SIMILAR PATTERNS OF AMINO ACIDS FOR 3QT0_A_486A4

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.
1np8 CALCIUM-DEPENDENT
PROTEASE, SMALL
SUBUNIT

(Rattus
norvegicus) 		PF13833
(EF-hand_8) 		5 CYH A 148
ALA A 117
LEU A 110
ILE A 125
MET A 128
 None
 1.21A 3qt0A-1np8A:
undetectable		 3qt0A-1np8A:
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.
1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE

(Haemophilus
influenzae) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		5 ARG A 270
SER A 166
ALA A 168
LEU A 176
ILE A 271
 CYS  A1374 (-2.5A)
NAP  A1372 (-4.8A)
CYS  A1374 ( 4.8A)
None
None
 1.38A 3qt0A-1pquA:
0.0		 3qt0A-1pquA:
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.
1tkc TRANSKETOLASE

(Saccharomyces
cerevisiae) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 ALA A  41
TYR A 297
LEU A  80
ILE A  17
HIS A 296
 None
 1.40A 3qt0A-1tkcA:
0.0		 3qt0A-1tkcA:
17.23
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.
1vme FLAVOPROTEIN

(Thermotoga
maritima) 		PF00258
(Flavodoxin_1) 		5 ALA A  68
TYR A  16
LEU A  44
ILE A 101
LYS A  46
 None
 1.40A 3qt0A-1vmeA:
undetectable		 3qt0A-1vmeA:
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.
1yts YERSINIA PROTEIN
TYROSINE PHOSPHATASE

(Yersinia
enterocolitica) 		PF00102
(Y_phosphatase) 		5 CYH A 259
SER A 403
ALA A 286
LEU A 282
MET A 273
 None
SO4  A   1 ( 2.8A)
None
None
None
 1.49A 3qt0A-1ytsA:
undetectable		 3qt0A-1ytsA:
22.15
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.
1z7a CONSERVED
HYPOTHETICAL PROTEIN

(Pseudomonas
aeruginosa) 		PF01522
(Polysacc_deac_1) 		5 CYH A  42
ARG A  41
SER A  50
ALA A  52
MET A 104
 None
 1.36A 3qt0A-1z7aA:
0.0		 3qt0A-1z7aA:
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.
2gwn DIHYDROOROTASE

(Porphyromonas
gingivalis) 		PF01979
(Amidohydro_1) 		5 CYH A 217
SER A 221
ALA A 224
ILE A 187
HIS A 239
 None
None
None
None
ZN  A 601 (-3.5A)
 1.28A 3qt0A-2gwnA:
0.0		 3qt0A-2gwnA:
20.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2p54 PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 CYH A 276
LEU A 321
ILE A 339
LYS A 358
HIS A 440
 735  A 469 (-2.9A)
735  A 469 ( 4.3A)
735  A 469 ( 4.1A)
None
735  A 469 (-4.0A)
 1.45A 3qt0A-2p54A:
36.6		 3qt0A-2p54A:
61.94
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.
2rkc HEMAGGLUTININ

(Measles
morbillivirus) 		PF00423
(HN) 		5 SER A 414
ALA A 363
TYR A 452
LEU A 443
PHE A 476
 None
 1.36A 3qt0A-2rkcA:
0.0		 3qt0A-2rkcA:
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.
2w4g MYOSIN HEAVY CHAIN,
SKELETAL MUSCLE,
ADULT

(Gallus gallus) 		PF00063
(Myosin_head)
PF02736
(Myosin_N) 		5 CYH M 479
ARG M 654
ALA M 651
LEU M 536
ILE M 526
 None
 1.32A 3qt0A-2w4gM:
0.0		 3qt0A-2w4gM:
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.
2waa XYLAN ESTERASE,
PUTATIVE, AXE2C

(Cellvibrio
japonicus) 		PF13472
(Lipase_GDSL_2) 		5 SER A 231
TYR A 167
LEU A 329
ILE A 336
MET A 337
 None
 1.49A 3qt0A-2waaA:
undetectable		 3qt0A-2waaA:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wu8 GLUCOSE-6-PHOSPHATE
ISOMERASE

(Mycobacterium
tuberculosis) 		PF00342
(PGI) 		5 SER A 480
TYR A 174
LEU A 171
ILE A 486
PHE A 408
 None
 1.45A 3qt0A-2wu8A:
undetectable		 3qt0A-2wu8A:
18.30
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.
2xxz LYSINE-SPECIFIC
DEMETHYLASE 6B

(Homo sapiens) 		PF02373
(JmjC) 		5 CYH A1202
LEU A1458
ILE A1185
PHE A1350
MET A1351
 None
None
EDO  A2496 (-3.5A)
None
None
 1.50A 3qt0A-2xxzA:
undetectable		 3qt0A-2xxzA:
21.82
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.
2z7x TOLL-LIKE RECEPTOR
2, VARIABLE
LYMPHOCYTE RECEPTOR
B

(Eptatretus
burgeri;
Homo sapiens) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		5 SER A 108
TYR A 136
LEU A 112
ILE A  67
PHE A 120
 None
 1.39A 3qt0A-2z7xA:
undetectable		 3qt0A-2z7xA:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z80 TOLL-LIKE RECEPTOR
2, VARIABLE
LYMPHOCYTE RECEPTOR
B

(Eptatretus
burgeri;
Homo sapiens) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		5 SER A 108
TYR A 136
LEU A 112
ILE A  67
PHE A 120
 None
 1.48A 3qt0A-2z80A:
undetectable		 3qt0A-2z80A:
23.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a2b SERINE
PALMITOYLTRANSFERASE

(Sphingobacterium
multivorum) 		PF00155
(Aminotran_1_2) 		5 SER A 227
ALA A 226
TYR A 101
LEU A 215
ILE A 183
 None
 1.47A 3qt0A-3a2bA:
undetectable		 3qt0A-3a2bA:
22.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		10 ARG A 288
ALA A 292
TYR A 327
LEU A 330
ILE A 341
MET A 348
PHE A 363
MET A 364
LYS A 367
HIS A 449
 None
None
None
MC5  A   1 (-4.4A)
MC5  A   1 (-4.5A)
MC5  A   1 ( 4.0A)
None
MC5  A   1 (-3.7A)
None
MC5  A   1 (-3.9A)
 0.72A 3qt0A-3b0qA:
38.5		 3qt0A-3b0qA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		10 CYH A 285
ARG A 288
ALA A 292
TYR A 327
LEU A 330
ILE A 341
MET A 348
PHE A 363
LYS A 367
HIS A 449
 MC5  A   1 (-3.6A)
None
None
None
MC5  A   1 (-4.4A)
MC5  A   1 (-4.5A)
MC5  A   1 ( 4.0A)
None
None
MC5  A   1 (-3.9A)
 0.61A 3qt0A-3b0qA:
38.5		 3qt0A-3b0qA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		10 CYH A 285
ARG A 288
SER A 289
ALA A 292
LEU A 330
ILE A 341
MET A 348
PHE A 363
LYS A 367
HIS A 449
 MC5  A   1 (-3.6A)
None
MC5  A   1 (-2.6A)
None
MC5  A   1 (-4.4A)
MC5  A   1 (-4.5A)
MC5  A   1 ( 4.0A)
None
None
MC5  A   1 (-3.9A)
 0.77A 3qt0A-3b0qA:
38.5		 3qt0A-3b0qA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b2d CD180 ANTIGEN

(Homo sapiens) 		PF00560
(LRR_1)
PF13855
(LRR_8) 		5 SER A 528
ALA A 551
TYR A 547
LEU A 548
ILE A 511
 None
 1.36A 3qt0A-3b2dA:
undetectable		 3qt0A-3b2dA:
19.97
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.
3cf0 TRANSITIONAL
ENDOPLASMIC
RETICULUM ATPASE

(Mus musculus) 		PF00004
(AAA)
PF09336
(Vps4_C) 		5 ALA A 622
LEU A 639
ILE A 601
PHE A 563
MET A 608
 None
 1.47A 3qt0A-3cf0A:
undetectable		 3qt0A-3cf0A:
20.18
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.
3d7r ESTERASE

(Staphylococcus
aureus) 		PF07859
(Abhydrolase_3) 		5 SER A 160
LEU A 183
ILE A 233
MET A 260
MET A 241
 None
 1.42A 3qt0A-3d7rA:
undetectable		 3qt0A-3d7rA:
20.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		6 ALA D 292
LEU D 330
ILE D 341
MET D 348
MET D 364
HIS D 449
 PLB  D 701 ( 4.1A)
PLB  D 701 ( 4.1A)
PLB  D 701 (-3.6A)
PLB  D 701 ( 4.7A)
PLB  D 701 ( 4.8A)
None
 1.10A 3qt0A-3dzuD:
36.1		 3qt0A-3dzuD:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		6 ALA D 292
TYR D 327
LEU D 330
ILE D 341
MET D 364
HIS D 449
 PLB  D 701 ( 4.1A)
None
PLB  D 701 ( 4.1A)
PLB  D 701 (-3.6A)
PLB  D 701 ( 4.8A)
None
 1.16A 3qt0A-3dzuD:
36.1		 3qt0A-3dzuD:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		6 CYH D 285
ALA D 292
TYR D 327
LEU D 330
ILE D 341
HIS D 449
 PLB  D 701 (-3.2A)
PLB  D 701 ( 4.1A)
None
PLB  D 701 ( 4.1A)
PLB  D 701 (-3.6A)
None
 1.12A 3qt0A-3dzuD:
36.1		 3qt0A-3dzuD:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		5 SER D 289
ALA D 292
ILE D 341
MET D 348
HIS D 449
 PLB  D 701 ( 3.9A)
PLB  D 701 ( 4.1A)
PLB  D 701 (-3.6A)
PLB  D 701 ( 4.7A)
None
 0.87A 3qt0A-3dzuD:
36.1		 3qt0A-3dzuD:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		5 SER D 289
ALA D 292
TYR D 327
ILE D 341
HIS D 449
 PLB  D 701 ( 3.9A)
PLB  D 701 ( 4.1A)
None
PLB  D 701 (-3.6A)
None
 0.97A 3qt0A-3dzuD:
36.1		 3qt0A-3dzuD:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q0c HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-9 SPECIFIC
SUVH5

(Arabidopsis
thaliana) 		no annotation 5 SER X 409
ALA X 407
TYR X 428
LEU X 513
ILE X 516
 None
 1.42A 3qt0A-3q0cX:
undetectable		 3qt0A-3q0cX:
20.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qkw NUCLEOTIDE SUGAR
SYNTHETASE-LIKE
PROTEIN

(Streptococcus
parasanguinis) 		no annotation 5 TYR A 238
LEU A 105
ILE A 118
MET A 143
MET A 134
 None
 1.31A 3qt0A-3qkwA:
undetectable		 3qt0A-3qkwA:
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.
3t6q CD180 ANTIGEN

(Mus musculus) 		PF13855
(LRR_8) 		5 SER A 528
ALA A 551
TYR A 547
LEU A 548
ILE A 511
 None
 1.40A 3qt0A-3t6qA:
undetectable		 3qt0A-3t6qA:
20.07
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.
3zzu ELONGATION FACTOR G

(Staphylococcus
aureus) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF03144
(GTP_EFTU_D2)
PF03764
(EFG_IV)
PF14492
(EFG_II) 		5 ARG A 130
ALA A 123
ILE A 131
MET A 270
LYS A  23
 None
 1.48A 3qt0A-3zzuA:
undetectable		 3qt0A-3zzuA:
17.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f9o HEXOKINASE-1

(Homo sapiens) 		PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2) 		5 CYH A 823
SER A 827
ALA A 830
ILE A 757
PHE A 786
 None
 1.04A 3qt0A-4f9oA:
undetectable		 3qt0A-4f9oA:
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.
4fhn NUCLEOPORIN NUP120

(Schizosaccharomyces
pombe) 		PF11715
(Nup160) 		5 ALA B 202
TYR B 129
LEU B 137
ILE B 165
MET B 175
 None
 1.35A 3qt0A-4fhnB:
undetectable		 3qt0A-4fhnB:
13.78
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.
4fmu HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD2

(Homo sapiens) 		PF00856
(SET) 		5 CYH A1580
ARG A1625
SER A1624
LEU A1475
HIS A1549
 None
0UM  A1804 (-4.9A)
None
None
None
 1.48A 3qt0A-4fmuA:
undetectable		 3qt0A-4fmuA:
21.75
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.
4fog THYMIDYLATE SYNTHASE

(Mycobacterium
tuberculosis) 		PF00303
(Thymidylat_synt) 		5 LEU A  59
ILE A 238
MET A 188
PHE A 150
HIS A 147
 None
None
None
None
UFP  A 301 (-4.0A)
 1.20A 3qt0A-4fogA:
undetectable		 3qt0A-4fogA:
24.75
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.
4nwo MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
MOGA

(Shewanella
oneidensis) 		PF00994
(MoCF_biosynth) 		5 ALA A  62
LEU A 123
ILE A 154
PHE A  99
MET A  96
 None
 1.36A 3qt0A-4nwoA:
undetectable		 3qt0A-4nwoA:
23.31
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.
4ztb PROTEASE NSP2

(Chikungunya
virus) 		PF01707
(Peptidase_C9) 		5 CYH A 285
ARG A 153
TYR A 172
LEU A 174
HIS A 217
 GOL  A 401 ( 4.5A)
None
None
None
None
 1.15A 3qt0A-4ztbA:
undetectable		 3qt0A-4ztbA:
20.35
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.
5c1b TRANSITIONAL
ENDOPLASMIC
RETICULUM ATPASE

(Homo sapiens) 		PF00004
(AAA)
PF02359
(CDC48_N)
PF02933
(CDC48_2)
PF09336
(Vps4_C) 		5 ALA A 622
LEU A 639
ILE A 601
PHE A 563
MET A 608
 None
None
CL  A 905 (-4.6A)
None
None
 1.46A 3qt0A-5c1bA:
undetectable		 3qt0A-5c1bA:
16.33
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.
5cqb DITRANS,POLYCIS-UNDE
CAPRENYL-DIPHOSPHATE
SYNTHASE
((2E,6E)-FARNESYL-DI
PHOSPHATE SPECIFIC)

(Escherichia
coli) 		PF01255
(Prenyltransf) 		5 SER A  55
ALA A  58
LEU A 139
ILE A  23
MET A  25
 None
 1.21A 3qt0A-5cqbA:
undetectable		 3qt0A-5cqbA:
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.
5kd5 METALLOPEPTIDASE

(Bacteroides
thetaiotaomicron) 		PF13402
(Peptidase_M60)
PF17291
(M60-like_N) 		5 SER A 696
ALA A 699
LEU A 652
ILE A 584
PHE A 712
 None
 1.27A 3qt0A-5kd5A:
undetectable		 3qt0A-5kd5A:
19.29
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.
5u8s CELL DIVISION
CONTROL PROTEIN 45

(Saccharomyces
cerevisiae) 		PF02724
(CDC45) 		5 LEU E 348
ILE E 404
PHE E 363
MET E 362
HIS E 360
 None
 1.34A 3qt0A-5u8sE:
undetectable		 3qt0A-5u8sE:
19.20
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.
6b8d ELONGATION FACTOR G

(Haemophilus
influenzae) 		no annotation 5 ARG A 137
ALA A 130
ILE A 138
MET A 278
LYS A  23
 None
 1.49A 3qt0A-6b8dA:
undetectable		 3qt0A-6b8dA:
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.
6bac ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE

(Neisseria
gonorrhoeae) 		no annotation 5 ARG A 268
SER A 165
ALA A 167
LEU A 175
ILE A 269
 SO4  A 403 (-4.1A)
None
SO4  A 403 ( 4.5A)
None
None
 1.24A 3qt0A-6bacA:
undetectable		 3qt0A-6bacA:
21.81
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.
6bk7 ELONGATION FACTOR G

(Enterococcus
faecalis) 		no annotation 5 ARG A 130
ALA A 123
ILE A 131
MET A 270
LYS A  23
 None
 1.31A 3qt0A-6bk7A:
undetectable		 3qt0A-6bk7A:
15.00
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.
1dt2 EXFOLIATIVE TOXIN B

(Staphylococcus
aureus) 		PF13365
(Trypsin_2) 		4 LYS A  14
GLN A 207
ILE A 212
LEU A 152
 None
 1.41A 3qt0A-1dt2A:
0.0		 3qt0A-1dt2A:
22.59
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.
1hm6 ANNEXIN 1

(Sus scrofa) 		PF00191
(Annexin) 		4 LYS A 185
GLN A 177
ILE A 260
LEU A 225
 None
 1.44A 3qt0A-1hm6A:
0.1		 3qt0A-1hm6A:
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.
1u2v ARP2/3 COMPLEX 16KDA
SUBUNIT

(Bos taurus) 		PF04699
(P16-Arc) 		4 LYS G  93
GLN G 127
ILE G 110
LEU G  59
 None
 1.36A 3qt0A-1u2vG:
undetectable		 3qt0A-1u2vG:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c3n GLUTATHIONE
S-TRANSFERASE THETA
1

(Homo sapiens) 		PF00043
(GST_C)
PF13417
(GST_N_3) 		4 LYS A 216
GLN A 208
ILE A  19
LEU A   7
 None
 1.17A 3qt0A-2c3nA:
0.9		 3qt0A-2c3nA:
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.
2li6 SWI/SNF
CHROMATIN-REMODELING
COMPLEX SUBUNIT SWI1

(Saccharomyces
cerevisiae) 		PF01388
(ARID) 		4 LYS A 110
GLN A 106
ILE A  28
LEU A  54
 None
 1.22A 3qt0A-2li6A:
undetectable		 3qt0A-2li6A:
19.33
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.
2pg6 CYTOCHROME P450 2A6

(Homo sapiens) 		PF00067
(p450) 		4 LYS A 250
GLN A 242
ILE A 208
LEU A 202
 None
 0.96A 3qt0A-2pg6A:
0.0		 3qt0A-2pg6A:
18.70
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.
2qjo BIFUNCTIONAL NMN
ADENYLYLTRANSFERASE/
NUDIX HYDROLASE

(Synechocystis
sp. PCC 6803) 		PF00293
(NUDIX)
PF01467
(CTP_transf_like) 		4 LYS A  98
GLN A  93
ILE A  11
LEU A  39
 None
 0.89A 3qt0A-2qjoA:
0.0		 3qt0A-2qjoA:
24.34
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.
2qty POLY(ADP-RIBOSE)
GLYCOHYDROLASE ARH3

(Mus musculus) 		PF03747
(ADP_ribosyl_GH) 		4 LYS A   1
GLN A 187
ILE A 309
LEU A 285
 None
 1.10A 3qt0A-2qtyA:
0.0		 3qt0A-2qtyA:
24.02
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.
2x3l ORN/LYS/ARG
DECARBOXYLASE FAMILY
PROTEIN

(Staphylococcus
aureus) 		PF01276
(OKR_DC_1)
PF03711
(OKR_DC_1_C) 		4 LYS A  68
GLN A  65
ILE A  59
LEU A  77
 None
 1.46A 3qt0A-2x3lA:
0.0		 3qt0A-2x3lA:
22.20
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.
2xa7 AP-2 COMPLEX SUBUNIT
BETA

(Homo sapiens) 		PF01602
(Adaptin_N) 		4 LYS B 318
GLN B 311
ILE B 564
LEU B 267
 None
 1.30A 3qt0A-2xa7B:
0.0		 3qt0A-2xa7B:
20.72
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.
3amj ZINC PEPTIDASE
ACTIVE SUBUNIT

(Sphingomonas
sp. A1) 		no annotation 4 LYS C 378
GLN C 417
ILE C 282
LEU C 294
 None
 1.31A 3qt0A-3amjC:
0.0		 3qt0A-3amjC:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ezh NITRATE/NITRITE
SENSOR PROTEIN NARX

(Escherichia
coli) 		PF13675
(PilJ) 		4 LYS A  49
GLN A 103
ILE A 111
LEU A  73
 None
 1.36A 3qt0A-3ezhA:
undetectable		 3qt0A-3ezhA:
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.
3ezi NITRATE/NITRITE
SENSOR PROTEIN NARX

(Escherichia
coli) 		PF13675
(PilJ) 		4 LYS A  49
GLN A 103
ILE A 111
LEU A  73
 None
 1.12A 3qt0A-3eziA:
undetectable		 3qt0A-3eziA:
18.99
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.
3h08 RNH (RIBONUCLEASE H)

(Chlorobaculum
tepidum) 		PF00075
(RNase_H) 		4 LYS A  84
GLN A 106
ILE A  53
LEU A  67
 None
 1.38A 3qt0A-3h08A:
undetectable		 3qt0A-3h08A:
18.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pqv RCL1 PROTEIN

(Kluyveromyces
lactis) 		PF01137
(RTC)
PF05189
(RTC_insert) 		4 LYS A 142
GLN A 291
ILE A 311
LEU A 182
 None
 1.12A 3qt0A-3pqvA:
undetectable		 3qt0A-3pqvA:
24.13
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.
3ugm TAL EFFECTOR
AVRBS3/PTHA

(Xanthomonas
oryzae) 		PF03377
(TAL_effector) 		4 LYS A 711
GLN A 746
ILE A 738
LEU A 721
 None
 1.48A 3qt0A-3ugmA:
undetectable		 3qt0A-3ugmA:
13.55
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.
3usw FLAGELLAR MOTOR
SWITCH PROTEIN

(Helicobacter
pylori) 		PF01706
(FliG_C)
PF14841
(FliG_M) 		4 LYS A 330
GLN A 325
ILE A 251
LEU A 263
 None
 1.35A 3qt0A-3uswA:
undetectable		 3qt0A-3uswA:
24.13
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.
3vi3 INTEGRIN ALPHA-5

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		4 LYS A 559
GLN A 599
ILE A 565
LEU A 520
 None
 1.21A 3qt0A-3vi3A:
undetectable		 3qt0A-3vi3A:
18.07
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.
4a3r ENOLASE

(Bacillus
subtilis) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		4 LYS A 357
GLN A 388
ILE A 377
LEU A 134
 None
 1.47A 3qt0A-4a3rA:
undetectable		 3qt0A-4a3rA:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aur LEOA

(Escherichia
coli) 		PF00350
(Dynamin_N) 		4 LYS A 203
GLN A 219
ILE A 260
LEU A 253
 None
 1.45A 3qt0A-4aurA:
undetectable		 3qt0A-4aurA:
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.
4e8d GLYCOSYL HYDROLASE,
FAMILY 35

(Streptococcus
pneumoniae) 		PF01301
(Glyco_hydro_35) 		4 LYS A 436
GLN A 417
ILE A 431
LEU A 479
 None
 1.30A 3qt0A-4e8dA:
undetectable		 3qt0A-4e8dA:
18.70
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.
4h41 PUTATIVE
ALPHA-L-FUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF14488
(DUF4434)
PF17134
(DUF5109) 		4 LYS A 229
GLN A 269
ILE A  72
LEU A 312
 None
UNL  A 401 ( 3.7A)
None
None
 1.31A 3qt0A-4h41A:
undetectable		 3qt0A-4h41A:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hsu LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1B

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM)
PF07496
(zf-CW) 		4 LYS A 690
GLN A 534
ILE A 468
LEU A 737
 None
 1.30A 3qt0A-4hsuA:
undetectable		 3qt0A-4hsuA:
18.55
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.
4mzd NISIN LEADER
PEPTIDE-PROCESSING
SERINE PROTEASE NISP

(Lactococcus
lactis) 		PF00082
(Peptidase_S8) 		4 LYS A 341
GLN A 382
ILE A 370
LEU A 422
 None
 1.20A 3qt0A-4mzdA:
undetectable		 3qt0A-4mzdA:
20.65
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.
4oon PENICILLIN-BINDING
PROTEIN 1A

(Pseudomonas
aeruginosa) 		PF00905
(Transpeptidase)
PF00912
(Transgly)
PF17092
(PCB_OB) 		4 LYS A 695
GLN A 673
ILE A 667
LEU A 513
 2U4  A 901 ( 4.3A)
None
None
None
 1.39A 3qt0A-4oonA:
undetectable		 3qt0A-4oonA:
16.31
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.
4rnz CONSERVED
HYPOTHETICAL
SECRETED PROTEIN

(Helicobacter
pylori) 		PF01551
(Peptidase_M23) 		4 LYS A 163
GLN A 157
ILE A 351
LEU A 231
 None
 1.42A 3qt0A-4rnzA:
undetectable		 3qt0A-4rnzA:
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.
5cxc RIBOSOME BIOGENESIS
PROTEIN ERB1

(Chaetomium
thermophilum) 		PF00400
(WD40) 		4 LYS B 696
GLN B 743
ILE B 779
LEU B 777
 None
 1.49A 3qt0A-5cxcB:
undetectable		 3qt0A-5cxcB:
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.
5f05 PHI CLASS
GLUTATHIONE
TRANSFERASE GSTF5

(Populus
trichocarpa) 		PF00043
(GST_C)
PF02798
(GST_N) 		4 LYS A  82
GLN A  78
ILE A  71
LEU A  19
 None
 1.44A 3qt0A-5f05A:
undetectable		 3qt0A-5f05A:
22.59
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.
5l7z MATERNAL PROTEIN
EXUPERANTIA

(Drosophila
melanogaster) 		no annotation 4 LYS A 106
GLN A  53
ILE A 148
LEU A 116
 None
 1.25A 3qt0A-5l7zA:
undetectable		 3qt0A-5l7zA:
23.74
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.
5l7z MATERNAL PROTEIN
EXUPERANTIA

(Drosophila
melanogaster) 		no annotation 4 LYS A 106
GLN A  53
ILE A 148
LEU A 157
 None
 1.20A 3qt0A-5l7zA:
undetectable		 3qt0A-5l7zA:
23.74
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.
5l80 MATERNAL PROTEIN
EXUPERANTIA,MATERNAL
PROTEIN EXUPERANTIA

(Drosophila
melanogaster) 		no annotation 4 LYS A 106
GLN A  53
ILE A 148
LEU A 116
 None
 1.22A 3qt0A-5l80A:
undetectable		 3qt0A-5l80A:
24.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l80 MATERNAL PROTEIN
EXUPERANTIA,MATERNAL
PROTEIN EXUPERANTIA

(Drosophila
melanogaster) 		no annotation 4 LYS A 106
GLN A  53
ILE A 148
LEU A 157
 None
 1.28A 3qt0A-5l80A:
undetectable		 3qt0A-5l80A:
24.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lta PRE-MRNA-SPLICING
FACTOR ATP-DEPENDENT
RNA HELICASE PRP43

(Chaetomium
thermophilum) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF04408
(HA2)
PF07717
(OB_NTP_bind) 		4 LYS A 100
GLN A 128
ILE A 247
LEU A 267
 None
 1.37A 3qt0A-5ltaA:
undetectable		 3qt0A-5ltaA:
18.70
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.
5ovn POL PROTEIN

(Feline
immunodeficiency
virus) 		no annotation 4 LYS B 216
GLN B 104
ILE B 179
LEU B 208
 None
 1.35A 3qt0A-5ovnB:
undetectable		 3qt0A-5ovnB:
13.86
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.
5u03 CTP SYNTHASE 1

(Homo sapiens) 		PF00117
(GATase)
PF06418
(CTP_synth_N) 		4 LYS A 284
GLN A 277
ILE A 274
LEU A  27
 None
 1.41A 3qt0A-5u03A:
undetectable		 3qt0A-5u03A:
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.
5vxl INVASIN IPAD
SINGLE-DOMAIN
ANTIBODY JPS-G3

(Shigella
flexneri;
Vicugna pacos) 		PF06511
(IpaD)
no annotation 		4 LYS A 291
GLN A 165
ILE B  30
LEU A 174
 None
 1.08A 3qt0A-5vxlA:
undetectable		 3qt0A-5vxlA:
23.03
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.
6b3e CYCLIN-DEPENDENT
KINASE 12

(Homo sapiens) 		no annotation 4 LYS A 861
GLN A 937
ILE A 948
LEU A 906
 None
 1.21A 3qt0A-6b3eA:
undetectable		 3qt0A-6b3eA:
14.81
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.
6dfp VCA0883

(Vibrio cholerae) 		no annotation 4 LYS A 191
GLN A  13
ILE A  76
LEU A 140
 None
 1.20A 3qt0A-6dfpA:
2.4		 3qt0A-6dfpA:
15.79