SIMILAR PATTERNS OF AMINO ACIDS FOR 5C0O_F_SAMF301

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.
1geg ACETOIN REDUCTASE

(Klebsiella
pneumoniae) 		PF00106
(adh_short) 		5 THR A  76
GLY A  79
GLY A  78
LEU A  77
ALA A 120
 None
 0.93A 5c0oF-1gegA:
5.8		 5c0oF-1gegA:
21.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1i9g HYPOTHETICAL PROTEIN
RV2118C

(Mycobacterium
tuberculosis) 		PF08704
(GCD14)
PF14801
(GCD14_N) 		6 GLY A 109
GLY A 111
LEU A 113
GLU A 131
HIS A 136
ASP A 178
 SAM  A 301 (-3.4A)
SAM  A 301 (-4.2A)
SAM  A 301 (-4.5A)
SAM  A 301 (-2.6A)
SAM  A 301 (-3.7A)
SAM  A 301 (-3.4A)
 0.91A 5c0oF-1i9gA:
26.8		 5c0oF-1i9gA:
38.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jne IMAGINAL DISC GROWTH
FACTOR-2

(Drosophila
melanogaster) 		PF00704
(Glyco_hydro_18) 		6 THR A 194
GLY A  84
GLY A  85
ALA A  50
ASP A 128
LEU A 127
 None
 1.32A 5c0oF-1jneA:
undetectable		 5c0oF-1jneA:
19.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kfw CHITINASE B

(Arthrobacter
sp. TAD20) 		PF00704
(Glyco_hydro_18) 		5 GLY A 407
GLY A 408
GLY A 409
LEU A 323
LEU A 312
 None
 0.96A 5c0oF-1kfwA:
undetectable		 5c0oF-1kfwA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kfw CHITINASE B

(Arthrobacter
sp. TAD20) 		PF00704
(Glyco_hydro_18) 		6 PRO A 109
GLY A 173
GLY A 175
GLY A 176
LEU A 168
GLU A 172
 None
 1.45A 5c0oF-1kfwA:
undetectable		 5c0oF-1kfwA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1l3i PRECORRIN-6Y
METHYLTRANSFERASE/PU
TATIVE DECARBOXYLASE

(Methanothermobacter
thermautotrophicus) 		PF13847
(Methyltransf_31) 		5 PRO A  16
THR A  17
GLY A  43
GLY A  45
GLY A  46
 SAH  A 801 (-4.3A)
SAH  A 801 (-3.7A)
SAH  A 801 (-3.2A)
SAH  A 801 (-4.0A)
SAH  A 801 (-3.2A)
 0.76A 5c0oF-1l3iA:
19.7		 5c0oF-1l3iA:
24.90
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.
1m0s RIBOSE-5-PHOSPHATE
ISOMERASE A

(Haemophilus
influenzae) 		PF06026
(Rib_5-P_isom_A) 		5 GLY A 197
GLY A  95
GLY A  96
ALA A 200
LEU A 126
 None
CIT  A 501 (-3.7A)
CIT  A 501 (-3.3A)
None
None
 0.77A 5c0oF-1m0sA:
2.9		 5c0oF-1m0sA:
22.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1m76 3-HYDROXYACYL-COA
DEHYDROGENASE

(Homo sapiens) 		PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 GLY A  29
GLY A  27
GLY A  24
ALA A  36
LEU A  62
 None
None
NAD  A 350 (-3.1A)
None
None
 0.97A 5c0oF-1m76A:
7.3		 5c0oF-1m76A:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1o8b RIBOSE 5-PHOSPHATE
ISOMERASE

(Escherichia
coli) 		PF06026
(Rib_5-P_isom_A) 		5 GLY A 196
GLY A  95
GLY A  96
ALA A 199
LEU A 126
 None
ABF  A1269 (-3.9A)
ABF  A1269 (-3.7A)
None
None
 0.80A 5c0oF-1o8bA:
undetectable		 5c0oF-1o8bA:
22.26
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.
1tdj BIOSYNTHETIC
THREONINE DEAMINASE

(Escherichia
coli) 		PF00291
(PALP)
PF00585
(Thr_dehydrat_C) 		5 GLY A 188
GLY A 190
GLY A 191
LEU A 192
ALA A 214
 PLP  A 962 (-3.7A)
PLP  A 962 (-3.5A)
PLP  A 962 (-3.1A)
PLP  A 962 (-4.5A)
None
 0.78A 5c0oF-1tdjA:
2.0		 5c0oF-1tdjA:
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.
1tdj BIOSYNTHETIC
THREONINE DEAMINASE

(Escherichia
coli) 		PF00291
(PALP)
PF00585
(Thr_dehydrat_C) 		5 GLY A 188
GLY A 190
GLY A 191
LEU A 192
LEU A 291
 PLP  A 962 (-3.7A)
PLP  A 962 (-3.5A)
PLP  A 962 (-3.1A)
PLP  A 962 (-4.5A)
None
 0.96A 5c0oF-1tdjA:
2.0		 5c0oF-1tdjA:
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.
1tdj BIOSYNTHETIC
THREONINE DEAMINASE

(Escherichia
coli) 		PF00291
(PALP)
PF00585
(Thr_dehydrat_C) 		5 GLY A 190
GLY A 191
LEU A 192
GLU A 213
LEU A 291
 PLP  A 962 (-3.5A)
PLP  A 962 (-3.1A)
PLP  A 962 (-4.5A)
None
None
 0.78A 5c0oF-1tdjA:
2.0		 5c0oF-1tdjA:
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.
1to6 GLYCERATE KINASE

(Neisseria
meningitidis) 		PF02595
(Gly_kinase) 		5 GLY A 139
GLY A 246
GLY A 244
ALA A 223
LEU A 105
 None
None
SO4  A 373 (-3.5A)
None
None
 0.97A 5c0oF-1to6A:
2.6		 5c0oF-1to6A:
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.
1tt7 YHFP

(Bacillus
subtilis) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A  95
GLY A 100
GLY A 101
LEU A 102
ASP A  47
 None
 0.92A 5c0oF-1tt7A:
6.8		 5c0oF-1tt7A:
24.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v71 HYPOTHETICAL PROTEIN
C320.14 IN
CHROMOSOME III

(Schizosaccharomyces
pombe) 		PF00291
(PALP) 		5 GLY A 183
GLY A 185
GLY A 186
LEU A 187
GLU A 208
 PLP  A 350 (-3.3A)
PLP  A 350 (-3.4A)
PLP  A 350 (-3.1A)
PLP  A 350 (-4.9A)
MG  A 360 (-3.2A)
 0.90A 5c0oF-1v71A:
undetectable		 5c0oF-1v71A:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vcg ISOPENTENYL-DIPHOSPH
ATE DELTA-ISOMERASE

(Thermus
thermophilus) 		PF01070
(FMN_dh) 		6 THR A  26
GLY A 190
GLY A 263
GLY A 264
GLU A 188
HIS A 191
 None
FMN  A 501 (-3.8A)
FMN  A 501 (-3.2A)
FMN  A 501 (-4.3A)
None
None
 1.33A 5c0oF-1vcgA:
undetectable		 5c0oF-1vcgA:
25.00
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.
1ysr SENSOR-TYPE
HISTIDINE KINASE
PRRB

(Mycobacterium
tuberculosis) 		PF02518
(HATPase_c) 		5 GLY A 435
GLY A 434
LEU A 433
ALA A 350
ASP A 379
 None
 0.77A 5c0oF-1ysrA:
undetectable		 5c0oF-1ysrA:
21.48
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.
1z3i SIMILAR TO
RAD54-LIKE

(Danio rerio) 		PF00176
(SNF2_N)
PF00271
(Helicase_C) 		5 PRO X 354
GLY X 358
GLY X 371
LEU X 375
ALA X 361
 None
 0.93A 5c0oF-1z3iX:
3.4		 5c0oF-1z3iX:
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.
2amc PHENYLALANYL-TRNA
SYNTHETASE BETA
CHAIN

(Thermus
thermophilus) 		PF01409
(tRNA-synt_2d)
PF01588
(tRNA_bind)
PF03147
(FDX-ACB)
PF03483
(B3_4)
PF03484
(B5) 		5 GLY B 778
GLY B 781
LEU B 697
ALA B 774
LEU B 713
 None
 0.98A 5c0oF-2amcB:
undetectable		 5c0oF-2amcB:
18.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2b25 HYPOTHETICAL PROTEIN

(Homo sapiens) 		PF08704
(GCD14) 		6 GLY A 113
GLY A 115
GLY A 116
GLU A 135
HIS A 140
ASP A 192
 SAM  A 601 (-3.2A)
SAM  A 601 (-4.1A)
SAM  A 601 (-3.5A)
SAM  A 601 (-2.9A)
SAM  A 601 (-4.0A)
SAM  A 601 (-3.5A)
 0.98A 5c0oF-2b25A:
26.9		 5c0oF-2b25A:
30.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2b25 HYPOTHETICAL PROTEIN

(Homo sapiens) 		PF08704
(GCD14) 		6 THR A  87
GLY A 113
GLY A 115
GLY A 116
HIS A 140
ASP A 192
 SAM  A 601 (-3.7A)
SAM  A 601 (-3.2A)
SAM  A 601 (-4.1A)
SAM  A 601 (-3.5A)
SAM  A 601 (-4.0A)
SAM  A 601 (-3.5A)
 1.00A 5c0oF-2b25A:
26.9		 5c0oF-2b25A:
30.45
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.
2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2

(Mus musculus) 		PF00248
(Aldo_ket_red) 		5 GLY A  55
GLY A  56
LEU A  57
GLU A  51
ALA A  42
 None
 0.98A 5c0oF-2c91A:
undetectable		 5c0oF-2c91A:
22.44
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.
2ef4 ARGINASE

(Thermus
thermophilus) 		PF00491
(Arginase) 		5 GLY A   8
GLY A  94
GLY A  95
ALA A   5
LEU A  81
 None
 0.99A 5c0oF-2ef4A:
undetectable		 5c0oF-2ef4A:
25.60
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.
2esr METHYLTRANSFERASE

(Streptococcus
pyogenes) 		PF03602
(Cons_hypoth95) 		6 GLY A  51
GLY A  53
GLY A  54
LEU A  55
GLU A  71
ASP A 117
 None
 1.31A 5c0oF-2esrA:
14.1		 5c0oF-2esrA:
20.95
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.
2esr METHYLTRANSFERASE

(Streptococcus
pyogenes) 		PF03602
(Cons_hypoth95) 		5 GLY A  53
GLY A  54
LEU A  55
ALA A 100
ASP A 117
 None
 0.92A 5c0oF-2esrA:
14.1		 5c0oF-2esrA:
20.95
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.
2fhp METHYLASE, PUTATIVE

(Enterococcus
faecalis) 		PF03602
(Cons_hypoth95) 		5 GLY A  51
GLY A  53
GLY A  54
LEU A  55
ASP A 120
 None
 0.96A 5c0oF-2fhpA:
14.8		 5c0oF-2fhpA:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fhp METHYLASE, PUTATIVE

(Enterococcus
faecalis) 		PF03602
(Cons_hypoth95) 		5 GLY A  53
GLY A  54
LEU A  55
ALA A 100
ASP A 120
 None
 0.93A 5c0oF-2fhpA:
14.8		 5c0oF-2fhpA:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2g4o 3-ISOPROPYLMALATE
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF00180
(Iso_dh) 		5 GLY A 249
GLY A 247
GLY A 246
ALA A 273
HIS A 270
 None
 0.85A 5c0oF-2g4oA:
undetectable		 5c0oF-2g4oA:
23.85
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.
2gn1 THREONINE
DEHYDRATASE
CATABOLIC

(Salmonella
enterica) 		PF00291
(PALP) 		5 GLY A 184
GLY A 186
GLY A 187
LEU A 188
ALA A 210
 LLP  A  58 ( 3.5A)
LLP  A  58 ( 3.4A)
LLP  A  58 ( 3.2A)
LLP  A  58 ( 4.5A)
None
 0.65A 5c0oF-2gn1A:
undetectable		 5c0oF-2gn1A:
20.97
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.
2iv0 ISOCITRATE
DEHYDROGENASE

(Archaeoglobus
fulgidus) 		PF00180
(Iso_dh) 		5 GLY A 315
GLY A 313
GLY A 312
HIS A 333
ASP A 386
 None
 0.84A 5c0oF-2iv0A:
undetectable		 5c0oF-2iv0A:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ml2 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE 6

(Azotobacter
vinelandii) 		no annotation 6 THR A  21
GLY A  24
GLY A  41
GLY A  40
LEU A  22
ALA A   4
 None
CA  A 202 ( 4.8A)
CA  A 204 (-4.4A)
CA  A 204 ( 4.2A)
None
None
 1.32A 5c0oF-2ml2A:
undetectable		 5c0oF-2ml2A:
22.95
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.
2qpx PREDICTED
METAL-DEPENDENT
HYDROLASE OF THE
TIM-BARREL FOLD

(Lactobacillus
paracasei) 		PF04909
(Amidohydro_2) 		5 GLY A  57
GLY A 292
LEU A 291
ALA A  62
LEU A  33
 None
 0.80A 5c0oF-2qpxA:
undetectable		 5c0oF-2qpxA:
21.18
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.
2qv3 VACUOLATING
CYTOTOXIN

(Helicobacter
pylori) 		PF02691
(VacA) 		5 GLY A 479
GLY A 481
GLY A 459
LEU A 458
LEU A 500
 None
 0.97A 5c0oF-2qv3A:
undetectable		 5c0oF-2qv3A:
20.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rhk NON-STRUCTURAL
PROTEIN 1

(Influenza A
virus) 		PF00600
(Flu_NS1) 		5 GLY A 179
GLY A 183
GLY A 184
LEU A 185
LEU A 147
 None
 0.97A 5c0oF-2rhkA:
undetectable		 5c0oF-2rhkA:
18.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vdv TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF02390
(Methyltransf_4) 		5 GLY E 105
GLY E 107
GLY E 108
LEU E 109
GLU E 126
 SAM  E1287 (-3.6A)
None
None
None
SAM  E1287 (-2.6A)
 0.83A 5c0oF-2vdvE:
10.2		 5c0oF-2vdvE:
22.06
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.
2wbp L-ARGININE
BETA-HYDROXYLASE

(Streptomyces
vinaceus) 		PF02668
(TauD) 		5 GLY A 126
GLY A 129
LEU A 128
ALA A  37
LEU A  71
 None
 0.99A 5c0oF-2wbpA:
undetectable		 5c0oF-2wbpA:
22.01
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.
3b05 ISOPENTENYL-DIPHOSPH
ATE DELTA-ISOMERASE

(Sulfolobus
shibatae) 		PF01070
(FMN_dh) 		5 GLY A 274
GLY A 219
GLY A 198
ALA A 282
ASP A 216
 FNR  A 669 (-3.6A)
None
None
None
None
 0.93A 5c0oF-3b05A:
undetectable		 5c0oF-3b05A:
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.
3bog 6.5 KDA GLYCINE-RICH
ANTIFREEZE PROTEIN

(Hypogastrura
harveyi) 		no annotation 5 PRO A  14
THR A  16
GLY A  39
GLY A  45
GLY A  46
 None
 0.97A 5c0oF-3bogA:
undetectable		 5c0oF-3bogA:
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.
3c6m SPERMINE SYNTHASE

(Homo sapiens) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A 198
GLY A 200
GLY A 202
LEU A 205
LEU A 195
 MTA  A 401 (-3.3A)
MTA  A 401 (-3.7A)
None
None
None
 0.95A 5c0oF-3c6mA:
12.3		 5c0oF-3c6mA:
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.
3ckk TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Homo sapiens) 		PF02390
(Methyltransf_4) 		5 GLY A  56
GLY A  58
GLY A  59
LEU A  60
GLU A  77
 SAM  A 301 (-3.5A)
None
None
None
SAM  A 301 (-2.7A)
 0.89A 5c0oF-3ckkA:
11.2		 5c0oF-3ckkA:
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.
3d6r NON-STRUCTURAL
PROTEIN 1

(Influenza A
virus) 		no annotation 5 GLY B 179
GLY B 183
GLY B 184
LEU B 185
LEU B 147
 None
 0.98A 5c0oF-3d6rB:
undetectable		 5c0oF-3d6rB:
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.
3ek9 SPRY
DOMAIN-CONTAINING
SOCS BOX PROTEIN 2

(Mus musculus) 		PF00622
(SPRY) 		5 GLY A  80
GLY A  47
GLY A  63
ALA A 109
LEU A 115
 None
 0.91A 5c0oF-3ek9A:
undetectable		 5c0oF-3ek9A:
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.
3enq RIBOSE-5-PHOSPHATE
ISOMERASE A

(Vibrio
vulnificus) 		PF06026
(Rib_5-P_isom_A) 		5 GLY A 196
GLY A  95
GLY A  96
ALA A 199
LEU A 126
 None
 0.84A 5c0oF-3enqA:
3.2		 5c0oF-3enqA:
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.
3ihl CTP SYNTHASE 2

(Homo sapiens) 		PF06418
(CTP_synth_N) 		5 THR A   7
GLY A 149
GLY A 148
LEU A 147
LEU A 207
 None
PO4  A 301 (-3.0A)
PO4  A 301 (-3.8A)
None
None
 0.99A 5c0oF-3ihlA:
undetectable		 5c0oF-3ihlA:
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.
3iht S-ADENOSYL-L-METHION
INE METHYL
TRANSFERASE

(Ruegeria
pomeroyi) 		PF12692
(Methyltransf_17) 		5 GLY A  49
GLY A  51
GLU A  70
ASP A 112
LEU A 113
 SAM  A 200 (-3.2A)
SAM  A 200 (-3.7A)
SAM  A 200 (-2.7A)
SAM  A 200 (-3.7A)
SAM  A 200 ( 4.5A)
 0.89A 5c0oF-3ihtA:
9.8		 5c0oF-3ihtA:
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.
3lga SAM-DEPENDENT
METHYLTRANSFERASE

(Pyrococcus
abyssi) 		PF08704
(GCD14)
PF14801
(GCD14_N) 		6 GLY A 103
GLY A 105
LEU A 107
GLU A 125
ASP A 169
LEU A 170
 SAH  A 301 (-3.5A)
SAH  A 301 (-4.1A)
SAH  A 301 (-4.3A)
SAH  A 301 (-2.8A)
SAH  A 301 (-3.6A)
SAH  A 301 (-4.2A)
 0.87A 5c0oF-3lgaA:
24.4		 5c0oF-3lgaA:
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.
3net HISTIDYL-TRNA
SYNTHETASE

(Nostoc sp. PCC
7120) 		PF03129
(HGTP_anticodon)
PF13393
(tRNA-synt_His) 		5 THR A 306
GLY A 343
GLY A 324
ALA A 119
ASP A 158
 None
 0.98A 5c0oF-3netA:
undetectable		 5c0oF-3netA:
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.
3nx4 PUTATIVE
OXIDOREDUCTASE

(Salmonella
enterica) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A  91
GLY A  96
GLY A  97
LEU A  98
ASP A  43
 None
 0.97A 5c0oF-3nx4A:
6.2		 5c0oF-3nx4A:
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.
3p39 NONSTRUCTURAL
PROTEIN 1

(Influenza A
virus) 		PF00600
(Flu_NS1) 		5 GLY A 174
GLY A 178
GLY A 179
LEU A 180
LEU A 142
 None
 0.91A 5c0oF-3p39A:
undetectable		 5c0oF-3p39A:
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.
3s55 PUTATIVE SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE

(Mycobacteroides
abscessus) 		PF00106
(adh_short) 		5 THR A  93
GLY A  96
GLY A  95
LEU A  94
ALA A 137
 None
 0.98A 5c0oF-3s55A:
5.2		 5c0oF-3s55A:
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.
3u2h S-LAYER PROTEIN
MA0829

(Methanosarcina
acetivorans) 		PF07752
(S-layer) 		5 PRO A 343
GLY A 345
GLY A 346
LEU A 347
GLU A 530
 None
 0.89A 5c0oF-3u2hA:
undetectable		 5c0oF-3u2hA:
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.
3u7j RIBOSE-5-PHOSPHATE
ISOMERASE A

(Burkholderia
thailandensis) 		PF06026
(Rib_5-P_isom_A) 		5 GLY A 209
GLY A 103
GLY A 104
ALA A 212
LEU A 134
 None
K  A 238 ( 3.6A)
K  A 238 ( 4.8A)
None
None
 0.83A 5c0oF-3u7jA:
3.2		 5c0oF-3u7jA:
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.
3u7v BETA-GALACTOSIDASE

(Caulobacter
vibrioides) 		PF02449
(Glyco_hydro_42) 		5 GLY A 472
GLY A 422
GLY A 363
LEU A 362
LEU A 403
 None
 0.92A 5c0oF-3u7vA:
undetectable		 5c0oF-3u7vA:
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.
3ucq AMYLOSUCRASE

(Deinococcus
geothermalis) 		PF00128
(Alpha-amylase) 		5 GLY A 389
GLY A 491
GLY A 490
ALA A 325
LEU A 334
 None
 0.93A 5c0oF-3ucqA:
undetectable		 5c0oF-3ucqA:
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.
3v6o MONOCLONAL ANTIBODY
9F8 FAB FRAGMENT
HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		6 THR C  59
GLY C  35
GLY C  55
GLY C  57
ALA C  98
HIS C 100
 None
 1.31A 5c0oF-3v6oC:
undetectable		 5c0oF-3v6oC:
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.
3v78 PROBABLE
TRANSCRIPTIONAL
REGULATORY PROTEIN
(PROBABLY
DEOR-FAMILY)

(Mycobacterium
tuberculosis) 		PF00440
(TetR_N) 		5 GLY A  33
GLY A  34
LEU A  35
GLU A 123
LEU A  66
 None
 0.95A 5c0oF-3v78A:
undetectable		 5c0oF-3v78A:
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.
3v9e LACCASE

(Botrytis aclada) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 THR A 420
GLY A 471
GLY A 469
GLY A 423
ALA A 474
 None
 0.96A 5c0oF-3v9eA:
undetectable		 5c0oF-3v9eA:
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.
3vex O-CARBAMOYLTRANSFERA
SE TOBZ

(Streptoalloteichus
tenebrarius) 		PF02543
(Carbam_trans_N)
PF16861
(Carbam_trans_C) 		5 GLY A 140
GLY A 163
GLU A 141
HIS A 114
ASP A 228
 CA0  A 602 ( 4.9A)
None
None
FE2  A 601 ( 3.4A)
None
 0.90A 5c0oF-3vexA:
undetectable		 5c0oF-3vexA:
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.
3vgl GLUCOKINASE

(Streptomyces
griseus) 		PF00480
(ROK) 		5 GLY A 260
GLY A 131
GLY A 133
LEU A 134
ALA A 294
 ANP  A 325 ( 4.1A)
ANP  A 325 (-3.0A)
BGC  A 324 ( 3.9A)
None
None
 0.97A 5c0oF-3vglA:
undetectable		 5c0oF-3vglA:
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.
3wye DIACETYL REDUCTASE
[(S)-ACETOIN
FORMING],L-2,3-BUTAN
EDIOL
DEHYDROGENASE,DIACET
YL REDUCTASE
[(S)-ACETOIN
FORMING],L-2,3-BUTAN
EDIOL
DEHYDROGENASE,DIACET
YL REDUCTASE
[(S)-ACETOIN
FORMING],L-2,3-BUTAN
EDIOL
DEHYDROGENASE,DIACET
YL REDUCTASE
[(S)-ACETOIN
FORMING]

(Klebsiella
pneumoniae;
Corynebacterium
glutamicum) 		PF13561
(adh_short_C2) 		5 THR A  76
GLY A  79
GLY A  78
LEU A  77
ALA A 120
 None
 0.97A 5c0oF-3wyeA:
5.9		 5c0oF-3wyeA:
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.
4apw ALP12

(Clostridium
tetani) 		no annotation 6 THR A 313
GLY A 158
GLY A 160
GLY A 317
LEU A 164
ALA A 175
 None
 1.37A 5c0oF-4apwA:
undetectable		 5c0oF-4apwA:
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.
4c94 FRA A 3 ALLERGEN

(Fragaria x
ananassa) 		PF00407
(Bet_v_1) 		5 GLY A  62
GLY A  60
LEU A  59
ALA A 135
ASP A  90
 KXN  A 160 ( 4.8A)
None
KXN  A 160 (-4.4A)
None
KXN  A 160 (-4.4A)
 0.96A 5c0oF-4c94A:
undetectable		 5c0oF-4c94A:
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.
4h0o ACETATE KINASE

(Entamoeba
histolytica) 		PF00871
(Acetate_kinase) 		5 THR A 223
GLY A 170
GLY A 220
ALA A 144
HIS A 146
 None
 0.97A 5c0oF-4h0oA:
undetectable		 5c0oF-4h0oA:
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.
4h27 L-SERINE
DEHYDRATASE/L-THREON
INE DEAMINASE

(Homo sapiens) 		PF00291
(PALP) 		5 GLY A 168
GLY A 170
GLY A 171
LEU A 172
GLU A 194
 LLP  A  41 ( 3.5A)
LLP  A  41 ( 3.3A)
LLP  A  41 ( 3.2A)
LLP  A  41 ( 4.9A)
None
 0.99A 5c0oF-4h27A:
3.0		 5c0oF-4h27A:
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.
4h2h MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Salipiger
bermudensis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		6 PRO A 118
GLY A 112
GLY A 350
GLY A 352
LEU A 351
ALA A  80
 None
 1.41A 5c0oF-4h2hA:
undetectable		 5c0oF-4h2hA:
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.
4io1 RIBOSE-5-PHOSPHATE
ISOMERASE A

(Francisella
tularensis) 		PF06026
(Rib_5-P_isom_A) 		5 GLY A 202
GLY A 101
GLY A 102
ALA A 205
LEU A 132
 None
CL  A 301 (-3.4A)
CL  A 301 ( 4.7A)
None
None
 0.72A 5c0oF-4io1A:
2.8		 5c0oF-4io1A:
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.
4j2u ENOYL-COA HYDRATASE

(Rhodobacter
sphaeroides) 		PF16113
(ECH_2) 		5 GLY A  63
GLY A 114
GLY A 116
LEU A 117
ALA A  22
 None
 0.94A 5c0oF-4j2uA:
undetectable		 5c0oF-4j2uA:
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.
4jnq THIOREDOXIN
REDUCTASE

(Brucella
melitensis) 		PF07992
(Pyr_redox_2) 		5 THR A 220
GLY A 241
GLY A 132
GLY A 131
LYS A 170
 None
 0.89A 5c0oF-4jnqA:
4.4		 5c0oF-4jnqA:
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.
4jxj RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A

(Rickettsia
bellii) 		PF00398
(RrnaAD) 		5 GLY A  52
GLY A  54
GLY A  55
LEU A  56
GLU A  72
 None
 0.86A 5c0oF-4jxjA:
13.7		 5c0oF-4jxjA:
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.
4m1g MURINE IGG2A A27D7
HEAVY CHAIN FAB
DOMAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		6 THR H  56
GLY H  33
GLY H  53
GLY H  54
ALA H  96
HIS H  98
 None
 1.48A 5c0oF-4m1gH:
undetectable		 5c0oF-4m1gH:
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.
4mes THIAMINE TRANSPORTER
THIT

(Lactococcus
lactis) 		PF09515
(Thia_YuaJ) 		5 GLY A  59
GLY A  56
GLY A  93
LEU A  92
ALA A  19
 None
None
None
None
BNG  A 201 ( 3.7A)
 0.97A 5c0oF-4mesA:
undetectable		 5c0oF-4mesA:
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.
4mi2 PUTATIVE ENOYL-COA
HYDRATASE/ISOMERASE

(Mycobacteroides
abscessus) 		PF00378
(ECH_1) 		5 GLY A  68
GLY A 119
GLY A 121
LEU A 122
ALA A  28
 None
 0.94A 5c0oF-4mi2A:
undetectable		 5c0oF-4mi2A:
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.
4mj3 HALOALKANE
DEHALOGENASE

(Mycolicibacterium
rhodesiae) 		PF00561
(Abhydrolase_1) 		5 GLY A  54
GLY A 125
GLY A 126
LEU A 127
ALA A 209
 None
 0.94A 5c0oF-4mj3A:
undetectable		 5c0oF-4mj3A:
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.
4oqj PKS

(Streptomyces
albus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 GLY A 588
GLY A 552
GLY A 551
ALA A 583
ASP A 592
 None
 0.99A 5c0oF-4oqjA:
undetectable		 5c0oF-4oqjA:
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.
4qgs ALCOHOL
DEHYDROGENASE YQHD

(Escherichia
coli) 		PF00465
(Fe-ADH) 		5 GLY A  93
GLY A  94
GLY A  95
LEU A  98
LEU A  90
 None
 0.92A 5c0oF-4qgsA:
3.0		 5c0oF-4qgsA:
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.
4r1n 3-HYDROXYBUTYRYL-COA
DEHYDROGENASE

(Clostridium
butyricum) 		PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 GLY A  15
GLY A  13
GLY A  10
ALA A  22
LEU A  48
 None
 0.99A 5c0oF-4r1nA:
7.5		 5c0oF-4r1nA:
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.
4x84 RIBOSE-5-PHOSPHATE
ISOMERASE A

(Pseudomonas
aeruginosa) 		PF06026
(Rib_5-P_isom_A) 		5 GLY A 200
GLY A  99
GLY A 100
ALA A 203
LEU A 130
 None
FLC  A 300 (-3.8A)
FLC  A 300 (-3.5A)
None
None
 0.77A 5c0oF-4x84A:
3.1		 5c0oF-4x84A:
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.
4zwo ORGANOPHOSPHATE
ANHYDROLASE/PROLIDAS
E

(Alteromonas sp.) 		PF00557
(Peptidase_M24) 		5 GLY A 335
GLY A 293
LEU A 295
GLU A 381
HIS A 336
 None
None
None
MN  A 501 ( 2.6A)
MN  A 501 ( 3.5A)
 0.99A 5c0oF-4zwoA:
undetectable		 5c0oF-4zwoA:
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.
5a22 VESICULAR STOMATITIS
VIRUS L POLYMERASE

(Vesicular
stomatitis
virus) 		PF00946
(Mononeg_RNA_pol)
PF14314
(Methyltrans_Mon)
PF14318
(Mononeg_mRNAcap) 		5 THR A1715
GLY A1718
GLY A1717
LEU A1716
GLU A1727
 None
 0.90A 5c0oF-5a22A:
8.8		 5c0oF-5a22A:
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.
5c1i TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
TRMI

(Thermus
thermophilus) 		PF08704
(GCD14) 		6 GLY A 103
GLY A 105
GLU A 125
ALA A 126
HIS A 130
LYS A 153
 None
 1.48A 5c0oF-5c1iA:
28.0		 5c0oF-5c1iA:
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.
5c1i TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
TRMI

(Thermus
thermophilus) 		PF08704
(GCD14) 		6 THR A  77
GLY A 105
GLY A 106
LEU A 107
ALA A 126
HIS A 130
 None
 0.77A 5c0oF-5c1iA:
28.0		 5c0oF-5c1iA:
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.
5c1i TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
TRMI

(Thermus
thermophilus) 		PF08704
(GCD14) 		6 THR A  77
GLY A 105
GLY A 106
LEU A 107
ALA A 126
LEU A 171
 None
 0.86A 5c0oF-5c1iA:
28.0		 5c0oF-5c1iA:
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.
5c3u L-SERINE
AMMONIA-LYASE

(Rhizomucor
miehei) 		PF00291
(PALP) 		5 GLY A 180
GLY A 182
GLY A 183
LEU A 184
GLU A 206
 PLP  A 401 (-3.4A)
PLP  A 401 (-3.4A)
PLP  A 401 (-3.3A)
PLP  A 401 (-4.6A)
None
 0.95A 5c0oF-5c3uA:
3.3		 5c0oF-5c3uA:
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.
5cju ISOBUTYRYL-COA
MUTASE FUSED

(Cupriavidus
metallidurans) 		PF01642
(MM_CoA_mutase)
PF02310
(B12-binding)
PF03308
(ArgK) 		5 GLY A 410
GLY A 413
GLY A 416
LEU A 415
LEU A 329
 None
 0.99A 5c0oF-5cjuA:
undetectable		 5c0oF-5cjuA:
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.
5cyk RIBOSOME BIOGENESIS
PROTEIN YTM1

(Chaetomium
thermophilum) 		PF00400
(WD40)
PF08154
(NLE) 		5 GLY A 433
GLY A 432
LEU A 431
ALA A 360
LEU A 338
 None
 0.90A 5c0oF-5cykA:
undetectable		 5c0oF-5cykA:
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.
5erg TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
CATALYTIC SUBUNIT
TRM61

(Saccharomyces
cerevisiae) 		PF08704
(GCD14) 		5 GLY B 120
GLY B 122
GLU B 139
ASP B 203
LEU B 204
 SAM  B 401 (-3.3A)
SAM  B 401 (-3.9A)
SAM  B 401 (-2.9A)
SAM  B 401 (-3.3A)
SAM  B 401 (-4.5A)
 0.97A 5c0oF-5ergB:
20.4		 5c0oF-5ergB:
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.
5esr HALOALKANE
DEHALOGENASE

(Caulobacter
vibrioides) 		PF00561
(Abhydrolase_1) 		5 GLY A  54
GLY A 125
GLY A 126
LEU A 127
ALA A 208
 None
 0.95A 5c0oF-5esrA:
undetectable		 5c0oF-5esrA:
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.
5fbz ENZYME SUBTILASE
SUBHAL FROM BACILLUS
HALMAPALUS

(Bacillus
halmapalus) 		PF00082
(Peptidase_S8)
PF04151
(PPC) 		5 GLY A  67
GLY A  32
LEU A  33
ALA A 248
ASP A  34
 None
 0.96A 5c0oF-5fbzA:
undetectable		 5c0oF-5fbzA:
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.
5gzt CHITINASE

(Paenibacillus
sp. FPU-7) 		no annotation 5 PRO A 239
GLY A 257
GLY A 259
GLY A 261
LEU A 253
 None
 0.91A 5c0oF-5gztA:
undetectable		 5c0oF-5gztA:
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.
5hk8 PROBABLE
PHEOPHORBIDASE

(Arabidopsis
thaliana) 		PF12697
(Abhydrolase_6) 		5 GLY A  18
GLY A  89
GLY A  90
HIS A  21
LEU A 213
 None
 0.90A 5c0oF-5hk8A:
undetectable		 5c0oF-5hk8A:
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.
5i20 UNCHARACTERIZED
PROTEIN

(Starkeya
novella) 		PF00892
(EamA) 		5 GLY A 217
GLY A  43
GLY A  44
ALA A 212
LEU A  35
 None
 0.93A 5c0oF-5i20A:
undetectable		 5c0oF-5i20A:
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.
5u03 CTP SYNTHASE 1

(Homo sapiens) 		PF00117
(GATase)
PF06418
(CTP_synth_N) 		5 THR A   7
GLY A 149
GLY A 148
LEU A 147
LEU A 207
 None
UTP  A 602 (-4.1A)
UTP  A 602 (-3.5A)
None
None
 0.98A 5c0oF-5u03A:
undetectable		 5c0oF-5u03A:
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.
5uf2 RIBOSE-5-PHOSPHATE
ISOMERASE A

(Neisseria
gonorrhoeae) 		PF06026
(Rib_5-P_isom_A) 		5 GLY A 197
GLY A  96
GLY A  97
ALA A 200
LEU A 127
 None
NA  A 301 ( 3.5A)
NA  A 301 ( 4.7A)
None
None
 0.78A 5c0oF-5uf2A:
2.4		 5c0oF-5uf2A:
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.
5ux5 BIFUNCTIONAL PROTEIN
PROLINE UTILIZATION
A (PUTA)

(Corynebacterium
freiburgense) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		5 GLY A 717
GLY A 720
GLY A 820
GLU A 550
ALA A 549
 None
 0.96A 5c0oF-5ux5A:
3.1		 5c0oF-5ux5A:
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.
5vi6 HISTONE DEACETYLASE
8

(Homo sapiens) 		PF00850
(Hist_deacetyl) 		5 GLY A 140
GLY A 303
GLY A 265
LEU A 264
LEU A 299
 None
 0.91A 5c0oF-5vi6A:
3.2		 5c0oF-5vi6A:
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.
5vxl INVASIN IPAD

(Shigella
flexneri) 		PF06511
(IpaD) 		5 GLY A 267
GLY A 265
GLY A 264
LEU A 263
GLU A 268
 None
 0.91A 5c0oF-5vxlA:
undetectable		 5c0oF-5vxlA:
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.
5xeq NEUROLIGIN-2

(Homo sapiens) 		PF00135
(COesterase) 		6 GLY A 234
GLY A 220
GLY A 217
LEU A 216
ALA A 241
LEU A 183
 None
 1.49A 5c0oF-5xeqA:
undetectable		 5c0oF-5xeqA:
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.
6c5b METHYLTRANSFERASE

(Lysobacter
antibioticus) 		no annotation 5 THR A 159
GLY A 184
GLY A 186
LEU A 188
LEU A 249
 SAH  A 501 (-3.0A)
SAH  A 501 (-3.3A)
FMT  A 502 (-3.1A)
FMT  A 502 (-4.4A)
None
 0.93A 5c0oF-6c5bA:
11.6		 5c0oF-6c5bA:
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.
6eu6 AMMONIUM TRANSPORTER

(Candidatus
Kuenenia
stuttgartiensis) 		no annotation 5 THR A 168
GLY A 175
GLY A 327
GLY A 330
ALA A 180
 None
 0.91A 5c0oF-6eu6A:
undetectable		 5c0oF-6eu6A:
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.
6g2j NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
5

(Mus musculus) 		no annotation 6 THR L 316
GLY L 281
GLY L 318
LEU L 317
ALA L 225
LEU L 310
 None
 1.29A 5c0oF-6g2jL:
undetectable		 5c0oF-6g2jL:
undetectable