bovis) 		PF01555
(N6_N4_Mtase) 		5 PRO A  32
PHE A 220
GLY A 222
SER A 223
THR A 225
 None
SAM  A 500 (-4.6A)
SAM  A 500 (-3.2A)
SAM  A 500 (-2.8A)
SAM  A 500 (-3.4A)
 0.80A 5hfjB-1g60A:
23.0		 5hfjB-1g60A:
29.63
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.
1ggp PROTEIN (LECTIN 1 B
CHAIN)

(Trichosanthes
kirilowii) 		PF00652
(Ricin_B_lectin) 		5 ALA B 243
PRO B 259
GLY B 151
SER B 150
SER B 240
 None
 1.31A 5hfjB-1ggpB:
undetectable		 5hfjB-1ggpB:
23.08
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.
1nku 3-METHYLADENINE DNA
GLYCOSYLASE I (TAG)

(Escherichia
coli) 		PF03352
(Adenine_glyco) 		5 ALA A 148
ASP A 114
PHE A 115
THR A  26
TYR A 102
 None
 1.33A 5hfjB-1nkuA:
undetectable		 5hfjB-1nkuA:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nw5 MODIFICATION
METHYLASE RSRI

(Rhodobacter
sphaeroides) 		PF01555
(N6_N4_Mtase) 		7 ASP A  65
PRO A  67
HIS A 223
THR A 225
GLN A 226
PHE A 250
GLY A 252
 SAM  A 401 (-3.3A)
SAM  A 401 (-4.3A)
SAM  A 401 (-4.0A)
SAM  A 401 (-3.6A)
None
SAM  A 401 (-4.7A)
SAM  A 401 (-3.3A)
 0.60A 5hfjB-1nw5A:
20.9		 5hfjB-1nw5A:
24.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nw5 MODIFICATION
METHYLASE RSRI

(Rhodobacter
sphaeroides) 		PF01555
(N6_N4_Mtase) 		7 PRO A  67
HIS A 223
THR A 225
GLN A 226
PHE A 250
GLY A 252
SER A 253
 SAM  A 401 (-4.3A)
SAM  A 401 (-4.0A)
SAM  A 401 (-3.6A)
None
SAM  A 401 (-4.7A)
SAM  A 401 (-3.3A)
SAM  A 401 (-2.8A)
 0.96A 5hfjB-1nw5A:
20.9		 5hfjB-1nw5A:
24.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1o5t TRYPTOPHANYL-TRNA
SYNTHETASE

(Homo sapiens) 		PF00579
(tRNA-synt_1b) 		5 ASP A 397
HIS A 387
THR A 427
PHE A 400
GLY A 392
 None
 1.33A 5hfjB-1o5tA:
undetectable		 5hfjB-1o5tA:
18.28
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.
1ofi ATP-DEPENDENT
PROTEASE HSLV

(Haemophilus
influenzae) 		PF00227
(Proteasome) 		5 ALA G 134
GLY G 127
SER G 125
THR G   1
SER G 132
 None
None
LVS  G   0 (-3.7A)
LVS  G   0 (-2.3A)
None
 1.27A 5hfjB-1ofiG:
undetectable		 5hfjB-1ofiG:
21.25
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.
1ouv CONSERVED
HYPOTHETICAL
SECRETED PROTEIN

(Helicobacter
pylori) 		PF08238
(Sel1) 		5 ALA A 156
ASP A 168
HIS A 101
GLY A 135
TYR A 124
 None
 1.19A 5hfjB-1ouvA:
undetectable		 5hfjB-1ouvA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pby QUINOHEMOPROTEIN
AMINE DEHYDROGENASE
40 KDA SUBUNIT

(Paracoccus
denitrificans) 		no annotation 5 ALA B 328
HIS B 280
SER B 281
SER B 284
TYR B 282
 None
 1.14A 5hfjB-1pbyB:
undetectable		 5hfjB-1pbyB:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1r6u TRYPTOPHANYL-TRNA
SYNTHETASE

(Homo sapiens) 		PF00579
(tRNA-synt_1b) 		5 ASP A 397
HIS A 387
THR A 427
PHE A 400
GLY A 392
 None
 1.31A 5hfjB-1r6uA:
2.6		 5hfjB-1r6uA:
19.91
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.
1t8w AMP NUCLEOSIDASE

(Escherichia
coli) 		PF01048
(PNP_UDP_1)
PF10423
(AMNp_N) 		5 ALA A  27
PRO A 147
PHE A  52
THR A  86
TYR A 125
 None
 1.31A 5hfjB-1t8wA:
undetectable		 5hfjB-1t8wA:
18.69
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.
1tkc TRANSKETOLASE

(Saccharomyces
cerevisiae) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 ALA A 420
THR A 384
GLY A 440
THR A 468
TYR A 438
 None
 1.21A 5hfjB-1tkcA:
undetectable		 5hfjB-1tkcA:
15.34
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.
1ux6 THROMBOSPONDIN-1

(Homo sapiens) 		PF02412
(TSP_3)
PF05735
(TSP_C) 		5 ASP A 975
PRO A 949
GLN A 970
GLY A 977
SER A1014
 CA  A2016 (-3.4A)
None
None
None
None
 1.31A 5hfjB-1ux6A:
undetectable		 5hfjB-1ux6A:
20.47
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.
1xr5 GENOME POLYPROTEIN

(Rhinovirus B) 		PF00680
(RdRP_1) 		5 PRO A 153
GLY A 117
THR A 114
SER A 122
TYR A 120
 None
 1.21A 5hfjB-1xr5A:
undetectable		 5hfjB-1xr5A:
20.30
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.
2c81 GLUTAMINE-2-DEOXY-SC
YLLO-INOSOSE
AMINOTRANSFERASE

(Bacillus
circulans) 		PF01041
(DegT_DnrJ_EryC1) 		5 ALA A  48
THR A  68
GLY A 200
SER A 187
SER A 255
 None
None
None
PMP  A1416 (-2.5A)
None
 1.17A 5hfjB-2c81A:
undetectable		 5hfjB-2c81A:
19.76
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.
2esr METHYLTRANSFERASE

(Streptococcus
pyogenes) 		PF03602
(Cons_hypoth95) 		6 ALA A 100
ASP A 117
PRO A 119
PHE A  49
GLY A  51
SER A  52
 None
 0.81A 5hfjB-2esrA:
3.8		 5hfjB-2esrA:
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.
2fhp METHYLASE, PUTATIVE

(Enterococcus
faecalis) 		PF03602
(Cons_hypoth95) 		5 ALA A 100
ASP A 120
PRO A 122
GLY A  51
SER A  52
 None
 0.96A 5hfjB-2fhpA:
4.5		 5hfjB-2fhpA:
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.
2fpo METHYLASE YHHF

(Escherichia
coli) 		PF03602
(Cons_hypoth95) 		5 ALA A 110
ASP A 127
PRO A 129
PHE A  60
GLY A  62
 CL  A 401 (-3.8A)
None
None
None
None
 0.91A 5hfjB-2fpoA:
4.0		 5hfjB-2fpoA:
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.
2iwa GLUTAMINE
CYCLOTRANSFERASE

(Carica papaya) 		PF05096
(Glu_cyclase_2) 		5 ALA A  51
THR A  60
GLN A  46
PHE A  57
GLY A  47
 None
 1.29A 5hfjB-2iwaA:
undetectable		 5hfjB-2iwaA:
20.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jjq UNCHARACTERIZED RNA
METHYLTRANSFERASE
PYRAB10780

(Pyrococcus
abyssi) 		PF05958
(tRNA_U5-meth_tr) 		5 ASP A 340
PRO A 342
GLY A 280
THR A 283
SER A 300
 SAH  A1406 (-3.8A)
SAH  A1406 (-4.1A)
SAH  A1406 (-3.4A)
SAH  A1406 (-3.4A)
SAH  A1406 (-2.9A)
 0.95A 5hfjB-2jjqA:
2.2		 5hfjB-2jjqA:
18.50
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.
2ker ALPHA-AMYLASE
INHIBITOR Z-2685

(Streptomyces
parvulus) 		PF01356
(A_amylase_inhib) 		5 ALA A  41
ASP A  20
PHE A  54
GLY A  56
TYR A  63
 None
 1.00A 5hfjB-2kerA:
undetectable		 5hfjB-2kerA:
17.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o3i HYPOTHETICAL PROTEIN

(Chromobacterium
violaceum) 		PF06032
(DUF917) 		5 ALA A 134
PRO A 139
GLY A  24
SER A 333
THR A  27
 None
 1.01A 5hfjB-2o3iA:
undetectable		 5hfjB-2o3iA:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rhp THROMBOSPONDIN-2

(Homo sapiens) 		PF02412
(TSP_3)
PF05735
(TSP_C)
PF07645
(EGF_CA)
PF12947
(EGF_3) 		5 ASP A 995
PRO A 969
GLN A 990
GLY A 997
SER A1034
 None
 1.20A 5hfjB-2rhpA:
undetectable		 5hfjB-2rhpA:
17.36
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.
2wk2 CHITINASE A

(Serratia
marcescens) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		5 ALA A 464
PRO A 459
HIS A 403
GLY A 402
THR A 416
 None
 1.19A 5hfjB-2wk2A:
undetectable		 5hfjB-2wk2A:
17.08
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.
2yyv PROBABLE
2-PHOSPHOSULFOLACTAT
E PHOSPHATASE

(Thermotoga
maritima) 		PF04029
(2-ph_phosp) 		5 ALA A 111
PRO A  42
PHE A 221
GLY A  39
SER A  38
 None
 0.92A 5hfjB-2yyvA:
undetectable		 5hfjB-2yyvA:
23.69
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.
2zie PUTATIVE
MODIFICATION
METHYLASE

(Thermus
thermophilus) 		PF01555
(N6_N4_Mtase) 		5 ALA A  29
PRO A  49
GLY A 245
THR A 248
TYR A 269
 None
 0.83A 5hfjB-2zieA:
20.1		 5hfjB-2zieA:
26.58
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.
2zie PUTATIVE
MODIFICATION
METHYLASE

(Thermus
thermophilus) 		PF01555
(N6_N4_Mtase) 		5 ALA A  29
PRO A  49
PHE A 243
GLY A 245
TYR A 269
 None
 0.50A 5hfjB-2zieA:
20.1		 5hfjB-2zieA:
26.58
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.
3a21 PUTATIVE SECRETED
ALPHA-GALACTOSIDASE

(Streptomyces
avermitilis) 		PF00652
(Ricin_B_lectin)
PF16499
(Melibiase_2) 		5 ALA A 198
THR A 552
GLN A 266
GLY A 227
SER A 245
 None
 1.13A 5hfjB-3a21A:
undetectable		 5hfjB-3a21A:
16.61
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.
3e9m OXIDOREDUCTASE,
GFO/IDH/MOCA FAMILY

(Enterococcus
faecalis) 		PF01408
(GFO_IDH_MocA) 		5 ALA A 200
GLN A 183
GLY A 178
SER A 179
THR A 306
 None
 1.30A 5hfjB-3e9mA:
2.5		 5hfjB-3e9mA:
19.18
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.
3fj7 MAJOR ANTIGENIC
PEPTIDE PEB3

(Campylobacter
jejuni) 		PF13531
(SBP_bac_11) 		5 ALA A 174
ASP A 191
HIS A  31
THR A  32
GLY A  28
 None
None
None
None
PEQ  A 301 (-3.5A)
 1.20A 5hfjB-3fj7A:
undetectable		 5hfjB-3fj7A:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g87 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE

(Burkholderia
pseudomallei) 		PF00698
(Acyl_transf_1) 		5 ALA A  98
GLN A  17
PHE A  11
GLY A  13
THR A  62
 None
 1.22A 5hfjB-3g87A:
undetectable		 5hfjB-3g87A:
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.
3ing HOMOSERINE
DEHYDROGENASE

(Thermoplasma
acidophilum) 		PF00742
(Homoserine_dh)
PF03447
(NAD_binding_3) 		5 ALA A 213
ASP A 303
GLY A 285
SER A 299
TYR A 286
 None
 1.29A 5hfjB-3ingA:
undetectable		 5hfjB-3ingA:
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.
3ipc ABC TRANSPORTER,
SUBSTRATE BINDING
PROTEIN (AMINO ACID)

(Agrobacterium
fabrum) 		PF13458
(Peripla_BP_6) 		5 ASP A  50
PRO A  10
GLY A  58
SER A  60
SER A  82
 None
 1.21A 5hfjB-3ipcA:
3.5		 5hfjB-3ipcA:
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.
3iqd OCTOPINE
DEHYDROGENASE

(Pecten maximus) 		PF02317
(Octopine_DH) 		5 ALA B  36
HIS B  15
PHE B  35
GLY B  10
THR B  89
 None
None
NAI  B 405 (-3.7A)
NAI  B 405 (-3.2A)
None
 1.16A 5hfjB-3iqdB:
undetectable		 5hfjB-3iqdB:
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.
3jb9 PRE-MRNA-SPLICING
FACTOR PRP5

(Schizosaccharomyces
pombe) 		PF00400
(WD40) 		5 ALA K 390
ASP K 352
GLY K 349
SER K 348
SER K 388
 None
 1.26A 5hfjB-3jb9K:
undetectable		 5hfjB-3jb9K:
21.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l7o RIBOSE-5-PHOSPHATE
ISOMERASE A

(Streptococcus
mutans) 		PF06026
(Rib_5-P_isom_A) 		5 PRO A 133
PHE A 130
GLY A 128
SER A 180
THR A 126
 None
 1.24A 5hfjB-3l7oA:
undetectable		 5hfjB-3l7oA:
20.08
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.
3ldu PUTATIVE METHYLASE

(Clostridioides
difficile) 		PF01170
(UPF0020)
PF02926
(THUMP) 		5 ALA A 290
PRO A 307
GLY A 202
SER A 203
THR A 205
 GTP  A 383 (-3.7A)
GTP  A 383 (-3.7A)
GTP  A 383 (-2.6A)
GTP  A 383 (-2.7A)
GTP  A 383 (-3.5A)
 0.75A 5hfjB-3lduA:
2.0		 5hfjB-3lduA:
23.08
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.
3mpi GLUTARYL-COA
DEHYDROGENASE

(Desulfococcus
multivorans) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 ALA A 144
ASP A 233
PRO A 231
GLY A 183
SER A 181
 None
None
None
None
GRA  A 402 (-2.6A)
 1.03A 5hfjB-3mpiA:
undetectable		 5hfjB-3mpiA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3na0 CHOLESTEROL
SIDE-CHAIN CLEAVAGE
ENZYME,
MITOCHONDRIAL

(Homo sapiens) 		PF00067
(p450) 		5 PRO A 506
GLN A 488
GLY A 196
SER A 195
THR A 510
 None
 1.03A 5hfjB-3na0A:
undetectable		 5hfjB-3na0A:
18.91
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.
3oz2 DIGERANYLGERANYLGLYC
EROPHOSPHOLIPID
REDUCTASE

(Thermoplasma
acidophilum) 		PF01494
(FAD_binding_3) 		5 ALA A 137
THR A 310
GLY A 277
THR A 274
TYR A 319
 None
None
None
GOL  A 514 (-3.8A)
None
 1.14A 5hfjB-3oz2A:
undetectable		 5hfjB-3oz2A:
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.
3ptw MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE

(Clostridium
perfringens) 		PF00698
(Acyl_transf_1) 		5 ALA A  97
GLN A  14
PHE A   8
GLY A  10
THR A  62
 None
 1.25A 5hfjB-3ptwA:
undetectable		 5hfjB-3ptwA:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qdq 4-HYDROXYBUTYRATE
COA-TRANSFERASE

(Clostridium
aminobutyricum) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		5 ALA A  17
PRO A  36
HIS A 181
GLN A 158
SER A 180
 None
 1.07A 5hfjB-3qdqA:
undetectable		 5hfjB-3qdqA:
19.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qz1 STEROID
21-HYDROXYLASE

(Bos taurus) 		PF00067
(p450) 		5 ALA A  81
GLN A  94
PHE A  89
GLY A  91
TYR A 113
 None
 1.26A 5hfjB-3qz1A:
undetectable		 5hfjB-3qz1A:
19.00
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.
3rq1 AMINOTRANSFERASE
CLASS I AND II

(Veillonella
parvula) 		PF00155
(Aminotran_1_2) 		5 ALA A  77
GLY A 269
SER A 256
SER A 102
TYR A 255
 None
 1.34A 5hfjB-3rq1A:
undetectable		 5hfjB-3rq1A:
19.86
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.
3tm5 CRYSTAL STRUCTURE OF
TRM14

(Pyrococcus
furiosus) 		PF01170
(UPF0020)
PF02926
(THUMP) 		6 ALA A 277
PRO A 295
HIS A 198
GLY A 227
SER A 228
THR A 230
 SFG  A 401 (-3.1A)
SFG  A 401 ( 4.4A)
SFG  A 401 (-3.8A)
SFG  A 401 ( 3.7A)
SFG  A 401 (-3.6A)
SFG  A 401 (-3.3A)
 0.65A 5hfjB-3tm5A:
3.3		 5hfjB-3tm5A:
23.36
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.
3tma METHYLTRANSFERASE

(Thermus
thermophilus) 		PF01170
(UPF0020)
PF02926
(THUMP) 		6 ALA A 244
PRO A 262
PHE A 192
GLY A 194
SER A 195
THR A 197
 None
 0.88A 5hfjB-3tmaA:
2.9		 5hfjB-3tmaA:
17.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ut2 CATALASE-PEROXIDASE
2

(Magnaporthe
oryzae) 		PF00141
(peroxidase) 		5 ASP A 483
GLN A 482
GLY A 464
THR A 466
SER A 530
 None
 1.18A 5hfjB-3ut2A:
undetectable		 5hfjB-3ut2A:
16.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v8v RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE L

(Escherichia
coli) 		PF01170
(UPF0020)
PF02926
(THUMP)
PF10672
(Methyltrans_SAM) 		5 PRO A 311
GLY A 199
SER A 200
THR A 202
SER A 263
 SAM  A 801 ( 4.1A)
SAM  A 801 (-3.2A)
SAM  A 801 (-3.0A)
SAM  A 801 (-4.1A)
SAM  A 801 (-3.5A)
 0.64A 5hfjB-3v8vA:
2.7		 5hfjB-3v8vA:
14.74
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.
3viu PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE 2

(Thermus
thermophilus) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		5 ALA A 539
PRO A 536
GLY A 490
SER A 491
THR A 494
 None
 1.21A 5hfjB-3viuA:
undetectable		 5hfjB-3viuA:
14.56
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.
3vte TETRAHYDROCANNABINOL
IC ACID SYNTHASE

(Cannabis sativa) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 ALA A 380
ASP A 408
GLY A 412
THR A 295
SER A 382
 None
 1.24A 5hfjB-3vteA:
undetectable		 5hfjB-3vteA:
18.22
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.
3zx1 OXIDOREDUCTASE,
PUTATIVE

(Campylobacter
jejuni) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 ASP A 290
HIS A 442
THR A 470
GLY A 142
THR A 446
 None
CU  A 604 ( 3.0A)
None
None
None
 1.20A 5hfjB-3zx1A:
undetectable		 5hfjB-3zx1A:
19.50
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.
4b4d FERREDOXIN-NADP
REDUCTASE

(Xanthomonas
citri) 		PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		5 ALA A 213
GLY A 248
SER A 241
THR A 246
TYR A 250
 None
 1.21A 5hfjB-4b4dA:
undetectable		 5hfjB-4b4dA:
22.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ii2 UBIQUITIN-CONJUGATIN
G ENZYME E2 4

(Schizosaccharomyces
pombe) 		PF00179
(UQ_con) 		5 ALA C  35
THR C 111
GLY C  39
THR C 142
SER C  21
 None
 1.33A 5hfjB-4ii2C:
undetectable		 5hfjB-4ii2C:
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.
4it4 CG17282

(Drosophila
melanogaster) 		no annotation 5 ALA A 198
PRO A 150
PHE A 146
GLY A 142
SER A 141
 None
 1.20A 5hfjB-4it4A:
undetectable		 5hfjB-4it4A:
22.27
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.
4mbo SERINE-RICH REPEAT
ADHESION
GLYCOPROTEIN (SRR1)

(Streptococcus
agalactiae) 		PF10425
(SdrG_C_C) 		5 GLN A 615
GLY A 618
SER A 611
THR A 609
TYR A 617
 None
MES  A 706 (-4.1A)
MES  A 706 ( 4.7A)
None
None
 1.31A 5hfjB-4mboA:
undetectable		 5hfjB-4mboA:
21.16
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.
4mrq PHOSPHOMANNOMUTASE/P
HOSPHOGLUCOMUTASE

(Pseudomonas
aeruginosa) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 ALA A 188
HIS A 213
PHE A 241
GLY A 180
TYR A 203
 None
 0.68A 5hfjB-4mrqA:
undetectable		 5hfjB-4mrqA:
19.61
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.
4qan HYPOTHETICAL PROTEIN

([Ruminococcus]
gnavus) 		no annotation 5 ALA A 261
GLN A 382
PHE A 273
SER A 383
THR A 371
 None
 1.17A 5hfjB-4qanA:
undetectable		 5hfjB-4qanA:
19.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rv3 1-PHOSPHATIDYLINOSIT
OL PHOSPHODIESTERASE

(Staphylococcus
aureus) 		PF00388
(PI-PLC-X) 		5 ALA A  96
ASP A  65
GLY A  33
SER A  34
THR A  48
 None
 1.15A 5hfjB-4rv3A:
undetectable		 5hfjB-4rv3A:
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.
4tyz UNCHARACTERIZED
PROTEIN

(Leishmania
infantum) 		PF02893
(GRAM) 		5 ALA A 719
GLY A 655
SER A 668
SER A 641
TYR A 656
 None
 1.28A 5hfjB-4tyzA:
undetectable		 5hfjB-4tyzA:
18.86
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.
4y23 GAMMA GLUTAMYL
TRANSPEPTIDASE,GAMMA
-GLUTAMYLTRANSPEPTID
ASE

(Bacillus
licheniformis) 		PF01019
(G_glu_transpept) 		5 HIS A 401
THR A 403
GLN A 552
GLY A 478
SER A 283
 None
 1.33A 5hfjB-4y23A:
undetectable		 5hfjB-4y23A:
16.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yla AROMATIC
PRENYLTRANSFERASE

(Marinactinospora
thermotolerans) 		PF11991
(Trp_DMAT) 		5 ALA A 241
PRO A   5
PHE A   6
GLY A 220
SER A 221
 None
None
None
ILV  A 401 (-3.8A)
ILV  A 401 (-4.7A)
 1.19A 5hfjB-4ylaA:
undetectable		 5hfjB-4ylaA:
17.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zcf RESTRICTION
ENDONUCLEASE
ECOP15I,
MODIFICATION SUBUNIT

(Escherichia
coli) 		PF01555
(N6_N4_Mtase) 		5 ASP A 123
PRO A 125
PHE A 441
GLY A 443
THR A 446
 None
 0.72A 5hfjB-4zcfA:
18.2		 5hfjB-4zcfA:
17.36
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.
5b71 SKY59 FAB HEAVY
CHAIN
COMPLEMENT C5 BETA
CHAIN

(Homo sapiens;
Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set)
no annotation 		5 ALA B  24
HIS E  70
THR E  53
GLY B  55
SER B  56
 None
 1.17A 5hfjB-5b71B:
undetectable		 5hfjB-5b71B:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c7o GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
TESTIS-SPECIFIC

(Homo sapiens) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 ALA O 347
ASP O 398
GLY O 391
SER O 393
TYR O 390
 None
 1.34A 5hfjB-5c7oO:
2.1		 5hfjB-5c7oO:
19.28
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.
5ccx TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
CATALYTIC SUBUNIT
TRMT61A
TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
NON-CATALYTIC
SUBUNIT TRM6

(Homo sapiens;
Homo sapiens) 		PF08704
(GCD14)
PF04189
(Gcd10p) 		5 PHE B 457
GLY A  55
SER A  56
SER A  19
TYR A  67
 None
 1.15A 5hfjB-5ccxB:
3.0		 5hfjB-5ccxB:
18.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ch8 MONO- AND
DIACYLGLYCEROL
LIPASE

(Penicillium
cyclopium) 		PF01764
(Lipase_3)
PF03893
(Lipase3_N) 		5 THR A  61
PHE A  80
GLY A  82
SER A  83
SER A  20
 CL  A 306 (-4.7A)
None
GOL  A 308 (-3.5A)
GOL  A 308 (-4.7A)
None
 1.32A 5hfjB-5ch8A:
undetectable		 5hfjB-5ch8A:
24.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cm2 TRNA
METHYLTRANSFERASE
ACTIVATOR SUBUNIT
TRNA
METHYLTRANSFERASE

(Yarrowia
lipolytica;
Yarrowia
lipolytica) 		PF03966
(Trm112p)
PF08241
(Methyltransf_11) 		5 ALA M  55
PRO Z 112
PHE M  23
GLY M  20
SER M  19
 None
 1.27A 5hfjB-5cm2M:
undetectable		 5hfjB-5cm2M:
20.26
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.
5dz6 POLYKETIDE
BIOSYNTHESIS MALONYL
COA-ACYL CARRIER
PROTEIN TRANSACYLASE
PKSC

(Bacillus
subtilis) 		PF00698
(Acyl_transf_1) 		5 ALA A  93
GLN A  12
PHE A   6
GLY A   8
THR A  57
 None
None
None
None
CL  A 305 ( 4.0A)
 1.23A 5hfjB-5dz6A:
undetectable		 5hfjB-5dz6A:
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.
5dz7 POLYKETIDE
BIOSYNTHESIS PROTEIN
PKSE

(Bacillus
subtilis) 		PF00698
(Acyl_transf_1) 		5 ALA A  93
GLN A  12
PHE A   6
GLY A   8
THR A  57
 None
 1.15A 5hfjB-5dz7A:
undetectable		 5hfjB-5dz7A:
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.
5e53 CONTACTIN-1

(Gallus gallus) 		PF00041
(fn3) 		5 ALA A 878
GLN A 853
GLY A 830
SER A 851
TYR A 831
 None
 1.34A 5hfjB-5e53A:
undetectable		 5hfjB-5e53A:
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.
5e72 N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE

(Thermococcus
kodakarensis) 		PF01170
(UPF0020)
PF02926
(THUMP) 		5 ALA A 236
ASP A 254
PRO A 256
PHE A 187
GLY A 189
 SAM  A 400 (-3.5A)
None
SAM  A 400 (-4.2A)
SAM  A 400 (-4.7A)
SAM  A 400 (-3.3A)
 0.64A 5hfjB-5e72A:
2.5		 5hfjB-5e72A:
22.91
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.
5exe OXALATE
OXIDOREDUCTASE
SUBUNIT ALPHA
OXALATE
OXIDOREDUCTASE
SUBUNIT BETA

(Moorella
thermoacetica;
Moorella
thermoacetica) 		PF01855
(POR_N)
PF17147
(PFOR_II)
PF02775
(TPP_enzyme_C) 		5 ALA A  51
THR C 148
GLN C 147
SER A  38
THR A  34
 None
 0.97A 5hfjB-5exeA:
undetectable		 5hfjB-5exeA:
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.
5fkc BETA-FRUCTOFURANOSID
ASE

(Xanthophyllomyces
dendrorhous) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		5 ALA A 112
PRO A  81
THR A 304
GLY A 147
THR A 163
 None
None
FRU  A3001 ( 4.9A)
None
None
 1.15A 5hfjB-5fkcA:
undetectable		 5hfjB-5fkcA:
16.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hfj ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA)

(Helicobacter
pylori) 		PF01555
(N6_N4_Mtase) 		5 ALA A   7
GLY A 197
SER A 198
THR A 200
TYR A 221
 None
SAM  A 301 (-3.4A)
SAM  A 301 (-2.5A)
SAM  A 301 (-3.6A)
SAM  A 301 (-4.2A)
 0.98A 5hfjB-5hfjA:
33.5		 5hfjB-5hfjA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hfj ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA)

(Helicobacter
pylori) 		PF01555
(N6_N4_Mtase) 		9 ALA A   9
ASP A  29
PRO A  31
PHE A 195
GLY A 197
SER A 198
THR A 200
SER A 217
TYR A 221
 SAM  A 301 (-3.2A)
SAM  A 301 (-3.2A)
SAM  A 301 ( 4.0A)
SAM  A 301 (-4.6A)
SAM  A 301 (-3.4A)
SAM  A 301 (-2.5A)
SAM  A 301 (-3.6A)
SAM  A 301 (-2.8A)
SAM  A 301 (-4.2A)
 0.66A 5hfjB-5hfjA:
33.5		 5hfjB-5hfjA:
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.
5i2t PERIODIC TRYPTOPHAN
PROTEIN 2

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		5 ALA A 396
HIS A 386
THR A 410
PHE A 403
THR A 391
 None
 1.26A 5hfjB-5i2tA:
undetectable		 5hfjB-5i2tA:
15.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5i3e PUTATIVE
DEOXYRIBONUCLEASE-2

(Burkholderia
thailandensis) 		PF03265
(DNase_II) 		5 ALA A  33
PRO A 135
HIS A 279
GLY A 138
THR A 140
 None
 1.32A 5hfjB-5i3eA:
undetectable		 5hfjB-5i3eA:
19.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5i45 GLYCOSYL
TRANSFERASES GROUP 1
FAMILY PROTEIN

(Francisella
tularensis) 		PF00534
(Glycos_transf_1) 		5 ALA A 187
HIS A 256
GLY A 179
SER A 255
SER A 300
 None
 1.27A 5hfjB-5i45A:
2.6		 5hfjB-5i45A:
21.46
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.
5i51 TRANSKETOLASE

(Scheffersomyces
stipitis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 ALA A 417
THR A 381
GLY A 437
THR A 465
TYR A 435
 None
 1.25A 5hfjB-5i51A:
undetectable		 5hfjB-5i51A:
15.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mc5 XAA-PRO DIPEPTIDASE

(Homo sapiens) 		no annotation 5 ASP A 287
HIS A 206
THR A 289
SER A 203
THR A 465
 MN  A 500 ( 2.3A)
None
None
None
None
 1.31A 5hfjB-5mc5A:
undetectable		 5hfjB-5mc5A:
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.
5mg5 HYDROXYMETHYLGLUTARY
L-COA SYNTHASE

(Pseudomonas
protegens) 		no annotation 5 ALA A  63
THR A  84
GLN A 112
GLY A  81
SER A 117
 None
 1.22A 5hfjB-5mg5A:
undetectable		 5hfjB-5mg5A:
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.
5npu ANC27

(synthetic
construct) 		no annotation 5 ASP A 391
THR A 472
GLY A 440
SER A 443
THR A 389
 None
TPP  A 602 (-3.4A)
TPP  A 602 (-3.3A)
TPP  A 602 (-2.7A)
TPP  A 602 ( 4.5A)
 1.32A 5hfjB-5npuA:
undetectable		 5hfjB-5npuA:
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.
5v5f AT3G11770

(Arabidopsis
thaliana) 		PF01612
(DNA_pol_A_exo1) 		5 ASP A  52
THR A 150
GLN A 110
GLY A 108
SER A  48
 None
 1.04A 5hfjB-5v5fA:
undetectable		 5hfjB-5v5fA:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v6t PLEXIN-D1

(Mus musculus) 		PF08337
(Plexin_cytopl) 		5 ALA A1825
THR A1540
GLN A1524
SER A1709
THR A1713
 None
 1.09A 5hfjB-5v6tA:
undetectable		 5hfjB-5v6tA:
17.98
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.
5vm1 XYLULOKINASE

(Brucella ovis) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 ALA A 299
ASP A 315
PRO A 311
GLY A 397
SER A 398
 None
 1.20A 5hfjB-5vm1A:
undetectable		 5hfjB-5vm1A:
17.85
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.
5w0x TIP41-LIKE PROTEIN

(Mus musculus) 		no annotation 5 ALA A  72
PRO A  46
PHE A 156
GLY A  51
THR A  25
 None
 1.30A 5hfjB-5w0xA:
undetectable		 5hfjB-5w0xA:
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.
5x41 COBALT ABC
TRANSPORTER
ATP-BINDING PROTEIN

(Rhodobacter
capsulatus) 		PF00005
(ABC_tran) 		5 ALA A 224
ASP A 199
THR A 168
SER A 196
SER A  33
 None
 1.34A 5hfjB-5x41A:
undetectable		 5hfjB-5x41A:
19.00
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.
5xcx VH(S112C)-SARAH
CHIMERA
VL-SARAH(S37C)
CHIMERA

(Homo sapiens;
Mus musculus;
Homo sapiens;
Mus musculus) 		PF07686
(V-set)
PF11629
(Mst1_SARAH)
PF07686
(V-set)
PF11629
(Mst1_SARAH) 		5 GLN B 143
GLY A   9
SER A 108
THR A 110
SER A  21
 None
 1.21A 5hfjB-5xcxB:
undetectable		 5hfjB-5xcxB:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yh0 DRFAM20C1

(Danio rerio) 		no annotation 5 ALA A 290
THR A 271
GLN A 269
PHE A 459
THR A 266
 None
 1.21A 5hfjB-5yh0A:
undetectable		 5hfjB-5yh0A:
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.
5zl9 CHITINASE AB

(Serratia
marcescens) 		no annotation 5 ALA A 466
PRO A 461
HIS A 405
GLY A 404
THR A 418
 None
 1.19A 5hfjB-5zl9A:
undetectable		 5hfjB-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.
6d6u GAMMA-AMINOBUTYRIC
ACID RECEPTOR
SUBUNIT
ALPHA-1,GAMMA-AMINOB
UTYRIC ACID RECEPTOR
SUBUNIT ALPHA-1

(Homo sapiens) 		no annotation 5 ALA B 182
THR B 130
GLN B  68
PHE B  46
THR B  43
 None
ABU  A 405 (-3.1A)
None
None
None
 1.29A 5hfjB-6d6uB:
undetectable		 5hfjB-6d6uB:
21.23
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.
6g2j NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
5

(Mus musculus) 		no annotation 5 PRO L 231
PHE L 529
GLY L 527
SER L 523
SER L 531
 None
 1.31A 5hfjB-6g2jL:
undetectable		 5hfjB-6g2jL:
undetectable