SIMILAR PATTERNS OF AMINO ACIDS FOR 4DM8_A_REAA501_1

List of similar pattern of amino acids derived from ASSAM search

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

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

(Aspergillus
niger) 		PF00295
(Glyco_hydro_28) 		5 PHE A 129
LEU A  50
ILE A  48
SER A 138
ILE A 107
 None
 1.16A 4dm8A-1czfA:
undetectable		 4dm8A-1czfA:
21.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1exx RETINOIC ACID
RECEPTOR GAMMA-2

(Homo sapiens) 		PF00104
(Hormone_recep) 		10 PHE A 230
CYH A 237
LEU A 268
LEU A 271
ARG A 278
PHE A 288
SER A 289
LEU A 307
LEU A 400
ILE A 412
 961  A 450 (-3.9A)
961  A 450 (-3.6A)
961  A 450 ( 4.9A)
961  A 450 (-3.6A)
961  A 450 (-3.6A)
961  A 450 (-4.6A)
961  A 450 (-2.5A)
961  A 450 (-4.8A)
None
961  A 450 ( 4.1A)
 0.64A 4dm8A-1exxA:
38.4		 4dm8A-1exxA:
79.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1h79 ANAEROBIC
RIBONUCLEOTIDE-TRIPH
OSPHATE REDUCTASE
LARGE CHAIN

(Escherichia
virus T4) 		PF13597
(NRDD) 		5 LEU A 258
LEU A 520
PHE A 487
LEU A 244
ILE A 269
 None
 1.02A 4dm8A-1h79A:
0.0		 4dm8A-1h79A:
19.44
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.
1ksp PROTEIN (DNA
POLYMERASE I-KLENOW
FRAGMENT
(E.C.2.7.7.7))

(Escherichia
coli) 		PF00476
(DNA_pol_A)
PF01612
(DNA_pol_A_exo1) 		5 LEU A 409
LEU A 435
ILE A 433
ARG A 539
LEU A 368
 None
 1.19A 4dm8A-1kspA:
0.0		 4dm8A-1kspA:
18.12
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.
1kyq SIROHEME
BIOSYNTHESIS PROTEIN
MET8

(Saccharomyces
cerevisiae) 		PF13241
(NAD_binding_7)
PF14823
(Sirohm_synth_C)
PF14824
(Sirohm_synth_M) 		5 PHE A 131
LEU A 126
ILE A 123
LEU A  17
LEU A 100
 None
 1.10A 4dm8A-1kyqA:
undetectable		 4dm8A-1kyqA:
24.51
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.
1mqq ALPHA-D-GLUCURONIDAS
E

(Geobacillus
stearothermophilus) 		PF03648
(Glyco_hydro_67N)
PF07477
(Glyco_hydro_67C)
PF07488
(Glyco_hydro_67M) 		5 PHE A 167
LEU A 187
ILE A 230
SER A 235
ILE A 446
 None
 1.16A 4dm8A-1mqqA:
0.0		 4dm8A-1mqqA:
17.15
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.
1nug PROTEIN-GLUTAMINE
GLUTAMYLTRANSFERASE
E

(Homo sapiens) 		PF00868
(Transglut_N)
PF00927
(Transglut_C)
PF01841
(Transglut_core) 		5 PHE A  24
CYH A 188
LEU A 286
ILE A 288
ILE A 131
 None
 1.20A 4dm8A-1nugA:
undetectable		 4dm8A-1nugA:
16.43
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.
1pd1 PROTEIN TRANSPORT
PROTEIN SEC24

(Saccharomyces
cerevisiae) 		PF00626
(Gelsolin)
PF04810
(zf-Sec23_Sec24)
PF04811
(Sec23_trunk)
PF04815
(Sec23_helical)
PF08033
(Sec23_BS) 		5 PHE A 540
ILE A 310
PHE A 529
SER A 503
LEU A 329
 None
 1.17A 4dm8A-1pd1A:
0.0		 4dm8A-1pd1A:
15.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ua2 CELL DIVISION
PROTEIN KINASE 7

(Homo sapiens) 		PF00069
(Pkinase) 		5 PHE A 295
LEU A 206
LEU A 203
ILE A 202
LEU A 151
 None
 1.10A 4dm8A-1ua2A:
0.0		 4dm8A-1ua2A:
23.91
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.
1wuf HYPOTHETICAL PROTEIN
LIN2664

(Listeria
innocua) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 PHE A1091
LEU A1036
ILE A1034
LEU A1073
ILE A1081
 None
 1.18A 4dm8A-1wufA:
undetectable		 4dm8A-1wufA:
26.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xap RETINOIC ACID
RECEPTOR BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		11 PHE A 221
CYH A 228
LEU A 259
LEU A 262
ILE A 263
ARG A 269
PHE A 279
SER A 280
LEU A 298
LEU A 391
ILE A 403
 TTB  A   1 (-4.7A)
TTB  A   1 ( 3.8A)
TTB  A   1 ( 4.9A)
TTB  A   1 (-3.9A)
TTB  A   1 ( 4.9A)
TTB  A   1 (-3.3A)
TTB  A   1 (-4.6A)
TTB  A   1 (-3.1A)
None
None
TTB  A   1 ( 4.8A)
 0.48A 4dm8A-1xapA:
38.3		 4dm8A-1xapA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xdk RETINOIC ACID
RECEPTOR, BETA

(Mus musculus) 		PF00104
(Hormone_recep) 		11 PHE B 221
CYH B 228
LEU B 259
LEU B 262
ILE B 263
ARG B 269
PHE B 279
SER B 280
LEU B 298
LEU B 391
ILE B 403
 9CR  B 600 ( 4.7A)
9CR  B 600 (-3.4A)
None
9CR  B 600 (-3.9A)
9CR  B 600 (-4.0A)
9CR  B 600 (-3.8A)
9CR  B 600 (-4.5A)
9CR  B 600 (-3.0A)
9CR  B 600 (-4.7A)
None
9CR  B 600 ( 4.4A)
 0.50A 4dm8A-1xdkB:
37.7		 4dm8A-1xdkB:
92.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xeu INTERNALIN C

(Listeria
monocytogenes) 		PF08191
(LRR_adjacent)
PF12354
(Internalin_N)
PF12799
(LRR_4) 		5 LEU A 191
LEU A 174
ILE A 196
LEU A 202
LEU A 183
 None
 1.08A 4dm8A-1xeuA:
undetectable		 4dm8A-1xeuA:
19.15
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.
2bl7 ENTEROCINE A
IMMUNITY PROTEIN

(Enterococcus
faecium) 		PF08951
(EntA_Immun) 		5 LEU A  12
LEU A  76
ILE A  77
LEU A  54
LEU A  38
 None
 1.20A 4dm8A-2bl7A:
undetectable		 4dm8A-2bl7A:
18.18
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.
2f5u VIRION PROTEIN UL25

(Human
alphaherpesvirus
1) 		PF01499
(Herpes_UL25) 		5 LEU A 408
LEU A 411
ILE A 412
LEU A 147
ILE A 573
 None
 1.14A 4dm8A-2f5uA:
undetectable		 4dm8A-2f5uA:
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.
2f5u VIRION PROTEIN UL25

(Human
alphaherpesvirus
1) 		PF01499
(Herpes_UL25) 		5 LEU A 408
LEU A 411
ILE A 412
SER A 171
ILE A 573
 None
 1.18A 4dm8A-2f5uA:
undetectable		 4dm8A-2f5uA:
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.
2ft3 BIGLYCAN

(Bos taurus) 		PF01462
(LRRNT)
PF13855
(LRR_8) 		5 LEU A 200
ILE A 179
ARG A 129
LEU A 191
LEU A 219
 None
 1.14A 4dm8A-2ft3A:
undetectable		 4dm8A-2ft3A:
21.13
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.
2gnp TRANSCRIPTIONAL
REGULATOR

(Streptococcus
pneumoniae) 		PF04198
(Sugar-bind) 		5 LEU A 312
LEU A 309
LEU A 290
LEU A 301
ILE A  79
 PEG  A 319 ( 4.7A)
None
None
None
None
 1.17A 4dm8A-2gnpA:
undetectable		 4dm8A-2gnpA:
24.18
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.
2imh HYPOTHETICAL PROTEIN
UNP Q5LQD5_SILPO

(Ruegeria
pomeroyi) 		PF06267
(DUF1028) 		5 LEU A 191
LEU A 145
ILE A 188
SER A 136
LEU A  31
 None
 1.12A 4dm8A-2imhA:
undetectable		 4dm8A-2imhA:
23.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jhs RHO GDP-DISSOCIATION
INHIBITOR 1

(Homo sapiens) 		PF02115
(Rho_GDI) 		5 CYH A  79
LEU A 196
LEU A 104
ILE A 198
ILE A 112
 None
 1.08A 4dm8A-2jhsA:
undetectable		 4dm8A-2jhsA:
18.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2msv MIXED LINEAGE KINASE
DOMAIN-LIKE PROTEIN

(Homo sapiens) 		no annotation 5 LEU A  69
LEU A  10
ILE A   7
LEU A  38
ILE A  76
 None
 1.19A 4dm8A-2msvA:
undetectable		 4dm8A-2msvA:
23.05
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.
2odp COMPLEMENT C2

(Homo sapiens) 		PF00089
(Trypsin)
PF00092
(VWA) 		5 LEU A 235
ILE A 264
ARG A 668
LEU A 354
ILE A 275
 None
 1.13A 4dm8A-2odpA:
undetectable		 4dm8A-2odpA:
19.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pqd 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE

(Agrobacterium
sp.) 		PF00275
(EPSP_synthase) 		5 LEU A 252
ILE A 265
SER A 309
LEU A 439
ILE A 330
 None
 1.08A 4dm8A-2pqdA:
undetectable		 4dm8A-2pqdA:
22.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qga ADENYLOSUCCINATE
LYASE

(Plasmodium
vivax) 		PF00206
(Lyase_1)
PF08328
(ASL_C) 		5 LEU B 282
ILE B 367
SER B 174
LEU B 154
LEU B 269
 None
 1.15A 4dm8A-2qgaB:
undetectable		 4dm8A-2qgaB:
19.06
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.
2v0p TYPE 2A
PHOSPHATASE-ASSOCIAT
ED PROTEIN 42

(Saccharomyces
cerevisiae) 		PF04177
(TAP42) 		5 LEU A  19
LEU A  82
PHE A 111
SER A 110
ILE A  12
 None
 1.21A 4dm8A-2v0pA:
undetectable		 4dm8A-2v0pA:
22.18
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.
2vhf UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE CYLD

(Homo sapiens) 		PF00443
(UCH) 		5 LEU A 662
ILE A 659
LEU A 607
LEU A 686
ILE A 688
 None
 1.15A 4dm8A-2vhfA:
undetectable		 4dm8A-2vhfA:
19.54
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.
2w40 GLYCEROL KINASE,
PUTATIVE

(Plasmodium
falciparum) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 LEU A 319
LEU A 324
ILE A 325
LEU A 383
ILE A 366
 None
 1.14A 4dm8A-2w40A:
undetectable		 4dm8A-2w40A:
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.
2xpz LEUKOTRIENE A-4
HYDROLASE

(Saccharomyces
cerevisiae) 		PF01433
(Peptidase_M1)
PF09127
(Leuk-A4-hydro_C) 		5 PHE A 452
LEU A 435
LEU A 436
LEU A 471
LEU A 485
 None
 1.18A 4dm8A-2xpzA:
undetectable		 4dm8A-2xpzA:
17.69
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.
2xyk 2-ON-2 HEMOGLOBIN

(Agrobacterium
tumefaciens) 		PF01152
(Bac_globin) 		5 PHE A  97
LEU A   8
LEU A  61
PHE A  53
ILE A 105
 None
None
None
HEM  A 700 (-4.4A)
None
 0.97A 4dm8A-2xykA:
undetectable		 4dm8A-2xykA:
18.66
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.
2z63 TOLL-LIKE RECEPTOR
4, VARIABLE
LYMPHOCYTE RECEPTOR
B

(Eptatretus
burgeri;
Homo sapiens) 		PF11921
(DUF3439)
PF13516
(LRR_6)
PF13855
(LRR_8) 		5 LEU A  80
LEU A  59
LEU A 107
LEU A  69
ILE A  48
 None
 1.20A 4dm8A-2z63A:
undetectable		 4dm8A-2z63A:
18.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a9g PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pyrobaculum
aerophilum) 		PF07995
(GSDH) 		6 PHE A 311
ILE A 244
ARG A 158
PHE A 283
SER A 282
ILE A 269
 None
 1.37A 4dm8A-3a9gA:
undetectable		 4dm8A-3a9gA:
21.45
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.
3bc1 RAS-RELATED PROTEIN
RAB-27A

(Mus musculus) 		PF00071
(Ras) 		5 LEU A 177
LEU A 180
ILE A 181
LEU A 117
ILE A 157
 None
 1.18A 4dm8A-3bc1A:
undetectable		 4dm8A-3bc1A:
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.
3dzd TRANSCRIPTIONAL
REGULATOR (NTRC
FAMILY)

(Aquifex
aeolicus) 		PF00072
(Response_reg)
PF00158
(Sigma54_activat) 		5 PHE A 284
LEU A 247
LEU A 244
LEU A 229
LEU A 157
 None
 0.88A 4dm8A-3dzdA:
undetectable		 4dm8A-3dzdA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3egw RESPIRATORY NITRATE
REDUCTASE 1 GAMMA
CHAIN

(Escherichia
coli) 		PF02665
(Nitrate_red_gam) 		5 LEU C 133
LEU C 130
ILE C 129
SER C  40
LEU C  60
 HEM  C 806 ( 4.8A)
HEM  C 806 (-3.8A)
None
HEM  C 806 (-3.5A)
HEM  C 806 ( 4.7A)
 1.13A 4dm8A-3egwC:
undetectable		 4dm8A-3egwC:
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.
3fz0 NUCLEOSIDE
HYDROLASE, PUTATIVE

(Trypanosoma
brucei) 		PF01156
(IU_nuc_hydro) 		5 LEU A 151
ILE A 159
LEU A 141
LEU A 112
ILE A 114
 None
 1.17A 4dm8A-3fz0A:
undetectable		 4dm8A-3fz0A:
20.31
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.
3fzg 16S RRNA METHYLASE

(Escherichia
coli) 		PF07091
(FmrO) 		5 LEU A 120
LEU A 146
ILE A 150
LEU A  74
ILE A  82
 None
 1.14A 4dm8A-3fzgA:
undetectable		 4dm8A-3fzgA:
20.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gs9 PROTEIN GP18

(Listeria
monocytogenes) 		PF06605
(Prophage_tail) 		5 PHE A  26
LEU A  18
ILE A   6
PHE A 310
ILE A  86
 OCS  A  27 ( 4.1A)
None
None
None
None
 1.14A 4dm8A-3gs9A:
undetectable		 4dm8A-3gs9A:
22.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3j0c E1 ENVELOPE
GLYCOPROTEIN

(Venezuelan
equine
encephalitis
virus) 		PF01589
(Alpha_E1_glycop) 		5 LEU A 133
ILE A  31
LEU A 278
LEU A 166
ILE A  36
 None
 1.09A 4dm8A-3j0cA:
undetectable		 4dm8A-3j0cA:
22.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k3p D-ALANINE--D-ALANINE
LIGASE

(Streptococcus
mutans) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		5 LEU A 107
ILE A 103
SER A 286
LEU A   9
LEU A   6
 None
 1.15A 4dm8A-3k3pA:
undetectable		 4dm8A-3k3pA:
26.28
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.
3k8p PROTEIN TRANSPORT
PROTEIN SEC39

(Saccharomyces
cerevisiae) 		PF08314
(Sec39) 		5 PHE D 198
LEU D 259
ILE D 232
LEU D 251
ILE D 214
 None
 1.09A 4dm8A-3k8pD:
undetectable		 4dm8A-3k8pD:
16.69
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.
3kmu INTEGRIN-LINKED
KINASE

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		5 LEU A 193
ILE A 188
PHE A 235
SER A 232
LEU A 207
 None
 0.95A 4dm8A-3kmuA:
undetectable		 4dm8A-3kmuA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kzw CYTOSOL
AMINOPEPTIDASE

(Staphylococcus
aureus) 		PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N) 		5 LEU A  71
LEU A  16
ILE A  72
LEU A  24
ILE A  37
 None
 1.20A 4dm8A-3kzwA:
undetectable		 4dm8A-3kzwA:
20.38
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.
3men ACETYLPOLYAMINE
AMINOHYDROLASE

(Burkholderia
pseudomallei) 		PF00850
(Hist_deacetyl) 		5 LEU A 301
LEU A 304
ILE A 305
LEU A 189
LEU A 244
 None
 1.17A 4dm8A-3menA:
undetectable		 4dm8A-3menA:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3myr HYDROGENASE (NIFE)
SMALL SUBUNIT HYDA

(Allochromatium
vinosum) 		PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		5 LEU A  31
LEU A  34
ILE A  35
LEU A  47
ILE A 156
 None
 1.06A 4dm8A-3myrA:
undetectable		 4dm8A-3myrA:
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.
3naf CALCIUM-ACTIVATED
POTASSIUM CHANNEL
SUBUNIT
ALPHA-1,CALCIUM-ACTI
VATED POTASSIUM
CHANNEL SUBUNIT
ALPHA-1,CALCIUM-ACTI
VATED POTASSIUM
CHANNEL SUBUNIT
ALPHA-1

(Homo sapiens) 		PF03493
(BK_channel_a) 		5 LEU A 387
LEU A 353
SER A 814
LEU A 360
LEU A 425
 None
 1.03A 4dm8A-3nafA:
undetectable		 4dm8A-3nafA:
14.43
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.
3p8c NCK-ASSOCIATED
PROTEIN 1

(Homo sapiens) 		PF09735
(Nckap1) 		5 LEU B1007
SER B1016
LEU B1067
LEU B1103
ILE B1091
 None
 1.21A 4dm8A-3p8cB:
undetectable		 4dm8A-3p8cB:
13.88
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.
3pdi NITROGENASE MOFE
COFACTOR
BIOSYNTHESIS PROTEIN
NIFN

(Azotobacter
vinelandii) 		PF00148
(Oxidored_nitro) 		5 LEU B 247
LEU B 175
SER B 237
LEU B 180
ILE B 153
 None
 1.18A 4dm8A-3pdiB:
undetectable		 4dm8A-3pdiB:
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.
3pjx CYCLIC DIMERIC GMP
BINDING PROTEIN

(Pseudomonas
fluorescens) 		PF00563
(EAL)
PF00990
(GGDEF) 		5 PHE A 566
LEU A 614
LEU A 580
ILE A 582
ILE A 610
 None
 1.05A 4dm8A-3pjxA:
undetectable		 4dm8A-3pjxA:
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.
3tqu NON-CANONICAL PURINE
NTP PYROPHOSPHATASE

(Coxiella
burnetii) 		PF01725
(Ham1p_like) 		5 LEU A  66
LEU A 124
ILE A 122
LEU A 187
ILE A  26
 None
 1.15A 4dm8A-3tquA:
undetectable		 4dm8A-3tquA:
23.88
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.
3u6n HIGH-CONDUCTANCE
CA2+-ACTIVATED K+
CHANNEL PROTEIN

(Danio rerio) 		PF02254
(TrkA_N)
PF03493
(BK_channel_a) 		5 PHE A 493
LEU A 940
ILE A 937
LEU A 510
LEU A 503
 None
 1.11A 4dm8A-3u6nA:
undetectable		 4dm8A-3u6nA:
17.63
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.
3umm PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE

(Salmonella
enterica) 		PF02769
(AIRS_C)
PF13507
(GATase_5) 		5 LEU A1144
LEU A1147
ILE A1148
LEU A1088
LEU A1075
 None
 0.99A 4dm8A-3ummA:
undetectable		 4dm8A-3ummA:
11.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w0l GLUCOKINASE
REGULATORY PROTEIN

(Xenopus laevis) 		no annotation 5 CYH B 167
LEU B 104
ILE B 176
LEU B 274
LEU B 125
 None
 1.19A 4dm8A-3w0lB:
undetectable		 4dm8A-3w0lB:
17.82
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.
3w1g DNA LIGASE 4

(Homo sapiens) 		PF01068
(DNA_ligase_A_M)
PF04675
(DNA_ligase_A_N)
PF04679
(DNA_ligase_A_C) 		6 CYH A 225
LEU A  75
LEU A 221
SER A  63
LEU A 196
ILE A 203
 None
 1.45A 4dm8A-3w1gA:
undetectable		 4dm8A-3w1gA:
19.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wuc GALECTIN

(Xenopus laevis) 		PF00337
(Gal-bind_lectin) 		5 CYH A  48
LEU A  90
ILE A  91
LEU A 129
ILE A 127
 None
 0.98A 4dm8A-3wucA:
undetectable		 4dm8A-3wucA:
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.
4azv WBDD

(Escherichia
coli) 		PF00069
(Pkinase)
PF13847
(Methyltransf_31) 		5 LEU A 161
LEU A 181
ILE A 182
LEU A  60
ILE A 134
 CL  A1479 (-4.5A)
None
None
None
SAM  A1474 ( 4.8A)
 1.19A 4dm8A-4azvA:
undetectable		 4dm8A-4azvA:
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.
4dlo BRAIN-SPECIFIC
ANGIOGENESIS
INHIBITOR 3

(Homo sapiens) 		PF01825
(GPS)
PF02793
(HRM)
PF16489
(GAIN) 		5 LEU A 807
ILE A 805
ARG A 855
LEU A 770
ILE A 783
 None
 1.20A 4dm8A-4dloA:
undetectable		 4dm8A-4dloA:
21.83
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.
4e4r PHOSPHATE
ACETYLTRANSFERASE

(Staphylococcus
aureus) 		PF01515
(PTA_PTB) 		5 LEU A  81
LEU A 102
LEU A  47
LEU A 121
ILE A 139
 None
 1.17A 4dm8A-4e4rA:
undetectable		 4dm8A-4e4rA:
21.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4egw MAGNESIUM TRANSPORT
PROTEIN CORA

(Methanocaldococcus
jannaschii) 		PF01544
(CorA) 		5 LEU A  41
SER A 106
LEU A  18
LEU A 100
ILE A  50
 None
 1.18A 4dm8A-4egwA:
undetectable		 4dm8A-4egwA:
25.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f1n KPAGO

(Vanderwaltozyma
polyspora) 		PF02171
(Piwi) 		5 PHE A 433
LEU A 246
LEU A 483
ILE A 244
PHE A 470
 None
 1.19A 4dm8A-4f1nA:
undetectable		 4dm8A-4f1nA:
13.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4flc ADENYLOSUCCINATE
LYASE

(Homo sapiens) 		PF00206
(Lyase_1)
PF10397
(ADSL_C) 		5 LEU A 186
LEU A 128
PHE A  30
LEU A 352
LEU A 311
 None
 1.17A 4dm8A-4flcA:
2.1		 4dm8A-4flcA:
22.24
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.
4ggp TRANS-2-ENOYL-COA
REDUCTASE

(Treponema
denticola) 		PF07055
(Eno-Rase_FAD_bd)
PF12241
(Enoyl_reductase)
PF12242
(Eno-Rase_NADH_b) 		5 LEU A 213
ILE A 210
ARG A 267
LEU A  52
ILE A 135
 None
 1.17A 4dm8A-4ggpA:
undetectable		 4dm8A-4ggpA:
20.45
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.
4hb4 EXPORTIN-1

(Saccharomyces
cerevisiae) 		PF03810
(IBN_N)
PF08389
(Xpo1)
PF08767
(CRM1_C) 		5 LEU C 508
ILE C 505
SER C 514
LEU C 538
ILE C 488
 None
 1.16A 4dm8A-4hb4C:
undetectable		 4dm8A-4hb4C:
13.16
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.
4htp DNA LIGASE 4

(Homo sapiens) 		PF04675
(DNA_ligase_A_N) 		6 CYH A 225
LEU A  75
LEU A 221
SER A  63
LEU A 196
ILE A 203
 None
 1.47A 4dm8A-4htpA:
undetectable		 4dm8A-4htpA:
23.94
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.
4j5u SERINE
HYDROXYMETHYLTRANSFE
RASE

(Rickettsia
rickettsii) 		PF00464
(SHMT) 		5 LEU A 336
ILE A 361
SER A  35
LEU A 301
ILE A  30
 None
None
LLP  A 230 ( 4.9A)
None
None
 1.03A 4dm8A-4j5uA:
undetectable		 4dm8A-4j5uA:
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.
4jxf SERINE/THREONINE-PRO
TEIN KINASE PLK4

(Homo sapiens) 		PF00069
(Pkinase) 		5 LEU A 241
LEU A 245
ILE A 242
LEU A 205
ILE A 121
 None
 1.11A 4dm8A-4jxfA:
undetectable		 4dm8A-4jxfA:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mn8 LRR RECEPTOR-LIKE
SERINE/THREONINE-PRO
TEIN KINASE FLS2

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13516
(LRR_6)
PF13855
(LRR_8) 		5 LEU A 386
SER A 320
LEU A 413
LEU A 376
ILE A 356
 None
 1.12A 4dm8A-4mn8A:
undetectable		 4dm8A-4mn8A:
16.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mna LRR RECEPTOR-LIKE
SERINE/THREONINE-PRO
TEIN KINASE FLS2

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13516
(LRR_6)
PF13855
(LRR_8) 		5 LEU A 386
SER A 320
LEU A 413
LEU A 376
ILE A 356
 None
ZN  A 907 ( 4.1A)
None
None
None
 1.19A 4dm8A-4mnaA:
undetectable		 4dm8A-4mnaA:
18.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4red 5'-AMP-ACTIVATED
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA-1

(Homo sapiens) 		PF00069
(Pkinase) 		5 LEU A 142
ILE A 157
PHE A 279
LEU A 206
ILE A 199
 None
 1.19A 4dm8A-4redA:
undetectable		 4dm8A-4redA:
23.18
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.
4uyb SEC14-LIKE PROTEIN 3

(Homo sapiens) 		PF00650
(CRAL_TRIO) 		5 CYH A 155
LEU A 220
ILE A 218
LEU A 231
LEU A 237
 UNL  A1407 ( 4.2A)
None
None
None
None
 1.18A 4dm8A-4uybA:
undetectable		 4dm8A-4uybA:
21.69
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.
4xqk LLABIII

(Lactococcus
lactis) 		PF00271
(Helicase_C)
PF02384
(N6_Mtase)
PF04851
(ResIII)
PF13156
(Mrr_cat_2) 		5 LEU A1213
LEU A1369
LEU A1415
LEU A1403
ILE A1392
 None
 1.14A 4dm8A-4xqkA:
undetectable		 4dm8A-4xqkA:
10.50
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.
4yzf BAND 3 ANION
TRANSPORT PROTEIN

(Homo sapiens) 		PF00955
(HCO3_cotransp) 		5 LEU A 859
LEU A 863
SER A 517
LEU A 677
ILE A 528
 None
 1.21A 4dm8A-4yzfA:
undetectable		 4dm8A-4yzfA:
15.38
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.
5a0z CHOLINE
TRIMETHYLAMINE LYASE

(Klebsiella
pneumoniae) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		5 LEU A 696
LEU A 699
ILE A 700
LEU A 599
ILE A 635
 None
 1.14A 4dm8A-5a0zA:
undetectable		 4dm8A-5a0zA:
17.48
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.
5cdf ATP SYNTHASE SUBUNIT
BETA

(Paracoccus
denitrificans) 		PF00006
(ATP-synt_ab)
PF02874
(ATP-synt_ab_N) 		5 LEU E 149
LEU E 160
ILE E 161
LEU E 128
ILE E 135
 None
 1.05A 4dm8A-5cdfE:
undetectable		 4dm8A-5cdfE:
21.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5chv UBL
CARBOXYL-TERMINAL
HYDROLASE 18

(Mus musculus) 		PF00443
(UCH) 		5 ILE A 144
PHE A 165
LEU A  67
LEU A 104
ILE A  83
 None
 1.15A 4dm8A-5chvA:
undetectable		 4dm8A-5chvA:
21.02
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.
5chv UBL
CARBOXYL-TERMINAL
HYDROLASE 18

(Mus musculus) 		PF00443
(UCH) 		5 PHE A  76
PHE A 165
LEU A  67
LEU A 104
ILE A  83
 None
 1.17A 4dm8A-5chvA:
undetectable		 4dm8A-5chvA:
21.02
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.
5cqr ELONGATOR COMPLEX
PROTEIN 1

(Homo sapiens) 		PF04762
(IKI3) 		5 LEU A1255
LEU A1240
ILE A1239
LEU A1232
LEU A1263
 None
 0.96A 4dm8A-5cqrA:
undetectable		 4dm8A-5cqrA:
17.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dm3 L-GLUTAMINE
SYNTHETASE

(Chromohalobacter
salexigens) 		PF00120
(Gln-synt_C) 		5 PHE A 275
LEU A 131
LEU A 136
LEU A 295
ILE A 375
 None
 1.10A 4dm8A-5dm3A:
undetectable		 4dm8A-5dm3A:
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.
5exp TRANSCRIPTIONAL
REGULATOR FLEQ

(Pseudomonas
aeruginosa) 		PF00158
(Sigma54_activat) 		5 PHE A 299
LEU A 262
LEU A 259
LEU A 244
LEU A 171
 None
 0.88A 4dm8A-5expA:
undetectable		 4dm8A-5expA:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fu7 CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF04054
(Not1) 		5 LEU A2309
LEU A2312
ILE A2313
ARG A2316
ILE A2330
 None
 1.11A 4dm8A-5fu7A:
undetectable		 4dm8A-5fu7A:
21.02
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.
5g39 PHOTOSYSTEM II
MANGANESE-STABILIZIN
G POLYPEPTIDE

(Thermosynechococcus
elongatus) 		PF01716
(MSP) 		5 LEU A  45
LEU A  71
ILE A  74
LEU A 118
ILE A 179
 None
 1.10A 4dm8A-5g39A:
undetectable		 4dm8A-5g39A:
22.30
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.
5h1q INNEXIN-6

(Caenorhabditis
elegans) 		PF00876
(Innexin) 		5 LEU A 213
LEU A 214
PHE A 242
LEU A 280
LEU A  46
 None
 1.16A 4dm8A-5h1qA:
undetectable		 4dm8A-5h1qA:
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.
5ijl DNA POLYMERASE II
LARGE SUBUNIT

(Pyrococcus
abyssi) 		PF03833
(PolC_DP2) 		5 PHE A 972
LEU A  54
ILE A 119
SER A  36
LEU A 920
 None
 1.21A 4dm8A-5ijlA:
undetectable		 4dm8A-5ijlA:
13.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5k13 RETINOIC ACID
RECEPTOR ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		10 PHE A 228
CYH A 235
LEU A 266
LEU A 269
ILE A 270
ARG A 276
PHE A 286
SER A 287
LEU A 305
LEU A 398
 6Q7  A 501 (-3.9A)
6Q7  A 501 ( 3.7A)
6Q7  A 501 (-4.2A)
6Q7  A 501 (-3.7A)
6Q7  A 501 (-4.8A)
6Q7  A 501 (-3.2A)
6Q7  A 501 (-4.7A)
6Q7  A 501 (-2.9A)
6Q7  A 501 ( 4.5A)
None
 0.72A 4dm8A-5k13A:
36.2		 4dm8A-5k13A:
87.55
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.
5mc5 XAA-PRO DIPEPTIDASE

(Homo sapiens) 		no annotation 5 LEU A 274
ILE A 244
SER A 286
LEU A 254
ILE A 451
 None
None
None
PRO  A 504 (-4.5A)
None
 1.20A 4dm8A-5mc5A:
undetectable		 4dm8A-5mc5A:
15.85
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.
5ng6 CRISPR-ASSOCIATED
ENDONUCLEASE CPF1

(Francisella
tularensis) 		no annotation 5 PHE A 123
LEU A 329
PHE A 119
SER A 116
ILE A  54
 None
 0.89A 4dm8A-5ng6A:
undetectable		 4dm8A-5ng6A:
11.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5o4m HCGC

(Methanococcus
maripaludis) 		PF06690
(DUF1188) 		5 LEU A 246
LEU A 242
ILE A 245
SER A 234
LEU A 205
 None
 1.15A 4dm8A-5o4mA:
undetectable		 4dm8A-5o4mA:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u89 AMINO ACID
ADENYLATION DOMAIN
PROTEIN

(Geobacillus sp.
Y4.1MC1) 		PF00501
(AMP-binding)
PF00550
(PP-binding)
PF00668
(Condensation)
PF13193
(AMP-binding_C) 		5 LEU A 973
ILE A 972
ARG A 966
LEU A1370
ILE A1017
 None
 0.99A 4dm8A-5u89A:
undetectable		 4dm8A-5u89A:
13.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uak CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Homo sapiens) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane)
PF14396
(CFTR_R) 		5 LEU A 453
SER A 624
LEU A 571
LEU A 568
ILE A 448
 None
 1.19A 4dm8A-5uakA:
1.4		 4dm8A-5uakA:
10.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uan RETINOIC ACID
RECEPTOR BETA

(Homo sapiens) 		no annotation 11 PHE B 221
CYH B 228
LEU B 259
LEU B 262
ILE B 263
ARG B 269
PHE B 279
SER B 280
LEU B 298
LEU B 391
ILE B 403
 REA  B 503 ( 4.8A)
REA  B 503 (-3.1A)
None
REA  B 503 (-3.9A)
REA  B 503 (-4.4A)
REA  B 503 ( 4.8A)
REA  B 503 (-4.4A)
REA  B 503 (-2.1A)
None
None
REA  B 503 ( 4.7A)
 0.40A 4dm8A-5uanB:
38.5		 4dm8A-5uanB:
73.55
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.
5w1a MYOSIN HEAVY CHAIN,
MUSCLE

(Drosophila
melanogaster) 		no annotation 5 CYH A 740
LEU A 726
ILE A 725
LEU A 769
ILE A 745
 None
 1.15A 4dm8A-5w1aA:
undetectable		 4dm8A-5w1aA:
14.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wti CRISPR-ASSOCIATED
PROTEIN

(Bacillus
thermoamylovorans) 		no annotation 5 LEU Z 178
LEU Z 183
ILE Z 184
LEU Z 102
ILE Z  41
 None
 1.19A 4dm8A-5wtiZ:
undetectable		 4dm8A-5wtiZ:
12.45
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.
5wze AMINOPEPTIDASE P

(Pseudomonas
aeruginosa) 		no annotation 5 LEU A 258
ILE A 232
SER A 270
LEU A 242
ILE A 407
 None
None
None
PRO  A 504 ( 4.4A)
None
 1.07A 4dm8A-5wzeA:
undetectable		 4dm8A-5wzeA:
15.36
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.
5xjq GEM-ASSOCIATED
PROTEIN 2

(Homo sapiens) 		no annotation 5 PHE 2 207
LEU 2 262
ILE 2 263
PHE 2 202
SER 2 199
 None
 1.03A 4dm8A-5xjq2:
undetectable		 4dm8A-5xjq2:
12.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xnl OXYGEN-EVOLVING
ENHANCER PROTEIN 1,
CHLOROPLASTIC

(Pisum sativum) 		PF01716
(MSP) 		5 LEU O  53
LEU O  86
ILE O  89
LEU O 133
ILE O 238
 None
 1.16A 4dm8A-5xnlO:
undetectable		 4dm8A-5xnlO:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6em0 2-HYDROXYBIPHENYL-3-
MONOOXYGENASE

(Pseudomonas
nitroreducens) 		no annotation 5 LEU A 352
LEU A 583
ILE A 582
SER A 517
LEU A  28
 None
 1.21A 4dm8A-6em0A:
undetectable		 4dm8A-6em0A:
15.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6eu9 RETINOIC ACID
RECEPTOR

(Platynereis
dumerilii) 		no annotation 5 LEU A 394
ILE A 398
ARG A 404
PHE A 414
LEU A 433
 None
 0.72A 4dm8A-6eu9A:
31.7		 4dm8A-6eu9A:
36.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6eu9 RETINOIC ACID
RECEPTOR

(Platynereis
dumerilii) 		no annotation 6 LEU A 394
ILE A 398
PHE A 414
SER A 415
LEU A 433
LEU A 526
 None
 0.89A 4dm8A-6eu9A:
31.7		 4dm8A-6eu9A:
36.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6exc ICMP (DOTM)

(Legionella
pneumophila) 		no annotation 5 LEU A 247
LEU A 244
ILE A 243
ARG A 237
LEU A 316
 None
 1.11A 4dm8A-6excA:
undetectable		 4dm8A-6excA:
16.02
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.
6fx0 RETINOIC ACID
RECEPTOR GAMMA

(Homo sapiens) 		no annotation 10 PHE A 230
CYH A 237
LEU A 268
LEU A 271
ARG A 278
PHE A 288
SER A 289
LEU A 307
LEU A 400
ILE A 412
 E9T  A 501 (-4.3A)
E9T  A 501 (-3.6A)
E9T  A 501 (-4.9A)
E9T  A 501 (-3.6A)
E9T  A 501 (-3.1A)
E9T  A 501 (-4.7A)
E9T  A 501 (-2.6A)
None
None
E9T  A 501 ( 4.8A)
 0.55A 4dm8A-6fx0A:
38.4		 4dm8A-6fx0A:
15.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6gsa -

(-) 		no annotation 5 PHE D 170
LEU D 127
LEU D 187
SER D 269
LEU D 179
 None
 1.21A 4dm8A-6gsaD:
undetectable		 4dm8A-6gsaD:
undetectable