SIMILAR PATTERNS OF AMINO ACIDS FOR 4M2X_A_TMQA202_2

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.
1ced CYTOCHROME C6

(Chlorolobion
braunii) 		PF13442
(Cytochrome_CBB3) 		3 TRP A  89
GLN A  39
THR A  31
 None
 0.96A 4m2xA-1cedA:
undetectable		 4m2xA-1cedA:
20.67
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.
1d7b CELLOBIOSE
DEHYDROGENASE

(Phanerochaete
chrysosporium) 		PF16010
(CDH-cyt) 		3 TRP A 127
GLN A 122
THR A 125
 None
 0.99A 4m2xA-1d7bA:
0.0		 4m2xA-1d7bA:
22.34
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.
1ed3 CLASS I MAJOR
HISTOCOMPATIBILITY
ANTIGEN RT1-AA

(Rattus
norvegicus) 		PF00129
(MHC_I)
PF07654
(C1-set) 		3 TRP A 217
GLN A 226
THR A 216
 None
 0.65A 4m2xA-1ed3A:
0.4		 4m2xA-1ed3A:
23.19
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.
1f3y DIADENOSINE
5',5'''-P1,P4-TETRAP
HOSPHATE HYDROLASE

(Lupinus
angustifolius) 		PF00293
(NUDIX) 		3 TRP A 134
GLN A  44
THR A  65
 None
 0.86A 4m2xA-1f3yA:
0.0		 4m2xA-1f3yA:
23.38
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.
1ic8 HEPATOCYTE NUCLEAR
FACTOR 1-ALPHA

(Homo sapiens) 		PF00046
(Homeobox)
PF04814
(HNF-1_N) 		3 TRP A 165
GLN A 157
THR A 164
 None
 0.87A 4m2xA-1ic8A:
undetectable		 4m2xA-1ic8A:
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.
1jf0 OBELIN

(Obelia
longissima) 		PF13499
(EF-hand_7)
PF13833
(EF-hand_8) 		3 TRP A  18
GLN A 174
THR A 181
 None
 0.89A 4m2xA-1jf0A:
undetectable		 4m2xA-1jf0A:
23.33
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.
1kxq ANTIBODY VHH
FRAGMENT CABAMD9

(Camelus
dromedarius) 		PF07686
(V-set) 		3 TRP E 110
GLN E   3
THR E  95
 None
 0.69A 4m2xA-1kxqE:
undetectable		 4m2xA-1kxqE:
23.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pjm IMPORTIN ALPHA-2
SUBUNIT

(Mus musculus) 		PF00514
(Arm)
PF16186
(Arm_3) 		3 TRP B 357
GLN B 394
THR B 356
 None
 0.72A 4m2xA-1pjmB:
undetectable		 4m2xA-1pjmB:
17.66
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.
1qb4 PHOSPHOENOLPYRUVATE
CARBOXYLASE

(Escherichia
coli) 		PF00311
(PEPcase) 		3 TRP A 186
GLN A 180
THR A  22
 None
 0.86A 4m2xA-1qb4A:
0.0		 4m2xA-1qb4A:
12.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1quu HUMAN SKELETAL
MUSCLE ALPHA-ACTININ
2

(Homo sapiens) 		PF00435
(Spectrin) 		3 TRP A  29
GLN A  21
THR A  28
 None
 1.00A 4m2xA-1quuA:
undetectable		 4m2xA-1quuA:
19.69
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.
1qv0 OBELIN

(Obelia
longissima) 		PF00036
(EF-hand_1)
PF13202
(EF-hand_5) 		3 TRP A  18
GLN A 174
THR A 181
 None
 0.89A 4m2xA-1qv0A:
undetectable		 4m2xA-1qv0A:
23.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qzg PROTECTION OF
TELOMERES PROTEIN 1

(Schizosaccharomyces
pombe) 		PF02765
(POT1) 		3 TRP A  72
GLN A  28
THR A  75
 None
 0.96A 4m2xA-1qzgA:
undetectable		 4m2xA-1qzgA:
21.00
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.
1r76 PECTATE LYASE

(Niveispirillum
irakense) 		PF09492
(Pec_lyase) 		3 TRP A 376
GLN A 285
THR A 349
 None
 1.02A 4m2xA-1r76A:
undetectable		 4m2xA-1r76A:
18.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tdj BIOSYNTHETIC
THREONINE DEAMINASE

(Escherichia
coli) 		PF00291
(PALP)
PF00585
(Thr_dehydrat_C) 		3 TRP A 153
GLN A   5
THR A 152
 None
 1.01A 4m2xA-1tdjA:
2.2		 4m2xA-1tdjA:
16.49
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.
1z5y THIOL:DISULFIDE
INTERCHANGE PROTEIN
DSBE

(Escherichia
coli) 		PF08534
(Redoxin) 		3 TRP E  79
GLN E 110
THR E  78
 None
 0.88A 4m2xA-1z5yE:
undetectable		 4m2xA-1z5yE:
19.21
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.
1z5z HELICASE OF THE
SNF2/RAD54 FAMILY

(Sulfolobus
solfataricus) 		PF00271
(Helicase_C) 		3 TRP A 828
GLN A 712
THR A 754
 None
 0.95A 4m2xA-1z5zA:
undetectable		 4m2xA-1z5zA:
22.75
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.
2b1l THIOL:DISULFIDE
INTERCHANGE PROTEIN
DSBE

(Escherichia
coli) 		PF08534
(Redoxin) 		3 TRP A  79
GLN A 110
THR A  78
 None
 0.98A 4m2xA-2b1lA:
undetectable		 4m2xA-2b1lA:
19.63
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.
2bco SUCCINYLGLUTAMATE
DESUCCINYLASE

(Vibrio
parahaemolyticus) 		PF04952
(AstE_AspA) 		3 TRP A 205
GLN A 214
THR A 172
 None
 0.85A 4m2xA-2bcoA:
undetectable		 4m2xA-2bcoA:
18.05
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.
2bkl PROLYL ENDOPEPTIDASE

(Myxococcus
xanthus) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		3 TRP A 186
GLN A 231
THR A 202
 None
 0.97A 4m2xA-2bklA:
undetectable		 4m2xA-2bklA:
12.95
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.
2cwb CHIMERA OF
IMMUNOGLOBULIN G
BINDING PROTEIN G
AND UBIQUITIN-LIKE
PROTEIN SB132

(Homo sapiens;
Streptococcus
sp.) 		PF00627
(UBA) 		3 TRP A  66
GLN A  96
THR A  91
 None
 1.03A 4m2xA-2cwbA:
undetectable		 4m2xA-2cwbA:
19.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dut HETEROCHROMATIN-ASSO
CIATED PROTEIN MENT

(Gallus gallus) 		PF00079
(Serpin) 		3 TRP A 163
GLN A 155
THR A 162
 None
 0.99A 4m2xA-2dutA:
undetectable		 4m2xA-2dutA:
18.85
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.
2ea1 RIBONUCLEASE I

(Escherichia
coli) 		PF00445
(Ribonuclease_T2) 		3 TRP A  20
GLN A  28
THR A 205
 None
 0.95A 4m2xA-2ea1A:
undetectable		 4m2xA-2ea1A:
21.40
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.
2gh8 CAPSID PROTEIN

(Vesicular
exanthema of
swine virus) 		PF00915
(Calici_coat) 		3 TRP A 209
GLN A 657
THR A 339
 None
 0.99A 4m2xA-2gh8A:
undetectable		 4m2xA-2gh8A:
14.05
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.
2h26 T-CELL SURFACE
GLYCOPROTEIN CD1B

(Homo sapiens) 		PF07654
(C1-set)
PF16497
(MHC_I_3) 		3 TRP A  40
GLN A  97
THR A  26
 6UL  A 312 (-4.7A)
None
None
 1.04A 4m2xA-2h26A:
undetectable		 4m2xA-2h26A:
21.28
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.
2hfh GENESIS

(Rattus
norvegicus) 		PF00250
(Forkhead) 		3 TRP A  77
GLN A  21
THR A  78
 None
 0.86A 4m2xA-2hfhA:
undetectable		 4m2xA-2hfhA:
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.
2ifw SCYTALIDOPEPSIN B

(Scytalidium
lignicola) 		PF01828
(Peptidase_A4) 		3 TRP A  39
GLN A  90
THR A  54
 None
 0.94A 4m2xA-2ifwA:
undetectable		 4m2xA-2ifwA:
24.66
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.
2inc TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT

(Pseudomonas
stutzeri) 		PF02332
(Phenol_Hydrox) 		3 TRP B 292
GLN B 286
THR B 220
 None
 1.00A 4m2xA-2incB:
undetectable		 4m2xA-2incB:
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.
2jjp CYTOCHROME P450
113A1

(Saccharopolyspora
erythraea) 		PF00067
(p450) 		3 TRP A 315
GLN A  60
THR A 314
 None
 0.87A 4m2xA-2jjpA:
undetectable		 4m2xA-2jjpA:
19.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2npl COXSACKIEVIRUS AND
ADENOVIRUS RECEPTOR

(Homo sapiens) 		PF13927
(Ig_3) 		3 TRP X  36
GLN X  33
THR X  54
 None
 0.97A 4m2xA-2nplX:
undetectable		 4m2xA-2nplX:
20.39
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.
2p13 CBS DOMAIN

(Nitrosomonas
europaea) 		PF03471
(CorC_HlyC) 		3 TRP A 443
GLN A 489
THR A 442
 None
 0.93A 4m2xA-2p13A:
undetectable		 4m2xA-2p13A:
22.67
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.
2po4 VIRION RNA
POLYMERASE

(Escherichia
virus N4) 		no annotation 3 TRP A 975
GLN A 934
THR A 973
 None
 0.78A 4m2xA-2po4A:
undetectable		 4m2xA-2po4A:
10.42
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.
2x2i ALPHA-1,4-GLUCAN
LYASE ISOZYME 1

(Gracilariopsis
lemaneiformis) 		PF01055
(Glyco_hydro_31) 		3 TRP A 589
GLN A 614
THR A 591
 None
 1.02A 4m2xA-2x2iA:
undetectable		 4m2xA-2x2iA:
9.97
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.
3d3q TRNA
DELTA(2)-ISOPENTENYL
PYROPHOSPHATE
TRANSFERASE

(Staphylococcus
epidermidis) 		PF01715
(IPPT) 		3 TRP A 283
GLN A 275
THR A 282
 None
 0.99A 4m2xA-3d3qA:
2.3		 4m2xA-3d3qA:
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.
3f6t ASPARTATE
AMINOTRANSFERASE

(Lactobacillus
acidophilus) 		PF00155
(Aminotran_1_2) 		3 TRP A 123
GLN A 386
THR A 142
 None
 1.00A 4m2xA-3f6tA:
1.5		 4m2xA-3f6tA:
14.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h6q MACROCYPIN 1A

(Macrolepiota
procera) 		no annotation 3 TRP A 107
GLN A  58
THR A  65
 None
 0.89A 4m2xA-3h6qA:
undetectable		 4m2xA-3h6qA:
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.
3k5j SUPPRESSOR OF FUSED
FAMILY PROTEIN

(Neisseria
gonorrhoeae) 		PF05076
(SUFU) 		3 TRP A  51
GLN A 110
THR A  74
 None
 1.03A 4m2xA-3k5jA:
undetectable		 4m2xA-3k5jA:
24.10
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.
3kpx APOPHOTOPROTEIN
CLYTIN-3

(Clytia gregaria) 		PF13202
(EF-hand_5) 		3 TRP A  21
GLN A 177
THR A 184
 None
 0.89A 4m2xA-3kpxA:
undetectable		 4m2xA-3kpxA:
19.70
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.
3l6d PUTATIVE
OXIDOREDUCTASE

(Pseudomonas
putida) 		PF03446
(NAD_binding_2) 		3 TRP A 262
GLN A 259
THR A 263
 None
 0.85A 4m2xA-3l6dA:
undetectable		 4m2xA-3l6dA:
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.
3ljp CHOLINE OXIDASE

(Arthrobacter
globiformis) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		3 TRP A 436
GLN A 430
THR A 437
 None
 0.78A 4m2xA-3ljpA:
undetectable		 4m2xA-3ljpA:
18.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mve UPF0255 PROTEIN
VV1_0328

(Vibrio
vulnificus) 		PF06500
(DUF1100) 		3 TRP A 102
GLN A 148
THR A 103
 None
None
EDO  A 419 ( 2.8A)
 1.04A 4m2xA-3mveA:
undetectable		 4m2xA-3mveA:
16.79
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.
3ppb PUTATIVE TETR FAMILY
TRANSCRIPTION
REGULATOR

(Shewanella
loihica) 		PF00440
(TetR_N) 		3 TRP A  95
GLN A  87
THR A  94
 EDO  A 210 (-4.3A)
None
PG4  A 218 ( 4.9A)
 0.93A 4m2xA-3ppbA:
undetectable		 4m2xA-3ppbA:
21.84
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.
3pvz UDP-N-ACETYLGLUCOSAM
INE 4,6-DEHYDRATASE

(Aliivibrio
fischeri) 		PF02719
(Polysacc_synt_2) 		3 TRP A 367
GLN A 374
THR A 368
 None
 0.97A 4m2xA-3pvzA:
undetectable		 4m2xA-3pvzA:
17.62
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.
3q5w PROTEIN CUT8

(Schizosaccharomyces
pombe) 		PF08559
(Cut8) 		3 TRP A 173
GLN A 164
THR A 170
 None
 1.01A 4m2xA-3q5wA:
undetectable		 4m2xA-3q5wA:
21.19
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.
3qz1 STEROID
21-HYDROXYLASE

(Bos taurus) 		PF00067
(p450) 		3 TRP A 200
GLN A 227
THR A 199
 3QZ  A 501 (-4.1A)
None
None
 0.98A 4m2xA-3qz1A:
undetectable		 4m2xA-3qz1A:
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.
3uc9 INCREASED
RECOMBINATION
CENTERS PROTEIN 6

(Saccharomyces
cerevisiae) 		no annotation 3 TRP A  45
GLN A 184
THR A  44
 None
 0.92A 4m2xA-3uc9A:
undetectable		 4m2xA-3uc9A:
23.42
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.
3v0a NTNH

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07953
(Toxin_R_bind_N)
PF08470
(NTNH_C) 		3 TRP B 673
GLN B 259
THR B 674
 None
 0.96A 4m2xA-3v0aB:
undetectable		 4m2xA-3v0aB:
8.38
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.
3w15 PEROXISOMAL
TARGETING SIGNAL 2
RECEPTOR

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		3 TRP A 291
GLN A  15
THR A 290
 None
 1.03A 4m2xA-3w15A:
undetectable		 4m2xA-3w15A:
19.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wfa ALPHA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF10566
(Glyco_hydro_97)
PF14508
(GH97_N)
PF14509
(GH97_C) 		3 TRP A 268
GLN A 193
THR A 270
 None
 0.81A 4m2xA-3wfaA:
undetectable		 4m2xA-3wfaA:
12.41
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.
3wkm PUTATIVE ZINC
METALLOPROTEASE
AQ_1964

(Aquifex
aeolicus) 		PF00595
(PDZ)
PF13180
(PDZ_2) 		3 TRP A 242
GLN A 130
THR A 241
 None
 0.99A 4m2xA-3wkmA:
undetectable		 4m2xA-3wkmA:
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.
3x0u UNCHARACTERIZED
PROTEIN

(Vibrio
parahaemolyticus) 		PF03945
(Endotoxin_N) 		3 TRP A  59
GLN A 169
THR A 106
 None
 1.00A 4m2xA-3x0uA:
undetectable		 4m2xA-3x0uA:
14.70
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.
3zgq INTERFERON-INDUCED
PROTEIN WITH
TETRATRICOPEPTIDE
REPEATS 5

(Homo sapiens) 		PF07719
(TPR_2)
PF13181
(TPR_8)
PF13374
(TPR_10)
PF13424
(TPR_12) 		3 TRP A  97
GLN A  76
THR A  96
 None
 0.92A 4m2xA-3zgqA:
undetectable		 4m2xA-3zgqA:
15.43
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.
4a2l TWO-COMPONENT SYSTEM
SENSOR HISTIDINE
KINASE/RESPONSE

(Bacteroides
thetaiotaomicron) 		PF07494
(Reg_prop)
PF07495
(Y_Y_Y) 		3 TRP A 705
GLN A 675
THR A 687
 None
 0.88A 4m2xA-4a2lA:
undetectable		 4m2xA-4a2lA:
12.83
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.
4ax2 RAP1B

(Serratia
marcescens) 		PF16695
(Tai4) 		3 TRP A 145
GLN A  44
THR A 144
 None
 0.88A 4m2xA-4ax2A:
undetectable		 4m2xA-4ax2A:
19.66
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.
4bhy ALANINE RACEMASE

(Aeromonas
hydrophila) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		3 TRP A 324
GLN A 231
THR A 235
 None
 1.01A 4m2xA-4bhyA:
undetectable		 4m2xA-4bhyA:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4by2 ANASTRAL SPINDLE 2,
SAS 4

(Drosophila
melanogaster) 		PF07202
(Tcp10_C) 		3 TRP A 124
GLN A 141
THR A 123
 None
 0.93A 4m2xA-4by2A:
undetectable		 4m2xA-4by2A:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4d0k A-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN2

(Chaetomium
thermophilum) 		no annotation 3 TRP A 127
GLN A 148
THR A 164
 None
 0.99A 4m2xA-4d0kA:
undetectable		 4m2xA-4d0kA:
19.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4eqv INVERTASE 2

(Saccharomyces
cerevisiae) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		3 TRP A  65
GLN A 462
THR A  14
 None
 0.60A 4m2xA-4eqvA:
undetectable		 4m2xA-4eqvA:
14.51
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.
4f7a PUTATIVE
UNCHARACTERIZED
PROTEIN

(Bacteroides
vulgatus) 		PF12741
(SusD-like) 		3 TRP A 107
GLN A 501
THR A 108
 None
 1.00A 4m2xA-4f7aA:
undetectable		 4m2xA-4f7aA:
15.94
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.
4fff LEVAN
FRUCTOTRANSFERASE

(Paenarthrobacter
ureafaciens) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		3 TRP A 272
GLN A 352
THR A 273
 None
 0.85A 4m2xA-4fffA:
undetectable		 4m2xA-4fffA:
18.08
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.
4g3m RIBOFLAVIN
BIOSYNTHESIS PROTEIN
RIBD

(Bacillus
subtilis) 		PF00383
(dCMP_cyt_deam_1)
PF01872
(RibD_C) 		3 TRP A 240
GLN A 235
THR A 239
 None
 0.91A 4m2xA-4g3mA:
10.9		 4m2xA-4g3mA:
18.06
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.
4gaf EBI-005

(Homo sapiens) 		PF00340
(IL1) 		3 TRP A  11
GLN A  31
THR A  17
 None
 0.80A 4m2xA-4gafA:
undetectable		 4m2xA-4gafA:
15.29
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.
4gn2 OXACILLINASE

(Pseudomonas
aeruginosa) 		PF00905
(Transpeptidase) 		3 TRP A 108
GLN A 100
THR A 103
 KCX  A  66 ( 4.1A)
None
None
 0.98A 4m2xA-4gn2A:
undetectable		 4m2xA-4gn2A:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hcj THIJ/PFPI DOMAIN
PROTEIN

(Brachyspira
murdochii) 		PF01965
(DJ-1_PfpI) 		3 TRP A  82
GLN A  14
THR A  80
 None
 0.96A 4m2xA-4hcjA:
undetectable		 4m2xA-4hcjA:
18.65
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.
4hpf POTASSIUM CHANNEL
SUBFAMILY U MEMBER 1

(Homo sapiens) 		PF03493
(BK_channel_a) 		3 TRP A 768
GLN A 772
THR A 695
 None
 1.01A 4m2xA-4hpfA:
undetectable		 4m2xA-4hpfA:
11.98
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.
4igl YENC2

(Yersinia
entomophaga) 		no annotation 3 TRP B 212
GLN B 141
THR B 150
 None
 1.00A 4m2xA-4iglB:
undetectable		 4m2xA-4iglB:
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.
4ixl XYLANASE

(Bacillus sp.
(in: Bacteria)) 		PF00457
(Glyco_hydro_11) 		3 TRP A 100
GLN A 186
THR A 102
 None
 1.03A 4m2xA-4ixlA:
undetectable		 4m2xA-4ixlA:
19.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j7m PROTEIN DOM3Z

(Mus musculus) 		PF08652
(RAI1) 		3 TRP A 149
GLN A 280
THR A 140
 None
U  B   1 ( 4.3A)
None
 0.88A 4m2xA-4j7mA:
undetectable		 4m2xA-4j7mA:
18.16
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.
4k2u ERYTHROCYTE BINDING
ANTIGEN 175

(Plasmodium
falciparum) 		PF03011
(PFEMP)
PF05424
(Duffy_binding) 		3 TRP A 179
GLN A 171
THR A 177
 None
 1.04A 4m2xA-4k2uA:
undetectable		 4m2xA-4k2uA:
18.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mpz SAS-4

(Drosophila
melanogaster) 		PF07202
(Tcp10_C) 		3 TRP A 773
GLN A 790
THR A 772
 None
 0.78A 4m2xA-4mpzA:
undetectable		 4m2xA-4mpzA:
22.33
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.
4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE

(Pseudomonas
syringae group
genomosp. 3) 		PF13229
(Beta_helix) 		3 TRP A 234
GLN A 238
THR A 233
 None
MLY  A 200 ( 3.7A)
None
 0.77A 4m2xA-4nk6A:
undetectable		 4m2xA-4nk6A:
15.68
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.
4o6i NUCLEOPROTEIN

(Lymphocytic
choriomeningitis
mammarenavirus) 		PF17290
(Arena_ncap_C) 		3 TRP A 380
GLN A 402
THR A 379
 IMD  A 606 (-4.3A)
None
None
 0.93A 4m2xA-4o6iA:
undetectable		 4m2xA-4o6iA:
22.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ozy POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE

(Pseudomonas
syringae group
genomosp. 3) 		PF13229
(Beta_helix) 		3 TRP A 234
GLN A 238
THR A 233
 None
 0.83A 4m2xA-4ozyA:
undetectable		 4m2xA-4ozyA:
15.37
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.
4toq CLASS III CHITINASE

(Punica granatum) 		PF00704
(Glyco_hydro_18) 		3 TRP A 207
GLN A 244
THR A 208
 None
None
MG  A 305 (-3.1A)
 0.87A 4m2xA-4toqA:
undetectable		 4m2xA-4toqA:
18.32
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.
4w78 HYDRATASE CHSH1

(Mycobacterium
tuberculosis) 		PF13452
(MaoC_dehydrat_N) 		3 TRP A  72
GLN A 151
THR A  73
 None
 1.01A 4m2xA-4w78A:
undetectable		 4m2xA-4w78A:
22.87
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.
4y1b ANTE

(Streptomyces
sp. NRRL 2288) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 TRP A 123
GLN A 128
THR A 141
 None
 0.88A 4m2xA-4y1bA:
2.6		 4m2xA-4y1bA:
19.85
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.
4zyo ACYL-COA DESATURASE

(Homo sapiens) 		no annotation 3 TRP A 103
GLN A 243
THR A 231
 None
 1.00A 4m2xA-4zyoA:
undetectable		 4m2xA-4zyoA:
19.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5aa6 VANADIUM-DEPENDENT
BROMOPEROXIDASE 2

(Ascophyllum
nodosum) 		no annotation 3 TRP A 280
GLN A 423
THR A 279
 None
 0.50A 4m2xA-5aa6A:
undetectable		 4m2xA-5aa6A:
15.41
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.
5cwu NUCLEOPORIN NUP188

(Chaetomium
thermophilum) 		no annotation 3 TRP A1777
GLN A1709
THR A1776
 None
 0.94A 4m2xA-5cwuA:
undetectable		 4m2xA-5cwuA:
17.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5d62 AGGLUTININ

(Marasmius
oreades) 		PF14200
(RicinB_lectin_2) 		3 TRP A  44
GLN A  36
THR A  41
 None
GLA  A 303 ( 4.8A)
GLA  A 303 ( 4.8A)
 1.00A 4m2xA-5d62A:
undetectable		 4m2xA-5d62A:
19.39
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.
5d7w SERRALYSIN

(Serratia
marcescens) 		PF00353
(HemolysinCabind)
PF00413
(Peptidase_M10)
PF08548
(Peptidase_M10_C) 		3 TRP A  46
GLN A  54
THR A  45
 TRP  A  46 ( 0.5A)
GLN  A  54 ( 0.6A)
THR  A  45 ( 0.8A)
 0.87A 4m2xA-5d7wA:
undetectable		 4m2xA-5d7wA:
16.63
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.
5dm5 PUTATIVE ACYL-COA
THIOESTER HYDROLASE

(Yersinia pestis) 		PF03061
(4HBT) 		3 TRP A 102
GLN A  44
THR A 118
 None
 0.99A 4m2xA-5dm5A:
undetectable		 4m2xA-5dm5A:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5do7 ATP-BINDING CASSETTE
SUB-FAMILY G MEMBER
8

(Homo sapiens) 		PF00005
(ABC_tran)
PF01061
(ABC2_membrane) 		3 TRP B 361
GLN B 137
THR B 365
 None
 0.88A 4m2xA-5do7B:
undetectable		 4m2xA-5do7B:
14.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dz7 POLYKETIDE
BIOSYNTHESIS PROTEIN
PKSE

(Bacillus
subtilis) 		PF00698
(Acyl_transf_1) 		3 TRP A 248
GLN A 156
THR A 249
 None
 0.84A 4m2xA-5dz7A:
undetectable		 4m2xA-5dz7A:
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.
5e9u GLYCOSYLTRANSFERASE
GTF1

(Streptococcus
gordonii) 		PF00534
(Glycos_transf_1) 		3 TRP A 493
GLN A  32
THR A 494
 None
 0.97A 4m2xA-5e9uA:
undetectable		 4m2xA-5e9uA:
16.26
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.
5f7v LMO0181 PROTEIN

(Listeria
monocytogenes) 		PF01547
(SBP_bac_1) 		3 TRP A 379
GLN A  78
THR A  96
 None
 1.04A 4m2xA-5f7vA:
undetectable		 4m2xA-5f7vA:
16.35
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.
5g52 VP2

(Deformed wing
virus) 		PF00073
(Rhv) 		3 TRP B 139
GLN B 160
THR B 138
 None
 0.50A 4m2xA-5g52B:
undetectable		 4m2xA-5g52B:
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.
5gnc AVH146

(Phytophthora
sojae) 		no annotation 3 TRP A 297
GLN A 239
THR A 296
 None
 1.01A 4m2xA-5gncA:
undetectable		 4m2xA-5gncA:
13.05
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.
5gw7 GLUCOSIDASE YGJK

(Escherichia
coli) 		PF01204
(Trehalase) 		3 TRP A 294
GLN A 319
THR A 305
 None
 1.00A 4m2xA-5gw7A:
undetectable		 4m2xA-5gw7A:
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.
5gy0 GLUCANASE

(Ruminiclostridium
thermocellum) 		PF00759
(Glyco_hydro_9)
PF00942
(CBM_3) 		3 TRP A 302
GLN A 296
THR A 303
 None
None
CL  A 703 (-4.0A)
 0.92A 4m2xA-5gy0A:
undetectable		 4m2xA-5gy0A:
13.82
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.
5h42 UNCHARACTERIZED
PROTEIN

(Lachnoclostridium
phytofermentans) 		PF17167
(Glyco_hydro_36) 		3 TRP A 627
GLN A 680
THR A 629
 None
 0.98A 4m2xA-5h42A:
undetectable		 4m2xA-5h42A:
10.64
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.
5h42 UNCHARACTERIZED
PROTEIN

(Lachnoclostridium
phytofermentans) 		PF17167
(Glyco_hydro_36) 		3 TRP A 690
GLN A 680
THR A 629
 None
 0.95A 4m2xA-5h42A:
undetectable		 4m2xA-5h42A:
10.64
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.
5lpc VANADIUM-DEPENDENT
BROMOPEROXIDASE

(Acaryochloris
marina) 		no annotation 3 TRP A 318
GLN A 483
THR A 317
 None
 0.61A 4m2xA-5lpcA:
undetectable		 4m2xA-5lpcA:
13.28
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.
5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1

(Homo sapiens) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		3 TRP A1544
GLN A1566
THR A1573
 None
 0.85A 4m2xA-5nugA:
undetectable		 4m2xA-5nugA:
3.24
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.
5xbp 3NT OXYGENASE ALPHA
SUBUNIT

(Diaphorobacter
sp. DS2) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		3 TRP A 193
GLN A 369
THR A 195
 None
 0.93A 4m2xA-5xbpA:
undetectable		 4m2xA-5xbpA:
15.69
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.
5xn7 PUTATIVE RTX-TOXIN

(Vibrio
vulnificus) 		PF11647
(MLD) 		3 TRP A2863
GLN A2829
THR A2838
 None
 0.98A 4m2xA-5xn7A:
undetectable		 4m2xA-5xn7A:
13.95
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.
5xv7 SERINE-ARGININE (SR)
PROTEIN KINASE 1

(Homo sapiens) 		no annotation 3 TRP A 652
GLN A 620
THR A 627
 None
 0.81A 4m2xA-5xv7A:
undetectable		 4m2xA-5xv7A:
19.38
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.
5xx9 BACTERIOFERRITIN

(Streptomyces
coelicolor) 		no annotation 3 TRP A  37
GLN A 158
THR A  38
 None
 1.02A 4m2xA-5xx9A:
undetectable		 4m2xA-5xx9A:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yem CATALASE

(Mycothermus
thermophilus) 		no annotation 3 TRP A 209
GLN A 163
THR A 206
 None
 1.04A 4m2xA-5yemA:
undetectable		 4m2xA-5yemA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6d34 TERC

(Streptomyces) 		no annotation 3 TRP A 161
GLN A 133
THR A 162
 None
 1.03A 4m2xA-6d34A:
undetectable		 4m2xA-6d34A:
15.43