SIMILAR PATTERNS OF AMINO ACIDS FOR 4AGA_A_ACTA1131

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.
1dbv GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Geobacillus
stearothermophilus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
3 ASN O 236
ASP O 312
ASN O 313
None
None
NAD  O 336 (-4.2A)
0.72A 4agaA-1dbvO:
undetectable
4agaA-1dbvO:
17.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1di4 LYSOZYME C

(Homo sapiens)
PF00062
(Lys)
3 ASN A  46
ASP A  53
ASN A  60
None
0.68A 4agaA-1di4A:
25.2
4agaA-1di4A:
60.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1gd6 LYSOZYME

(Bombyx mori)
PF00062
(Lys)
3 ASN A  43
ASP A  49
ASN A  56
None
0.45A 4agaA-1gd6A:
20.0
4agaA-1gd6A:
41.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1iiz LYSOZYME

(Antheraea
mylitta)
PF00062
(Lys)
3 ASN A  44
ASP A  50
ASN A  57
None
0.44A 4agaA-1iizA:
19.5
4agaA-1iizA:
39.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jug LYSOZYME

(Tachyglossus
aculeatus)
PF00062
(Lys)
3 ASN A  46
ASP A  52
ASN A  59
None
0.37A 4agaA-1jugA:
23.2
4agaA-1jugA:
52.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1lmo LYSOZYME

(Oncorhynchus
mykiss)
PF00062
(Lys)
3 ASN A  46
ASP A  52
ASN A  59
None
NAG  A 131 ( 4.5A)
NAG  A 131 (-4.1A)
0.36A 4agaA-1lmoA:
26.1
4agaA-1lmoA:
60.47
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.
1m54 CYSTATHIONINE
BETA-SYNTHASE


(Homo sapiens)
PF00291
(PALP)
3 ASN A 149
ASP A 376
ASN A 380
PLP  A1110 (-3.6A)
PLP  A1110 (-3.2A)
None
0.76A 4agaA-1m54A:
undetectable
4agaA-1m54A:
16.67
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.
1mio NITROGENASE
MOLYBDENUM IRON
PROTEIN (BETA CHAIN)


(Clostridium
pasteurianum)
PF00148
(Oxidored_nitro)
3 ASN B 234
ASP B 231
ASN B 169
None
0.75A 4agaA-1mioB:
undetectable
4agaA-1mioB:
14.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1obf GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Achromobacter
xylosoxidans)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
3 ASN O 240
ASP O 315
ASN O 316
None
0.70A 4agaA-1obfO:
undetectable
4agaA-1obfO:
16.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1q5a EP-CADHERIN

(Mus musculus)
PF00028
(Cadherin)
3 ASN A 434
ASP A 515
ASN A 518
CA  A 914 (-2.5A)
CA  A 914 (-3.1A)
None
0.70A 4agaA-1q5aA:
undetectable
4agaA-1q5aA:
9.44
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.
1u2x ADP-SPECIFIC
PHOSPHOFRUCTOKINASE


(Pyrococcus
horikoshii)
PF04587
(ADP_PFK_GK)
3 ASN A  37
ASP A  39
ASN A 182
SO4  A1003 ( 4.6A)
None
None
0.68A 4agaA-1u2xA:
undetectable
4agaA-1u2xA:
12.82
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.
1ud3 AMYLASE

(Bacillus sp.
KSM-K38)
PF00128
(Alpha-amylase)
PF09154
(DUF1939)
3 ASN A 161
ASP A 194
ASN A 183
None
NA  A1001 (-3.3A)
None
0.75A 4agaA-1ud3A:
undetectable
4agaA-1ud3A:
15.91
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.
1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT


(Pseudomonas
putida)
PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C)
3 ASN A 506
ASP A 516
ASN A 518
None
0.62A 4agaA-1wveA:
undetectable
4agaA-1wveA:
12.43
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.
1xd6 GASTRODIANIN-4

(Gastrodia elata)
PF01453
(B_lectin)
3 ASN A  77
ASP A  59
ASN A  61
None
0.81A 4agaA-1xd6A:
undetectable
4agaA-1xd6A:
24.64
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.
1yiq QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE


(Pseudomonas
putida)
PF01011
(PQQ)
PF13360
(PQQ_2)
PF13442
(Cytochrome_CBB3)
3 ASN A 247
ASP A 283
ASN A 167
None
0.42A 4agaA-1yiqA:
undetectable
4agaA-1yiqA:
11.13
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.
1z6u NP95-LIKE RING
FINGER PROTEIN
ISOFORM B


(Homo sapiens)
PF00097
(zf-C3HC4)
3 ASN A 784
ASP A 703
ASN A 706
None
0.65A 4agaA-1z6uA:
undetectable
4agaA-1z6uA:
18.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2gv0 LYSOZYME C

(Pelodiscus
sinensis)
PF00062
(Lys)
3 ASN A  47
ASP A  54
ASN A  61
None
0.34A 4agaA-2gv0A:
25.6
4agaA-2gv0A:
68.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2h5z LYSOZYME 1

(Musca domestica)
PF00062
(Lys)
3 ASN A  44
ASP A  50
ASN A  57
None
0.43A 4agaA-2h5zA:
19.9
4agaA-2h5zA:
39.69
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.
2i1y RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE


(Homo sapiens)
PF00102
(Y_phosphatase)
3 ASN A 895
ASP A 923
ASN A 927
None
0.74A 4agaA-2i1yA:
undetectable
4agaA-2i1yA:
18.09
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.
2j3z C2 TOXIN COMPONENT I

(Clostridium
botulinum)
PF03496
(ADPrib_exo_Tox)
3 ASN A 271
ASP A 273
ASN A 276
None
0.68A 4agaA-2j3zA:
undetectable
4agaA-2j3zA:
15.01
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.
2nz9 BOTULINUM NEUROTOXIN
TYPE A


(Clostridium
botulinum)
PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N)
3 ASN A1238
ASP A1246
ASN A1268
None
0.74A 4agaA-2nz9A:
undetectable
4agaA-2nz9A:
6.58
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.
2pkq GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
B


(Spinacia
oleracea)
PF00044
(Gp_dh_N)
PF02672
(CP12)
PF02800
(Gp_dh_C)
3 ASN O 236
ASP O 312
ASN O 313
None
None
NDP  O 363 (-4.2A)
0.64A 4agaA-2pkqO:
undetectable
4agaA-2pkqO:
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.
2pt6 SPERMIDINE SYNTHASE

(Plasmodium
falciparum)
PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N)
3 ASN A 142
ASP A 144
ASN A 173
None
0.62A 4agaA-2pt6A:
undetectable
4agaA-2pt6A:
17.21
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.
2qu7 PUTATIVE
TRANSCRIPTIONAL
REGULATOR


(Staphylococcus
saprophyticus)
PF13407
(Peripla_BP_4)
3 ASN A  75
ASP A 279
ASN A 251
None
0.70A 4agaA-2qu7A:
undetectable
4agaA-2qu7A:
18.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rhp THROMBOSPONDIN-2

(Homo sapiens)
PF02412
(TSP_3)
PF05735
(TSP_C)
PF07645
(EGF_CA)
PF12947
(EGF_3)
3 ASN A 784
ASP A 777
ASN A 778
CA  A  21 (-3.1A)
CA  A  21 ( 2.4A)
None
0.79A 4agaA-2rhpA:
undetectable
4agaA-2rhpA:
13.87
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.
2rhp THROMBOSPONDIN-2

(Homo sapiens)
PF02412
(TSP_3)
PF05735
(TSP_C)
PF07645
(EGF_CA)
PF12947
(EGF_3)
3 ASN A 881
ASP A 874
ASN A 875
CA  A   9 (-3.3A)
CA  A   9 ( 2.3A)
None
0.80A 4agaA-2rhpA:
undetectable
4agaA-2rhpA:
13.87
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.
2sxl SEX-LETHAL PROTEIN

(Drosophila
melanogaster)
PF00076
(RRM_1)
3 ASN A  31
ASP A  51
ASN A   3
None
0.71A 4agaA-2sxlA:
undetectable
4agaA-2sxlA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wan PULLULANASE

(Bacillus
acidopullulyticus)
PF00128
(Alpha-amylase)
PF02922
(CBM_48)
3 ASN A 287
ASP A 289
ASN A 299
None
0.78A 4agaA-2wanA:
undetectable
4agaA-2wanA:
9.74
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.
2wtb FATTY ACID
MULTIFUNCTIONAL
PROTEIN (ATMFP2)


(Arabidopsis
thaliana)
PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N)
3 ASN A 492
ASP A 431
ASN A 433
None
0.63A 4agaA-2wtbA:
undetectable
4agaA-2wtbA:
10.00
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.
2xf8 D-ERYTHROSE-4-PHOSPH
ATE DEHYDROGENASE


(Escherichia
coli)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
3 ASN A 236
ASP A 312
ASN A 313
None
0.69A 4agaA-2xf8A:
undetectable
4agaA-2xf8A:
17.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z4t BETA-GALACTOSIDE
ALPHA-2,6-SIALYLTRAN
SFERASE


(Photobacterium
sp. JT-ISH-224)
PF11477
(PM0188)
3 ASN A 226
ASP A 228
ASN A 289
GOL  A3002 (-4.3A)
None
GOL  A3002 (-3.3A)
0.79A 4agaA-2z4tA:
undetectable
4agaA-2z4tA:
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.
3aqi FERROCHELATASE

(Homo sapiens)
PF00762
(Ferrochelatase)
3 ASN A 408
ASP A  97
ASN A 204
None
0.77A 4agaA-3aqiA:
undetectable
4agaA-3aqiA:
15.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3cb7 LYS-RICH LYSOZYME 2

(Musca domestica)
PF00062
(Lys)
3 ASN A  48
ASP A  54
ASN A  61
ASN  A  48 ( 0.6A)
ASP  A  54 (-0.5A)
ASN  A  61 (-0.6A)
0.39A 4agaA-3cb7A:
19.0
4agaA-3cb7A:
37.21
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.
3ctp PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR


(Alkaliphilus
metalliredigens)
PF13377
(Peripla_BP_3)
3 ASN A 239
ASP A 213
ASN A  72
XLF  A 401 (-3.8A)
XLF  A 401 ( 4.3A)
XLF  A 401 (-3.0A)
0.75A 4agaA-3ctpA:
undetectable
4agaA-3ctpA:
17.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3doc GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Brucella
abortus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
3 ASN A 239
ASP A 315
ASN A 316
None
None
NAD  A 901 (-3.9A)
0.72A 4agaA-3docA:
undetectable
4agaA-3docA:
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.
3e38 TWO-DOMAIN PROTEIN
CONTAINING PREDICTED
PHP-LIKE
METAL-DEPENDENT
PHOSPHOESTERASE


(Bacteroides
vulgatus)
PF16392
(DUF5001)
3 ASN A  91
ASP A 130
ASN A 132
None
None
GOL  A   9 ( 4.9A)
0.67A 4agaA-3e38A:
undetectable
4agaA-3e38A:
15.45
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.
3e38 TWO-DOMAIN PROTEIN
CONTAINING PREDICTED
PHP-LIKE
METAL-DEPENDENT
PHOSPHOESTERASE


(Bacteroides
vulgatus)
PF16392
(DUF5001)
3 ASN A 132
ASP A  89
ASN A  91
GOL  A   9 ( 4.9A)
None
None
0.72A 4agaA-3e38A:
undetectable
4agaA-3e38A:
15.45
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.
3fby CARTILAGE OLIGOMERIC
MATRIX PROTEIN


(Homo sapiens)
PF02412
(TSP_3)
PF05735
(TSP_C)
3 ASN A 415
ASP A 408
ASN A 409
CA  A 814 (-3.2A)
CA  A 814 ( 2.5A)
None
0.71A 4agaA-3fbyA:
undetectable
4agaA-3fbyA:
11.28
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.
3fby CARTILAGE OLIGOMERIC
MATRIX PROTEIN


(Homo sapiens)
PF02412
(TSP_3)
PF05735
(TSP_C)
3 ASN A 489
ASP A 482
ASN A 483
CA  A 823 (-3.1A)
CA  A 823 ( 2.8A)
None
0.73A 4agaA-3fbyA:
undetectable
4agaA-3fbyA:
11.28
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.
3fl2 E3 UBIQUITIN-PROTEIN
LIGASE UHRF1


(Homo sapiens)
no annotation 3 ASN A 775
ASP A 687
ASN A 690
None
0.65A 4agaA-3fl2A:
undetectable
4agaA-3fl2A:
15.67
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.
3gnq GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE, TYPE
I


(Burkholderia
pseudomallei)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
3 ASN A 240
ASP A 315
ASN A 316
None
0.72A 4agaA-3gnqA:
undetectable
4agaA-3gnqA:
15.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i1c DIISOPROPYL-FLUOROPH
OSPHATASE


(Loligo vulgaris)
PF08450
(SGL)
3 ASN A  83
ASP A  26
ASN A  28
None
0.68A 4agaA-3i1cA:
undetectable
4agaA-3i1cA:
17.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i2n WD REPEAT-CONTAINING
PROTEIN 92


(Homo sapiens)
PF00400
(WD40)
3 ASN A 189
ASP A 191
ASN A 207
None
0.52A 4agaA-3i2nA:
undetectable
4agaA-3i2nA:
15.01
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.
3k2b GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
A, CHLOROPLASTIC


(Arabidopsis
thaliana)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
3 ASN A 236
ASP A 312
ASN A 313
None
None
NAD  A 335 (-3.9A)
0.76A 4agaA-3k2bA:
undetectable
4agaA-3k2bA:
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.
3l0d GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Bartonella
henselae)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
3 ASN A 239
ASP A 315
ASN A 316
None
None
NAD  A 336 (-3.9A)
0.71A 4agaA-3l0dA:
undetectable
4agaA-3l0dA:
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.
3pc3 CG1753, ISOFORM A

(Drosophila
melanogaster)
PF00291
(PALP)
PF00571
(CBS)
3 ASN A 118
ASP A 345
ASN A 349
P1T  A 702 (-3.8A)
P1T  A 702 (-3.3A)
None
0.71A 4agaA-3pc3A:
undetectable
4agaA-3pc3A:
14.09
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.
3q2v CADHERIN-1

(Mus musculus)
PF00028
(Cadherin)
3 ASN A 435
ASP A 517
ASN A 518
CA  A 612 (-2.8A)
CA  A 612 (-3.2A)
None
0.64A 4agaA-3q2vA:
undetectable
4agaA-3q2vA:
12.32
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.
3rhg PUTATIVE
PHOPHOTRIESTERASE


(Proteus
mirabilis)
PF02126
(PTE)
3 ASN A 191
ASP A 147
ASN A 151
None
0.57A 4agaA-3rhgA:
undetectable
4agaA-3rhgA:
14.60
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.
3u1w HYPOTHETICAL
PERIPLASMIC PROTEIN


(Parabacteroides
distasonis)
PF11396
(PepSY_like)
3 ASN A 177
ASP A 196
ASN A 197
None
0.49A 4agaA-3u1wA:
undetectable
4agaA-3u1wA:
18.50
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.
3uy4 PANTOTHENATE
SYNTHETASE


(Campylobacter
jejuni)
PF02569
(Pantoate_ligase)
3 ASN A 258
ASP A 245
ASN A 247
None
0.58A 4agaA-3uy4A:
undetectable
4agaA-3uy4A:
17.14
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.
3vv3 DESEASIN MCP-01

(Pseudoalteromonas
sp. SM9913)
PF00082
(Peptidase_S8)
3 ASN A  80
ASP A  85
ASN A  66
CA  A 401 (-3.1A)
CA  A 401 (-3.0A)
None
0.71A 4agaA-3vv3A:
undetectable
4agaA-3vv3A:
15.89
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.
3zdf GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Thermosynechococcus
elongatus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
3 ASN A 240
ASP A 316
ASN A 317
None
None
NAD  A1001 (-3.7A)
0.79A 4agaA-3zdfA:
undetectable
4agaA-3zdfA:
18.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zvq LYSOZYME C

(Gallus gallus)
PF00062
(Lys)
3 ASN A  46
ASP A  52
ASN A  59
None
0.31A 4agaA-3zvqA:
10.6
4agaA-3zvqA:
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.
4aay AROB

(Rhizobium sp.
NT-26)
PF00355
(Rieske)
3 ASN B 155
ASP B 157
ASN B  56
None
0.75A 4agaA-4aayB:
undetectable
4agaA-4aayB:
21.14
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.
4cak INTEGRIN BETA-3

(Homo sapiens)
PF00362
(Integrin_beta)
PF07965
(Integrin_B_tail)
PF07974
(EGF_2)
PF17205
(PSI_integrin)
3 ASN B   3
ASP B  39
ASN B  43
None
0.78A 4agaA-4cakB:
undetectable
4agaA-4cakB:
10.08
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.
4dib GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Bacillus
anthracis)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
3 ASN A 237
ASP A 313
ASN A 314
None
0.72A 4agaA-4dibA:
undetectable
4agaA-4dibA:
16.46
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.
4eg9 UNCHARACTERIZED
PROTEIN
SAOUHSC_02783


(Staphylococcus
aureus)
PF04507
(DUF576)
3 ASN A  41
ASP A 167
ASN A 169
None
0.68A 4agaA-4eg9A:
undetectable
4agaA-4eg9A:
17.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ej6 PUTATIVE
ZINC-BINDING
DEHYDROGENASE


(Sinorhizobium
meliloti)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
3 ASN A 289
ASP A  83
ASN A  85
None
EDO  A 401 (-3.8A)
None
0.64A 4agaA-4ej6A:
undetectable
4agaA-4ej6A:
17.26
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.
4igb LPXTG CELL WALL
SURFACE PROTEIN


(Streptococcus
gordonii)
no annotation 3 ASN D 293
ASP D 198
ASN D 135
None
0.52A 4agaA-4igbD:
undetectable
4agaA-4igbD:
12.32
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.
4kyz DESIGNED PROTEIN
OR327


(synthetic
construct)
no annotation 3 ASN A  16
ASP A  18
ASN A   9
None
0.79A 4agaA-4kyzA:
undetectable
4agaA-4kyzA:
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.
4l27 CYSTATHIONINE
BETA-SYNTHASE


(Homo sapiens)
no annotation 3 ASN B 149
ASP B 376
ASN B 380
PLP  B 601 (-3.5A)
PLP  B 601 (-3.1A)
None
0.80A 4agaA-4l27B:
undetectable
4agaA-4l27B:
14.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lsm GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE,
CYTOSOLIC


(Trypanosoma
cruzi)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
3 ASN A 243
ASP A 319
ASN A 320
None
None
NAD  A 401 (-3.7A)
0.74A 4agaA-4lsmA:
undetectable
4agaA-4lsmA:
20.25
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.
4lvo SUBTILISIN-LIKE
SERINE PROTEASE


(Plasmodium
falciparum)
PF00082
(Peptidase_S8)
3 ASN A 404
ASP A 409
ASN A 389
CA  A 703 (-2.8A)
CA  A 703 (-2.8A)
None
0.80A 4agaA-4lvoA:
undetectable
4agaA-4lvoA:
15.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4m7s BTRN

(Bacillus
circulans)
PF13186
(SPASM)
3 ASN A  17
ASP A  94
ASN A  92
None
None
SF4  A 502 (-4.5A)
0.76A 4agaA-4m7sA:
undetectable
4agaA-4m7sA:
14.18
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.
4n78 CYTOPLASMIC
FMR1-INTERACTING
PROTEIN 1


(Homo sapiens)
PF05994
(FragX_IP)
PF07159
(DUF1394)
3 ASN A 176
ASP A 172
ASN A 218
None
0.80A 4agaA-4n78A:
undetectable
4agaA-4n78A:
7.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o59 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Bos taurus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
3 ASN O 236
ASP O 312
ASN O 313
None
None
NAD  O 401 (-3.8A)
0.75A 4agaA-4o59O:
undetectable
4agaA-4o59O:
18.27
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.
4p8r GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE,
CYTOSOLIC


(Trypanosoma
brucei)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
3 ASN A 237
ASP A 313
ASN A 314
None
None
NAD  A 400 (-3.7A)
0.74A 4agaA-4p8rA:
undetectable
4agaA-4p8rA:
17.11
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.
4qn9 N-ACYL-PHOSPHATIDYLE
THANOLAMINE-HYDROLYZ
ING PHOSPHOLIPASE D


(Homo sapiens)
PF12706
(Lactamase_B_2)
3 ASN A 388
ASP A 302
ASN A 277
None
0.80A 4agaA-4qn9A:
undetectable
4agaA-4qn9A:
17.03
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.
4r12 PUTATIVE
UNCHARACTERIZED
PROTEIN


(Dictyostelium
purpureum)
PF05450
(Nicastrin)
3 ASN A 427
ASP A 435
ASN A 439
None
0.44A 4agaA-4r12A:
undetectable
4agaA-4r12A:
12.82
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.
4tr2 SUBTILISIN-LIKE 1
SERINE PROTEASE


(Plasmodium
vivax)
PF00082
(Peptidase_S8)
3 ASN A 333
ASP A 346
ASN A 348
CA  A 803 ( 4.9A)
CA  A 803 (-3.2A)
CA  A 803 (-2.8A)
0.79A 4agaA-4tr2A:
undetectable
4agaA-4tr2A:
11.95
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.
4tr2 SUBTILISIN-LIKE 1
SERINE PROTEASE


(Plasmodium
vivax)
PF00082
(Peptidase_S8)
3 ASN A 348
ASP A 353
ASN A 333
CA  A 803 (-2.8A)
CA  A 803 (-3.1A)
CA  A 803 ( 4.9A)
0.65A 4agaA-4tr2A:
undetectable
4agaA-4tr2A:
11.95
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.
4txw HYALURONOGLUCOSAMINI
DASE


(Clostridium
perfringens)
PF00754
(F5_F8_type_C)
3 ASN A 100
ASP A  92
ASN A  88
None
None
CA  A 202 (-3.2A)
0.79A 4agaA-4txwA:
undetectable
4agaA-4txwA:
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.
4u1r ATP-DEPENDENT
6-PHOSPHOFRUCTOKINAS
E, PLATELET TYPE


(Homo sapiens)
PF00365
(PFK)
3 ASN A 259
ASP A 235
ASN A 267
None
PO4  A 802 ( 4.6A)
None
0.66A 4agaA-4u1rA:
undetectable
4agaA-4u1rA:
10.26
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.
4uoe SPERMIDINE SYNTHASE

(Plasmodium
falciparum)
PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N)
3 ASN A 142
ASP A 144
ASN A 173
None
0.64A 4agaA-4uoeA:
undetectable
4agaA-4uoeA:
17.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4wg1 LYSOZYME C

(Gallus gallus)
PF00062
(Lys)
3 ASN A  46
ASP A  52
ASN A  59
None
0.19A 4agaA-4wg1A:
28.3
4agaA-4wg1A:
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.
4xed PEPTIDASE M14,
CARBOXYPEPTIDASE A


(Thermoplasmatales
archaeon SCGC
AB-540-F20)
PF00801
(PKD)
3 ASN A   1
ASP A  33
ASN A  31
CA  A 101 (-2.9A)
CA  A 101 (-3.3A)
CA  A 101 (-3.5A)
0.80A 4agaA-4xedA:
undetectable
4agaA-4xedA:
22.14
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.
4zw0 3-HYDROXYACYL-[ACYL-
CARRIER-PROTEIN]
DEHYDRATASE FABZ


(Candidatus
Liberibacter
asiaticus)
PF07977
(FabA)
3 ASN A  84
ASP A  37
ASN A 121
None
0.78A 4agaA-4zw0A:
undetectable
4agaA-4zw0A:
19.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5anb EUKARYOTIC
TRANSLATION
INITIATION FACTOR 6


(Dictyostelium
discoideum)
PF01912
(eIF-6)
3 ASN I 156
ASP I 112
ASN I  21
None
0.77A 4agaA-5anbI:
undetectable
4agaA-5anbI:
21.05
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.
5c7i GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
TESTIS-SPECIFIC


(Mus musculus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
3 ASN O 343
ASP O 419
ASN O 420
None
0.75A 4agaA-5c7iO:
undetectable
4agaA-5c7iO:
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.
5fn4 NICASTRIN

(Homo sapiens)
PF05450
(Nicastrin)
3 ASN A 450
ASP A 458
ASN A 462
None
0.52A 4agaA-5fn4A:
undetectable
4agaA-5fn4A:
11.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fq6 SUSC/RAGA FAMILY
TONB-LINKED OUTER
MEMBRANE PROTEIN


(Bacteroides
thetaiotaomicron)
PF00593
(TonB_dep_Rec)
PF07715
(Plug)
3 ASN B  84
ASP B  59
ASN B 131
None
0.78A 4agaA-5fq6B:
undetectable
4agaA-5fq6B:
9.36
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.
5fq6 SUSC/RAGA FAMILY
TONB-LINKED OUTER
MEMBRANE PROTEIN


(Bacteroides
thetaiotaomicron)
PF00593
(TonB_dep_Rec)
PF07715
(Plug)
3 ASN B 458
ASP B 460
ASN B 481
None
0.67A 4agaA-5fq6B:
undetectable
4agaA-5fq6B:
9.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5jen LYSOZYME C

(Gallus gallus)
PF00062
(Lys)
3 ASN B  46
ASP B  52
ASN B  59
None
NA  A 401 (-3.1A)
None
0.55A 4agaA-5jenB:
26.6
4agaA-5jenB:
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.
5k59 UNCHARACTERIZED
LEUKOCIDIN-LIKE
PROTEIN 2


(Staphylococcus
aureus)
no annotation 3 ASN D 196
ASP D 197
ASN D 206
None
0.80A 4agaA-5k59D:
undetectable
4agaA-5k59D:
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.
5kkg ANCMT E72A

(synthetic
construct)
PF04587
(ADP_PFK_GK)
3 ASN A  16
ASP A  18
ASN A 161
None
0.79A 4agaA-5kkgA:
undetectable
4agaA-5kkgA:
14.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m11 IMMUNOREACTIVE 84KD
ANTIGEN PG93


(Porphyromonas
gingivalis)
no annotation 3 ASN A 617
ASP A 557
ASN A 559
PG4  A 815 ( 4.8A)
None
None
0.77A 4agaA-5m11A:
undetectable
4agaA-5m11A:
9.90
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.
5m5p PRE-MRNA-SPLICING
HELICASE BRR2


(Saccharomyces
cerevisiae)
PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63)
3 ASN A1713
ASP A1678
ASN A1579
None
0.80A 4agaA-5m5pA:
undetectable
4agaA-5m5pA:
5.49
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.
5moy BOTULINUM NEUROTOXIN
TYPE A


(Clostridium
botulinum)
PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N)
3 ASN A1238
ASP A1246
ASN A1268
None
0.61A 4agaA-5moyA:
undetectable
4agaA-5moyA:
15.46
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.
5mpd 26S PROTEASOME
REGULATORY SUBUNIT
RPN3
26S PROTEASOME
REGULATORY SUBUNIT
RPN8


(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae)
PF01399
(PCI)
PF08375
(Rpn3_C)
PF01398
(JAB)
PF13012
(MitMem_reg)
3 ASN U 294
ASP U 290
ASN S 490
None
0.62A 4agaA-5mpdU:
undetectable
4agaA-5mpdU:
14.97
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.
5n6r BREAKPOINT CLUSTER
REGION PROTEIN


(Homo sapiens)
no annotation 3 ASN A 637
ASP A 629
ASN A 627
None
0.70A 4agaA-5n6rA:
undetectable
4agaA-5n6rA:
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.
5tpc BOTULINUM NEUROTOXIN
TYPE A


(Clostridium
botulinum)
PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N)
3 ASN A1238
ASP A1246
ASN A1268
None
0.75A 4agaA-5tpcA:
undetectable
4agaA-5tpcA:
15.06
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.
5tro PENICILLIN-BINDING
PROTEIN 1


(Staphylococcus
aureus)
PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
3 ASN A  72
ASP A 245
ASN A 247
None
0.71A 4agaA-5troA:
undetectable
4agaA-5troA:
13.36
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.
5uz8 CADHERIN-23

(Mus musculus)
no annotation 3 ASN A2373
ASP A2456
ASN A2457
CA  A2608 (-3.1A)
CA  A2608 (-3.2A)
None
0.76A 4agaA-5uz8A:
undetectable
4agaA-5uz8A:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5v8g LYSOZYME ISOFORM I

(Anas
platyrhynchos)
no annotation 3 ASN A  46
ASP A  52
ASN A  59
None
0.27A 4agaA-5v8gA:
27.0
4agaA-5v8gA:
84.25
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.
5x8z PENICILLIN V
ACYLASE-LIKE PROTEIN


(Shewanella
loihica)
no annotation 3 ASN A 285
ASP A 287
ASN A 302
None
0.68A 4agaA-5x8zA:
undetectable
4agaA-5x8zA:
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.
5y28 -

(-)
no annotation 3 ASN A 256
ASP A 165
ASN A 167
None
0.64A 4agaA-5y28A:
undetectable
4agaA-5y28A:
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.
6c8z ADP-DEPENDENT
PHOSPHOFRUCTOKINASE


(Methanosarcinales)
no annotation 3 ASN A  34
ASP A  36
ASN A 181
None
0.79A 4agaA-6c8zA:
undetectable
4agaA-6c8zA:
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.
6chs PUTATIVE CELL
DIVISION CONTROL
PROTEIN


(Chaetomium
thermophilum)
no annotation 3 ASN H 367
ASP H 578
ASN H 575
None
0.74A 4agaA-6chsH:
undetectable
4agaA-6chsH:
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.
6fay ODZ3 PROTEIN

(Mus musculus)
no annotation 3 ASN A1371
ASP A1308
ASN A1310
None
0.73A 4agaA-6fayA:
undetectable
4agaA-6fayA:
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.
6fpe TRNA N6-ADENOSINE
THREONYLCARBAMOYLTRA
NSFERASE


(Thermotoga
maritima)
no annotation 3 ASN B  27
ASP B 296
ASN B 297
None
0.81A 4agaA-6fpeB:
undetectable
4agaA-6fpeB:
undetectable