SIMILAR PATTERNS OF AMINO ACIDS FOR 5AD9_A_H4BA760

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.
1c4k PROTEIN (ORNITHINE
DECARBOXYLASE)

(Lactobacillus
sp. 30A) 		PF01276
(OKR_DC_1)
PF03709
(OKR_DC_1_N)
PF03711
(OKR_DC_1_C) 		4 VAL A 667
TRP A 673
PHE A 681
GLU A 649
 None
 1.26A 5ad9A-1c4kA:
undetectable
5ad9B-1c4kA:
0.0		 5ad9A-1c4kA:
19.07
5ad9B-1c4kA:
19.07
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.
1cyo CYTOCHROME B5

(Bos taurus) 		PF00173
(Cyt-b5) 		4 ARG A  68
VAL A  61
PHE A  58
GLU A  56
 None
None
HEM  A 201 (-4.8A)
None
 1.28A 5ad9A-1cyoA:
undetectable
5ad9B-1cyoA:
undetectable		 5ad9A-1cyoA:
12.05
5ad9B-1cyoA:
12.05
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.
1dvk PRP18

(Saccharomyces
cerevisiae) 		PF02840
(Prp18) 		4 ARG A 123
TRP A 242
PHE A 239
GLU A 241
 None
 1.44A 5ad9A-1dvkA:
undetectable
5ad9B-1dvkA:
undetectable		 5ad9A-1dvkA:
17.18
5ad9B-1dvkA:
17.18
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.
1flg PROTEIN
(QUINOPROTEIN
ETHANOL
DEHYDROGENASE)

(Pseudomonas
aeruginosa) 		PF01011
(PQQ)
PF13360
(PQQ_2) 		4 VAL A  41
TRP A 521
PHE A 501
GLU A 519
 None
 1.12A 5ad9A-1flgA:
undetectable
5ad9B-1flgA:
undetectable		 5ad9A-1flgA:
19.67
5ad9B-1flgA:
19.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1h5q NADP-DEPENDENT
MANNITOL
DEHYDROGENASE

(Agaricus
bisporus) 		PF13561
(adh_short_C2) 		4 VAL A 116
PHE A 113
HIS A 110
GLU A 111
 None
 1.27A 5ad9A-1h5qA:
0.0
5ad9B-1h5qA:
0.4		 5ad9A-1h5qA:
19.07
5ad9B-1h5qA:
19.07
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.
1kh2 ARGININOSUCCINATE
SYNTHETASE

(Thermus
thermophilus) 		PF00764
(Arginosuc_synth) 		4 ARG A 282
VAL A 226
PHE A 220
GLU A 222
 None
 1.29A 5ad9A-1kh2A:
0.0
5ad9B-1kh2A:
0.0		 5ad9A-1kh2A:
22.65
5ad9B-1kh2A:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1l6n GAG POLYPROTEIN

(Human
immunodeficiency
virus 1) 		PF00540
(Gag_p17)
PF00607
(Gag_p24) 		4 VAL A  84
TRP A  16
HIS A  33
GLU A  17
 None
 1.41A 5ad9A-1l6nA:
undetectable
5ad9B-1l6nA:
undetectable		 5ad9A-1l6nA:
19.19
5ad9B-1l6nA:
19.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1lzx NITRIC-OXIDE
SYNTHASE

(Rattus
norvegicus) 		PF02898
(NO_synthase) 		4 TRP A 676
PHE A 691
HIS A 692
GLU A 694
 None
 0.18A 5ad9A-1lzxA:
62.4
5ad9B-1lzxA:
61.7		 5ad9A-1lzxA:
100.00
5ad9B-1lzxA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1m9q ENDOTHELIAL
NITRIC-OXIDE
SYNTHASE

(Homo sapiens) 		PF02898
(NO_synthase) 		4 TRP A 445
PHE A 460
HIS A 461
GLU A 463
 MPD  A 603 (-4.6A)
MPD  A 603 (-4.2A)
None
None
 0.27A 5ad9A-1m9qA:
59.2
5ad9B-1m9qA:
30.4		 5ad9A-1m9qA:
64.72
5ad9B-1m9qA:
64.72
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.
1mzb FERRIC UPTAKE
REGULATION PROTEIN

(Pseudomonas
aeruginosa) 		PF01475
(FUR) 		4 ARG A  69
VAL A  54
PHE A  79
GLU A  36
 None
 1.07A 5ad9A-1mzbA:
undetectable
5ad9B-1mzbA:
undetectable		 5ad9A-1mzbA:
16.59
5ad9B-1mzbA:
16.59
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.
1nst HEPARAN SULFATE
N-DEACETYLASE/N-SULF
OTRANSFERASE

(Homo sapiens) 		PF00685
(Sulfotransfer_1) 		4 VAL A 775
PHE A 681
HIS A 760
GLU A 762
 None
 1.28A 5ad9A-1nstA:
undetectable
5ad9B-1nstA:
undetectable		 5ad9A-1nstA:
21.36
5ad9B-1nstA:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pvd PYRUVATE
DECARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 TRP A 518
PHE A 527
HIS A 510
GLU A 517
 None
 1.28A 5ad9A-1pvdA:
undetectable
5ad9B-1pvdA:
undetectable		 5ad9A-1pvdA:
20.87
5ad9B-1pvdA:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qou CEN

(Antirrhinum
majus) 		PF01161
(PBP) 		4 VAL A  46
PHE A 120
HIS A 118
GLU A  40
 None
 1.43A 5ad9A-1qouA:
undetectable
5ad9B-1qouA:
undetectable		 5ad9A-1qouA:
17.40
5ad9B-1qouA:
17.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1qw5 NITRIC OXIDE
SYNTHASE, INDUCIBLE

(Mus musculus) 		PF02898
(NO_synthase) 		4 TRP A 455
PHE A 470
HIS A 471
GLU A 473
 None
 0.30A 5ad9A-1qw5A:
57.5
5ad9B-1qw5A:
57.5		 5ad9A-1qw5A:
63.90
5ad9B-1qw5A:
63.90
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.
1r47 ALPHA-GALACTOSIDASE
A

(Homo sapiens) 		PF16499
(Melibiase_2)
PF17450
(Melibiase_2_C) 		4 ARG A 196
VAL A 199
HIS A 125
GLU A  87
 None
 1.25A 5ad9A-1r47A:
undetectable
5ad9B-1r47A:
undetectable		 5ad9A-1r47A:
19.79
5ad9B-1r47A:
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.
1ro5 AUTOINDUCER
SYNTHESIS PROTEIN
LASI

(Pseudomonas
aeruginosa) 		PF00765
(Autoind_synth) 		4 ARG A 161
VAL A 143
HIS A 165
GLU A 171
 None
None
None
SO4  A 404 ( 4.9A)
 1.23A 5ad9A-1ro5A:
undetectable
5ad9B-1ro5A:
undetectable		 5ad9A-1ro5A:
20.41
5ad9B-1ro5A:
20.41
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.
1tki TITIN

(Homo sapiens) 		PF00069
(Pkinase) 		4 VAL A 122
TRP A 277
PHE A 254
GLU A 250
 None
 1.46A 5ad9A-1tkiA:
undetectable
5ad9B-1tkiA:
undetectable		 5ad9A-1tkiA:
20.23
5ad9B-1tkiA:
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.
1tki TITIN

(Homo sapiens) 		PF00069
(Pkinase) 		4 VAL A 122
TRP A 277
PHE A 254
HIS A 275
 None
 1.34A 5ad9A-1tkiA:
undetectable
5ad9B-1tkiA:
undetectable		 5ad9A-1tkiA:
20.23
5ad9B-1tkiA:
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.
1u10 PENICILLIN-INSENSITI
VE MUREIN
ENDOPEPTIDASE

(Escherichia
coli) 		PF03411
(Peptidase_M74) 		4 ARG A 213
TRP A 203
PHE A 177
HIS A 211
 None
None
None
ZN  A 400 (-3.0A)
 1.35A 5ad9A-1u10A:
undetectable
5ad9B-1u10A:
undetectable		 5ad9A-1u10A:
20.00
5ad9B-1u10A:
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.
1uwx ANTIBODY

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 ARG K 156
VAL K 133
HIS K 190
GLU K 188
 None
 1.45A 5ad9A-1uwxK:
undetectable
5ad9B-1uwxK:
undetectable		 5ad9A-1uwxK:
19.90
5ad9B-1uwxK:
19.90
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.
1v71 HYPOTHETICAL PROTEIN
C320.14 IN
CHROMOSOME III

(Schizosaccharomyces
pombe) 		PF00291
(PALP) 		4 VAL A 312
PHE A 320
HIS A 319
GLU A 315
 None
 1.19A 5ad9A-1v71A:
undetectable
5ad9B-1v71A:
undetectable		 5ad9A-1v71A:
21.33
5ad9B-1v71A:
21.33
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.
1vmk PURINE NUCLEOSIDE
PHOSPHORYLASE

(Thermotoga
maritima) 		PF01048
(PNP_UDP_1) 		4 VAL A 221
TRP A 162
PHE A 265
GLU A 161
 None
 1.42A 5ad9A-1vmkA:
undetectable
5ad9B-1vmkA:
undetectable		 5ad9A-1vmkA:
21.48
5ad9B-1vmkA:
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.
1wko TERMINAL FLOWER 1
PROTEIN

(Arabidopsis
thaliana) 		PF01161
(PBP) 		4 VAL A  51
PHE A 123
HIS A 121
GLU A  45
 None
 1.44A 5ad9A-1wkoA:
undetectable
5ad9B-1wkoA:
undetectable		 5ad9A-1wkoA:
17.61
5ad9B-1wkoA:
17.61
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.
1wql ETHYLBENZENE
DIOXYGENASE SMALL
SUBUNIT

(Pseudomonas
fluorescens) 		PF00866
(Ring_hydroxyl_B) 		4 ARG B 156
VAL B 128
PHE B 163
GLU B  26
 None
 1.26A 5ad9A-1wqlB:
undetectable
5ad9B-1wqlB:
undetectable		 5ad9A-1wqlB:
19.79
5ad9B-1wqlB:
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.
1wvt HYPOTHETICAL PROTEIN
ST2180

(Sulfurisphaera
tokodaii) 		PF01923
(Cob_adeno_trans) 		4 VAL A  80
PHE A  75
HIS A 139
GLU A 137
 None
 1.46A 5ad9A-1wvtA:
undetectable
5ad9B-1wvtA:
undetectable		 5ad9A-1wvtA:
16.75
5ad9B-1wvtA:
16.75
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.
2awc HEMERYTHRIN-LIKE
DOMAIN PROTEIN DCRH

(Desulfovibrio
vulgaris) 		PF01814
(Hemerythrin) 		4 VAL A  86
PHE A  60
HIS A  59
GLU A  58
 None
FEO  A 137 ( 4.8A)
FEO  A 137 (-3.4A)
None
 1.06A 5ad9A-2awcA:
2.4
5ad9B-2awcA:
2.2		 5ad9A-2awcA:
16.75
5ad9B-2awcA:
16.75
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.
2b39 C3

(Bos taurus) 		PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl) 		4 ARG A 708
VAL A1424
PHE A 722
GLU A 693
 None
 1.05A 5ad9A-2b39A:
undetectable
5ad9B-2b39A:
undetectable		 5ad9A-2b39A:
13.58
5ad9B-2b39A:
13.58
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.
2e9f ARGININOSUCCINATE
LYASE

(Thermus
thermophilus) 		PF00206
(Lyase_1)
PF14698
(ASL_C2) 		4 ARG A 123
TRP A  37
PHE A 221
GLU A 218
 None
 1.33A 5ad9A-2e9fA:
undetectable
5ad9B-2e9fA:
undetectable		 5ad9A-2e9fA:
20.24
5ad9B-2e9fA:
20.24
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.
2ehb CBL-INTERACTING
SERINE/THREONINE-PRO
TEIN KINASE 24

(Arabidopsis
thaliana) 		PF03822
(NAF) 		4 ARG D 368
VAL D 388
HIS D 366
GLU D 375
 None
 1.42A 5ad9A-2ehbD:
undetectable
5ad9B-2ehbD:
undetectable		 5ad9A-2ehbD:
17.16
5ad9B-2ehbD:
17.16
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.
2fja ADENYLYLSULFATE
REDUCTASE, SUBUNIT A
ADENYLYLSULFATE
REDUCTASE, SUBUNIT B

(Archaeoglobus
fulgidus) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C)
PF12139
(APS-reductase_C)
PF13187
(Fer4_9) 		4 ARG A  62
VAL A 367
TRP B 788
GLU A 360
 None
 1.34A 5ad9A-2fjaA:
undetectable
5ad9B-2fjaA:
undetectable		 5ad9A-2fjaA:
22.29
5ad9B-2fjaA:
22.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i9u CYTOSINE/GUANINE
DEAMINASE RELATED
PROTEIN

(Clostridium
acetobutylicum) 		PF01979
(Amidohydro_1) 		4 ARG A 202
TRP A  93
PHE A  99
GLU A 101
 GUN  A 503 (-3.7A)
None
None
None
 1.41A 5ad9A-2i9uA:
undetectable
5ad9B-2i9uA:
undetectable		 5ad9A-2i9uA:
20.97
5ad9B-2i9uA:
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.
2j8m ACETYLTRANSFERASE
PA4866 FROM P.
AERUGINOSA

(Pseudomonas
aeruginosa) 		PF13420
(Acetyltransf_4) 		4 VAL A 118
PHE A 139
HIS A 134
GLU A  85
 None
 1.41A 5ad9A-2j8mA:
undetectable
5ad9B-2j8mA:
undetectable		 5ad9A-2j8mA:
16.39
5ad9B-2j8mA:
16.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nyg YOKD PROTEIN

(Bacillus
subtilis) 		PF02522
(Antibiotic_NAT) 		4 VAL A 227
PHE A 258
HIS A 235
GLU A 232
 None
 1.43A 5ad9A-2nygA:
undetectable
5ad9B-2nygA:
undetectable		 5ad9A-2nygA:
20.28
5ad9B-2nygA:
20.28
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.
2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE

(Mycobacterium
tuberculosis) 		PF00698
(Acyl_transf_1) 		4 VAL A 290
PHE A 268
HIS A  71
GLU A  73
 None
 1.32A 5ad9A-2qc3A:
undetectable
5ad9B-2qc3A:
undetectable		 5ad9A-2qc3A:
23.08
5ad9B-2qc3A:
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.
2w4o CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE IV

(Homo sapiens) 		PF00069
(Pkinase) 		4 ARG A 278
VAL A 269
TRP A 266
PHE A 261
 None
 1.40A 5ad9A-2w4oA:
undetectable
5ad9B-2w4oA:
undetectable		 5ad9A-2w4oA:
20.26
5ad9B-2w4oA:
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.
2xvg ALPHA XYLOSIDASE

(Cellvibrio
japonicus) 		PF01055
(Glyco_hydro_31)
PF16338
(DUF4968)
PF17137
(DUF5110) 		4 ARG A 697
VAL A 717
PHE A 698
GLU A 722
 None
 1.35A 5ad9A-2xvgA:
undetectable
5ad9B-2xvgA:
undetectable		 5ad9A-2xvgA:
19.68
5ad9B-2xvgA:
19.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ywb GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG]

(Thermus
thermophilus) 		PF00117
(GATase)
PF00958
(GMP_synt_C) 		4 ARG A 211
VAL A 239
PHE A 309
GLU A 305
 None
 1.32A 5ad9A-2ywbA:
undetectable
5ad9B-2ywbA:
undetectable		 5ad9A-2ywbA:
21.54
5ad9B-2ywbA:
21.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z11 RIBOSOMAL-PROTEIN-AL
ANINE
ACETYLTRANSFERASE

(Thermus
thermophilus) 		PF13302
(Acetyltransf_3) 		4 VAL A  64
TRP A  66
PHE A   4
GLU A   6
 None
 1.42A 5ad9A-2z11A:
undetectable
5ad9B-2z11A:
undetectable		 5ad9A-2z11A:
17.58
5ad9B-2z11A:
17.58
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.
3b7f GLYCOSYL HYDROLASE,
BNR REPEAT

(Cupriavidus
pinatubonensis) 		no annotation 4 VAL A 314
TRP A 293
TRP A 374
GLU A 372
 None
None
None
EDO  A 404 ( 3.8A)
 1.40A 5ad9A-3b7fA:
undetectable
5ad9B-3b7fA:
undetectable		 5ad9A-3b7fA:
20.87
5ad9B-3b7fA:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ckn PUTATIVE
UNCHARACTERIZED
PROTEIN

(Mycobacterium
avium) 		PF00535
(Glycos_transf_2) 		4 ARG A 261
VAL A  66
HIS A 263
GLU A  59
 None
None
MN  A 330 ( 3.7A)
UDP  A 332 (-2.4A)
 1.33A 5ad9A-3cknA:
undetectable
5ad9B-3cknA:
undetectable		 5ad9A-3cknA:
24.08
5ad9B-3cknA:
24.08
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.
3ddl XANTHORHODOPSIN

(Salinibacter
ruber) 		PF01036
(Bac_rhodopsin) 		4 VAL A  16
TRP A  70
PHE A  88
GLU A  71
 None
 1.44A 5ad9A-3ddlA:
undetectable
5ad9B-3ddlA:
undetectable		 5ad9A-3ddlA:
20.14
5ad9B-3ddlA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dr8 YNCA

(Salmonella
enterica) 		PF13420
(Acetyltransf_4) 		4 VAL A 115
PHE A 136
HIS A 131
GLU A  82
 None
None
ACO  A1423 ( 4.5A)
ACT  A1429 (-2.8A)
 1.43A 5ad9A-3dr8A:
undetectable
5ad9B-3dr8A:
undetectable		 5ad9A-3dr8A:
16.86
5ad9B-3dr8A:
16.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3e7g NITRIC OXIDE
SYNTHASE, INDUCIBLE

(Homo sapiens) 		PF02898
(NO_synthase) 		4 TRP A 461
PHE A 476
HIS A 477
GLU A 479
 None
 0.18A 5ad9A-3e7gA:
56.4
5ad9B-3e7gA:
56.6		 5ad9A-3e7gA:
65.64
5ad9B-3e7gA:
65.64
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.
3eqq BENZENE
1,2-DIOXYGENASE
SUBUNIT ALPHA
BENZENE
1,2-DIOXYGENASE
SUBUNIT BETA

(Pseudomonas
putida) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A)
PF00866
(Ring_hydroxyl_B) 		4 VAL A 340
TRP A 341
TRP A 203
HIS B  80
 None
 1.46A 5ad9A-3eqqA:
undetectable
5ad9B-3eqqA:
undetectable		 5ad9A-3eqqA:
21.78
5ad9B-3eqqA:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fi9 MALATE DEHYDROGENASE

(Porphyromonas
gingivalis) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 VAL A 171
PHE A 164
HIS A 163
GLU A 159
 None
 1.24A 5ad9A-3fi9A:
undetectable
5ad9B-3fi9A:
undetectable		 5ad9A-3fi9A:
21.79
5ad9B-3fi9A:
21.79
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.
3gn6 CT0912, ORFAN
PROTEIN WITH A
FERREDOXIN-LIKE
DOMAIN REPEAT

(Chlorobaculum
tepidum) 		no annotation 4 ARG A 259
VAL A 218
TRP A 214
HIS A 211
 None
 1.36A 5ad9A-3gn6A:
undetectable
5ad9B-3gn6A:
undetectable		 5ad9A-3gn6A:
20.63
5ad9B-3gn6A:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gyx ADENYLYLSULFATE
REDUCTASE

(Desulfovibrio
gigas) 		PF00890
(FAD_binding_2)
PF12139
(APS-reductase_C)
PF13187
(Fer4_9) 		4 ARG A  66
VAL A 387
TRP B  88
GLU A 380
 None
 1.27A 5ad9A-3gyxA:
undetectable
5ad9B-3gyxA:
undetectable		 5ad9A-3gyxA:
20.98
5ad9B-3gyxA:
20.98
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.
3ixw HEMOCYANIN AA6 CHAIN

(Androctonus
australis) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		4 ARG A 270
PHE A 363
HIS A 224
GLU A 228
 None
 1.16A 5ad9A-3ixwA:
undetectable
5ad9B-3ixwA:
undetectable		 5ad9A-3ixwA:
20.50
5ad9B-3ixwA:
20.50
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.
3k7t 6-HYDROXY-L-NICOTINE
OXIDASE

(Paenarthrobacter
nicotinovorans) 		PF01593
(Amino_oxidase) 		4 VAL A 276
PHE A 379
HIS A 383
GLU A 385
 None
 1.28A 5ad9A-3k7tA:
undetectable
5ad9B-3k7tA:
undetectable		 5ad9A-3k7tA:
20.21
5ad9B-3k7tA:
20.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lwt PHOSPHOINOSITIDE
PHOSPHATASE SAC1

(Saccharomyces
cerevisiae) 		PF02383
(Syja_N) 		4 ARG X 389
VAL X 321
PHE X 289
HIS X 288
 None
 1.27A 5ad9A-3lwtX:
undetectable
5ad9B-3lwtX:
undetectable		 5ad9A-3lwtX:
21.70
5ad9B-3lwtX:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lwt PHOSPHOINOSITIDE
PHOSPHATASE SAC1

(Saccharomyces
cerevisiae) 		PF02383
(Syja_N) 		4 ARG X 389
VAL X 322
PHE X 289
HIS X 288
 None
 1.43A 5ad9A-3lwtX:
undetectable
5ad9B-3lwtX:
undetectable		 5ad9A-3lwtX:
21.70
5ad9B-3lwtX:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ma6 CALMODULIN-DOMAIN
PROTEIN KINASE 1

(Toxoplasma
gondii) 		PF00069
(Pkinase) 		4 ARG A 269
VAL A 260
TRP A 257
PHE A 252
 None
 1.41A 5ad9A-3ma6A:
undetectable
5ad9B-3ma6A:
undetectable		 5ad9A-3ma6A:
21.55
5ad9B-3ma6A:
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.
3n3k UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 8

(Homo sapiens) 		PF00443
(UCH) 		4 ARG A 944
TRP A1001
PHE A 946
GLU A 908
 None
 1.44A 5ad9A-3n3kA:
undetectable
5ad9B-3n3kA:
undetectable		 5ad9A-3n3kA:
19.83
5ad9B-3n3kA:
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.
3ner CYTOCHROME B5 TYPE B

(Homo sapiens) 		PF00173
(Cyt-b5) 		4 ARG A  68
VAL A  61
PHE A  58
GLU A  56
 None
HEM  A 201 (-4.5A)
HEM  A 201 (-4.7A)
None
 1.45A 5ad9A-3nerA:
undetectable
5ad9B-3nerA:
undetectable		 5ad9A-3nerA:
14.93
5ad9B-3nerA:
14.93
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.
3of7 REGULATOR OF
CHROMOSOME
CONDENSATION

(Saccharomyces
cerevisiae) 		PF00415
(RCC1)
PF13540
(RCC1_2) 		4 VAL A 462
TRP A 108
HIS A  95
GLU A  58
 None
 1.34A 5ad9A-3of7A:
undetectable
5ad9B-3of7A:
undetectable		 5ad9A-3of7A:
21.91
5ad9B-3of7A:
21.91
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.
3oqc UFM1-SPECIFIC
PROTEASE 2

(Mus musculus) 		PF07910
(Peptidase_C78) 		4 VAL A 204
PHE A 235
HIS A 223
GLU A 221
 None
 1.32A 5ad9A-3oqcA:
undetectable
5ad9B-3oqcA:
undetectable		 5ad9A-3oqcA:
20.43
5ad9B-3oqcA:
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.
3owc PROBABLE
ACETYLTRANSFERASE

(Pseudomonas
aeruginosa) 		PF00583
(Acetyltransf_1) 		4 ARG A 175
VAL A  92
PHE A 121
GLU A 119
 None
 1.18A 5ad9A-3owcA:
undetectable
5ad9B-3owcA:
undetectable		 5ad9A-3owcA:
16.47
5ad9B-3owcA:
16.47
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.
3rjy ENDOGLUCANASE
FNCEL5A

(Fervidobacterium
nodosum) 		PF00150
(Cellulase) 		4 VAL A 149
TRP A 146
PHE A 162
GLU A 187
 None
 1.30A 5ad9A-3rjyA:
undetectable
5ad9B-3rjyA:
undetectable		 5ad9A-3rjyA:
21.27
5ad9B-3rjyA:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sng NUCLEASE

(Solanum
lycopersicum) 		PF02265
(S1-P1_nuclease) 		4 VAL A 271
TRP A 184
HIS A 181
GLU A 187
 None
None
ZN  A 403 ( 3.3A)
None
 1.18A 5ad9A-3sngA:
undetectable
5ad9B-3sngA:
undetectable		 5ad9A-3sngA:
20.74
5ad9B-3sngA:
20.74
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.
3ti8 NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		4 VAL A 240
TRP A 239
PHE A 305
GLU A 265
 None
 1.38A 5ad9A-3ti8A:
undetectable
5ad9B-3ti8A:
undetectable		 5ad9A-3ti8A:
22.64
5ad9B-3ti8A:
22.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3twk FORMAMIDOPYRIMIDINE-
DNA GLYCOSYLASE 1

(Arabidopsis
thaliana) 		PF01149
(Fapy_DNA_glyco)
PF06831
(H2TH) 		4 VAL A 222
TRP A 240
PHE A 236
HIS A 243
 None
 1.44A 5ad9A-3twkA:
undetectable
5ad9B-3twkA:
undetectable		 5ad9A-3twkA:
21.86
5ad9B-3twkA:
21.86
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.
3ucg POLYADENYLATE-BINDIN
G PROTEIN 2

(Homo sapiens) 		PF00076
(RRM_1) 		4 VAL A 201
PHE A 192
HIS A 191
GLU A 187
 None
 1.08A 5ad9A-3ucgA:
undetectable
5ad9B-3ucgA:
undetectable		 5ad9A-3ucgA:
11.85
5ad9B-3ucgA:
11.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3uto TWITCHIN

(Caenorhabditis
elegans) 		PF00041
(fn3)
PF00069
(Pkinase)
PF07679
(I-set) 		4 VAL A 255
TRP A 410
PHE A 387
HIS A 408
 None
 1.40A 5ad9A-3utoA:
undetectable
5ad9B-3utoA:
undetectable		 5ad9A-3utoA:
20.97
5ad9B-3utoA:
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.
3uxm THYMIDYLATE KINASE

(Pseudomonas
aeruginosa) 		PF02223
(Thymidylate_kin) 		4 ARG A 109
VAL A 166
PHE A 162
GLU A 156
 None
None
None
MG  A 213 (-3.2A)
 1.33A 5ad9A-3uxmA:
undetectable
5ad9B-3uxmA:
undetectable		 5ad9A-3uxmA:
20.29
5ad9B-3uxmA:
20.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bgd PRE-MRNA-SPLICING
FACTOR 8

(Saccharomyces
cerevisiae) 		PF08084
(PROCT) 		4 VAL C2274
TRP C2314
PHE C2329
GLU C2310
 None
 1.34A 5ad9A-4bgdC:
undetectable
5ad9B-4bgdC:
undetectable		 5ad9A-4bgdC:
20.99
5ad9B-4bgdC:
20.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cr4 26S PROTEASE
REGULATORY SUBUNIT
6B HOMOLOG
26S PROTEASE SUBUNIT
RPT4

(Saccharomyces
cerevisiae) 		PF00004
(AAA) 		4 VAL K 160
PHE K 242
HIS K 244
GLU L 258
 None
 1.38A 5ad9A-4cr4K:
undetectable
5ad9B-4cr4K:
undetectable		 5ad9A-4cr4K:
21.86
5ad9B-4cr4K:
21.86
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.
4d8o ANKYRIN-2

(Homo sapiens) 		PF00531
(Death)
PF00791
(ZU5) 		4 ARG A1065
VAL A1046
PHE A1118
GLU A1032
 None
 1.35A 5ad9A-4d8oA:
undetectable
5ad9B-4d8oA:
undetectable		 5ad9A-4d8oA:
19.44
5ad9B-4d8oA:
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.
4e0t CYCLIC DIPEPTIDE
N-PRENYLTRANSFERASE

(Aspergillus
fumigatus) 		PF11991
(Trp_DMAT) 		4 VAL A 165
PHE A 155
HIS A 170
GLU A 168
 None
 1.32A 5ad9A-4e0tA:
undetectable
5ad9B-4e0tA:
undetectable		 5ad9A-4e0tA:
21.92
5ad9B-4e0tA:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l37 ARYLPHORIN

(Bombyx mori) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		4 VAL B 351
TRP B 355
PHE B 327
GLU B 424
 None
 0.97A 5ad9A-4l37B:
undetectable
5ad9B-4l37B:
undetectable		 5ad9A-4l37B:
20.69
5ad9B-4l37B:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l4x AMPHI

(Streptomyces
nodosus) 		PF08659
(KR) 		4 VAL A 502
TRP A 504
HIS A 508
GLU A 505
 None
 1.30A 5ad9A-4l4xA:
undetectable
5ad9B-4l4xA:
undetectable		 5ad9A-4l4xA:
20.27
5ad9B-4l4xA:
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.
4ldu AUXIN RESPONSE
FACTOR 5

(Arabidopsis
thaliana) 		PF02362
(B3)
PF06507
(Auxin_resp) 		4 VAL A 200
PHE A 184
HIS A 212
GLU A 197
 None
 1.17A 5ad9A-4lduA:
undetectable
5ad9B-4lduA:
undetectable		 5ad9A-4lduA:
21.63
5ad9B-4lduA:
21.63
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.
4mln PREDICTED HD
PHOSPHOHYDROLASE
PHNZ

(uncultured
bacterium
HF130_AEPn_1) 		PF01966
(HD) 		4 VAL A   9
PHE A  93
HIS A 184
GLU A 183
 None
 1.13A 5ad9A-4mlnA:
undetectable
5ad9B-4mlnA:
undetectable		 5ad9A-4mlnA:
16.55
5ad9B-4mlnA:
16.55
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.
4mtk VGRG1

(Pseudomonas
aeruginosa) 		PF05954
(Phage_GPD) 		4 VAL A 178
PHE A 168
HIS A 175
GLU A 171
 None
 1.31A 5ad9A-4mtkA:
undetectable
5ad9B-4mtkA:
undetectable		 5ad9A-4mtkA:
19.94
5ad9B-4mtkA:
19.94
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.
4n6w PREDICTED HD
PHOSPHOHYDROLASE
PHNZ

(uncultured
bacterium
HF130_AEPn_1) 		PF01966
(HD) 		4 VAL A   9
PHE A  93
HIS A 184
GLU A 183
 None
 1.07A 5ad9A-4n6wA:
undetectable
5ad9B-4n6wA:
undetectable		 5ad9A-4n6wA:
19.62
5ad9B-4n6wA:
19.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p2l SULFHYDRYL OXIDASE 1

(Rattus
norvegicus) 		PF00085
(Thioredoxin)
PF04777
(Evr1_Alr) 		4 ARG A 125
VAL A  53
PHE A  68
GLU A 115
 None
 1.36A 5ad9A-4p2lA:
undetectable
5ad9B-4p2lA:
undetectable		 5ad9A-4p2lA:
21.63
5ad9B-4p2lA:
21.63
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.
4pne METHYLTRANSFERASE-LI
KE PROTEIN

(Saccharopolyspora
spinosa) 		PF08241
(Methyltransf_11) 		4 ARG A  75
VAL A  79
PHE A 141
GLU A 162
 None
 1.38A 5ad9A-4pneA:
undetectable
5ad9B-4pneA:
undetectable		 5ad9A-4pneA:
21.36
5ad9B-4pneA:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pvv ADENOSINE KINASE

(Mycobacterium
tuberculosis) 		PF00294
(PfkB) 		4 ARG A 275
VAL A 320
HIS A 314
GLU A 313
 None
 1.26A 5ad9A-4pvvA:
undetectable
5ad9B-4pvvA:
undetectable		 5ad9A-4pvvA:
21.83
5ad9B-4pvvA:
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.
4q4l ATP SYNTHASE SUBUNIT
BETA 1

(Burkholderia
thailandensis) 		PF00006
(ATP-synt_ab)
PF02874
(ATP-synt_ab_N) 		4 VAL A 192
PHE A 247
HIS A 246
GLU A 245
 None
 1.19A 5ad9A-4q4lA:
undetectable
5ad9B-4q4lA:
undetectable		 5ad9A-4q4lA:
21.50
5ad9B-4q4lA:
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.
4x8d SULFOXIDE SYNTHASE
EGTB

(Mycolicibacterium
thermoresistibile) 		PF03781
(FGE-sulfatase)
PF12867
(DinB_2) 		4 VAL A 427
TRP A 361
HIS A 276
GLU A 281
 None
 1.22A 5ad9A-4x8dA:
undetectable
5ad9B-4x8dA:
undetectable		 5ad9A-4x8dA:
20.24
5ad9B-4x8dA:
20.24
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.
4xeu TRANSKETOLASE

(Pseudomonas
aeruginosa) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 ARG A   5
VAL A  39
HIS A 219
GLU A 223
 None
None
None
CA  A 702 (-2.6A)
 1.34A 5ad9A-4xeuA:
undetectable
5ad9B-4xeuA:
undetectable		 5ad9A-4xeuA:
19.62
5ad9B-4xeuA:
19.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xj6 VC0179-LIKE PROTEIN

(Escherichia
coli) 		no annotation 4 ARG A 276
VAL A 305
PHE A 264
GLU A 266
 None
 1.20A 5ad9A-4xj6A:
undetectable
5ad9B-4xj6A:
undetectable		 5ad9A-4xj6A:
21.06
5ad9B-4xj6A:
21.06
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.
4xj6 VC0179-LIKE PROTEIN

(Escherichia
coli) 		no annotation 4 VAL A 305
TRP A 263
PHE A 264
GLU A 266
 None
 1.11A 5ad9A-4xj6A:
undetectable
5ad9B-4xj6A:
undetectable		 5ad9A-4xj6A:
21.06
5ad9B-4xj6A:
21.06
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.
4ylr TUBULIN
POLYGLUTAMYLASE
TTLL7

(Homo sapiens) 		PF03133
(TTL) 		4 VAL A 288
TRP A 292
PHE A 277
GLU A 279
 None
 1.45A 5ad9A-4ylrA:
undetectable
5ad9B-4ylrA:
undetectable		 5ad9A-4ylrA:
22.81
5ad9B-4ylrA:
22.81
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.
4yom SERINE/THREONINE-PRO
TEIN KINASE BRSK2

(Mus musculus) 		no annotation 4 VAL A 626
PHE A 555
HIS A 563
GLU A 574
 None
 1.26A 5ad9A-4yomA:
undetectable
5ad9B-4yomA:
undetectable		 5ad9A-4yomA:
16.11
5ad9B-4yomA:
16.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zht BIFUNCTIONAL
UDP-N-ACETYLGLUCOSAM
INE
2-EPIMERASE/N-ACETYL
MANNOSAMINE KINASE

(Homo sapiens) 		PF02350
(Epimerase_2) 		4 VAL A 249
PHE A 276
HIS A 273
GLU A 271
 None
None
None
NCC  A 502 (-2.7A)
 1.35A 5ad9A-4zhtA:
undetectable
5ad9B-4zhtA:
undetectable		 5ad9A-4zhtA:
21.68
5ad9B-4zhtA:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a7d INSCUTEABLE
PINS

(Drosophila
melanogaster) 		PF13176
(TPR_7)
PF13424
(TPR_12)
no annotation 		4 ARG B 339
VAL L 310
TRP L 313
HIS B 324
 None
 1.11A 5ad9A-5a7dB:
undetectable
5ad9B-5a7dB:
undetectable		 5ad9A-5a7dB:
21.95
5ad9B-5a7dB:
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.
5bs1 CRRBCX-IIA

(Chlamydomonas
reinhardtii) 		PF02341
(RcbX) 		4 ARG A 123
VAL A 108
TRP A 104
GLU A 103
 ARG  A 123 ( 0.6A)
VAL  A 108 ( 0.6A)
TRP  A 104 ( 0.5A)
GLU  A 103 ( 0.6A)
 1.35A 5ad9A-5bs1A:
undetectable
5ad9B-5bs1A:
undetectable		 5ad9A-5bs1A:
14.45
5ad9B-5bs1A:
14.45
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.
5c6g AGR133CP
SISTER CHROMATID
COHESION PROTEIN 2

(Eremothecium
gossypii) 		PF10345
(Cohesin_load)
no annotation 		4 VAL B  28
TRP A 401
PHE A 397
GLU A 402
 None
 1.41A 5ad9A-5c6gB:
undetectable
5ad9B-5c6gB:
undetectable		 5ad9A-5c6gB:
18.69
5ad9B-5c6gB:
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.
5ejj UFM1-SPECIFIC
PROTEASE

(Caenorhabditis
elegans) 		PF07910
(Peptidase_C78) 		4 VAL A 516
PHE A 495
HIS A 494
GLU A 490
 None
 1.07A 5ad9A-5ejjA:
undetectable
5ad9B-5ejjA:
undetectable		 5ad9A-5ejjA:
21.65
5ad9B-5ejjA:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5foe GDP-FUCOSE PROTEIN
O-FUCOSYLTRANSFERASE
2,THROMBOSPONDIN-1

(Caenorhabditis
elegans;
Homo sapiens) 		PF00090
(TSP_1)
PF10250
(O-FucT) 		4 TRP A 420
TRP A 231
HIS A 222
GLU A 227
 None
 1.44A 5ad9A-5foeA:
undetectable
5ad9B-5foeA:
undetectable		 5ad9A-5foeA:
20.68
5ad9B-5foeA:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5imw INTERMEDILYSIN

(Streptococcus
intermedius) 		PF01289
(Thiol_cytolysin)
PF17440
(Thiol_cytolys_C) 		4 VAL A 248
PHE A 238
HIS A 242
GLU A 245
 None
 1.42A 5ad9A-5imwA:
undetectable
5ad9B-5imwA:
undetectable		 5ad9A-5imwA:
23.05
5ad9B-5imwA:
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.
5iri SERINE/THREONINE-PRO
TEIN KINASE BRSK1

(Mus musculus) 		no annotation 4 VAL A 705
PHE A 628
HIS A 636
GLU A 647
 None
 1.23A 5ad9A-5iriA:
undetectable
5ad9B-5iriA:
undetectable		 5ad9A-5iriA:
14.35
5ad9B-5iriA:
14.35
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.
5kn7 LIPID A BIOSYNTHESIS
LAUROYL
ACYLTRANSFERASE

(Acinetobacter
baumannii) 		PF03279
(Lip_A_acyltrans) 		4 VAL B 116
PHE B 106
HIS B 107
GLU B 108
 None
 1.33A 5ad9A-5kn7B:
undetectable
5ad9B-5kn7B:
undetectable		 5ad9A-5kn7B:
22.48
5ad9B-5kn7B:
22.48
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.
5kn8 ADENINE DNA
GLYCOSYLASE

(Geobacillus
stearothermophilus) 		PF00633
(HHH)
PF00730
(HhH-GPD) 		4 VAL A  92
TRP A  83
PHE A  61
GLU A  84
 None
 1.27A 5ad9A-5kn8A:
undetectable
5ad9B-5kn8A:
undetectable		 5ad9A-5kn8A:
22.28
5ad9B-5kn8A:
22.28
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.
5m58 C-METHYLTRANSFERASE
COUO

(Streptomyces
rishiriensis) 		PF13649
(Methyltransf_25) 		4 VAL A 218
TRP A 161
PHE A 147
HIS A 120
 None
 1.42A 5ad9A-5m58A:
undetectable
5ad9B-5m58A:
undetectable		 5ad9A-5m58A:
19.34
5ad9B-5m58A:
19.34
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.
5m8t 5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE

(Homo sapiens) 		PF00264
(Tyrosinase) 		4 ARG A 225
TRP A 414
PHE A 411
GLU A 413
 None
 1.04A 5ad9A-5m8tA:
undetectable
5ad9B-5m8tA:
undetectable		 5ad9A-5m8tA:
20.00
5ad9B-5m8tA:
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.
5mc5 XAA-PRO DIPEPTIDASE

(Homo sapiens) 		no annotation 4 VAL A 126
PHE A 117
HIS A 112
GLU A 115
 None
 1.45A 5ad9A-5mc5A:
undetectable
5ad9B-5mc5A:
undetectable		 5ad9A-5mc5A:
12.07
5ad9B-5mc5A:
12.07
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.
5unn NADPH-DEPENDENT
GLYOXYLATE/HYDROXYPY
RUVATE REDUCTASE

(Sinorhizobium
meliloti) 		PF02826
(2-Hacid_dh_C) 		4 VAL A 289
PHE A  93
HIS A 295
GLU A 297
 None
 1.21A 5ad9A-5unnA:
undetectable
5ad9B-5unnA:
undetectable		 5ad9A-5unnA:
21.44
5ad9B-5unnA:
21.44
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.
5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB

(Acinetobacter
baumannii) 		no annotation 4 VAL A 576
PHE A  94
HIS A  98
GLU A 569
 None
 1.42A 5ad9A-5ws4A:
undetectable
5ad9B-5ws4A:
undetectable		 5ad9A-5ws4A:
20.95
5ad9B-5ws4A:
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.
6cz4 PROTEIN-TYROSINE
KINASE 6

(Homo sapiens) 		no annotation 4 VAL A 400
PHE A 397
HIS A 394
GLU A 395
 None
 1.26A 5ad9A-6cz4A:
undetectable
5ad9B-6cz4A:
undetectable		 5ad9A-6cz4A:
11.87
5ad9B-6cz4A:
11.87