SIMILAR PATTERNS OF AMINO ACIDS FOR 4R3A_B_RBFB402

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.
1jnu PHY3 PROTEIN

(Adiantum
capillus-veneris)
PF13426
(PAS_9)
5 ASN A 965
LEU A 969
GLN A 970
VAL A 979
PHE A1025
FMN  A1033 (-3.2A)
FMN  A1033 (-4.1A)
FMN  A1033 (-3.1A)
FMN  A1033 ( 4.9A)
FMN  A1033 ( 4.6A)
0.76A 4r3aB-1jnuA:
15.7
4r3aB-1jnuA:
23.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1k1x 4-ALPHA-GLUCANOTRANS
FERASE


(Thermococcus
litoralis)
PF03065
(Glyco_hydro_57)
PF09094
(DUF1925)
PF09095
(DUF1926)
5 ILE A  10
LEU A  66
LEU A  72
MET A  35
PHE A  34
None
1.36A 4r3aB-1k1xA:
undetectable
4r3aB-1k1xA:
20.03
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.
1n9l PUTATIVE BLUE LIGHT
RECEPTOR


(Chlamydomonas
reinhardtii)
PF13426
(PAS_9)
5 ASN A  56
LEU A  60
GLN A  61
VAL A  70
PHE A 116
FMN  A 500 (-2.9A)
FMN  A 500 (-4.3A)
FMN  A 500 (-3.3A)
FMN  A 500 (-4.3A)
FMN  A 500 (-4.8A)
0.62A 4r3aB-1n9lA:
15.6
4r3aB-1n9lA:
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.
1olt OXYGEN-INDEPENDENT
COPROPORPHYRINOGEN
III OXIDASE


(Escherichia
coli)
PF04055
(Radical_SAM)
PF06969
(HemN_C)
5 THR A 206
ILE A 201
GLU A 200
ASN A 196
LEU A 232
None
1.47A 4r3aB-1oltA:
undetectable
4r3aB-1oltA:
23.23
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.
1vdk FUMARATE HYDRATASE
CLASS II


(Thermus
thermophilus)
PF00206
(Lyase_1)
PF10415
(FumaraseC_C)
5 ASN A 359
VAL A 275
LEU A 274
MET A 148
PHE A 144
None
1.48A 4r3aB-1vdkA:
undetectable
4r3aB-1vdkA:
24.05
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.
2dt9 ASPARTOKINASE

(Thermus
thermophilus)
PF01842
(ACT)
PF13840
(ACT_7)
5 ILE A 129
LEU A  12
VAL A 101
MET A 115
PHE A 116
None
1.26A 4r3aB-2dt9A:
2.5
4r3aB-2dt9A:
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.
2ehh DIHYDRODIPICOLINATE
SYNTHASE


(Aquifex
aeolicus)
PF00701
(DHDPS)
5 ILE A 173
LEU A 222
VAL A 202
LEU A 184
PHE A 181
None
1.39A 4r3aB-2ehhA:
undetectable
4r3aB-2ehhA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2f4z TGTWINSCAN_2721 - E2
DOMAIN


(Toxoplasma
gondii)
PF00179
(UQ_con)
5 LEU A 155
GLN A 152
VAL A  65
LEU A 148
MET A 111
None
1.37A 4r3aB-2f4zA:
undetectable
4r3aB-2f4zA:
18.72
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.
2gf9 RAS-RELATED PROTEIN
RAB-3D


(Homo sapiens)
PF00071
(Ras)
5 ILE A  71
LEU A  39
VAL A 175
LEU A 179
PHE A  23
None
1.24A 4r3aB-2gf9A:
undetectable
4r3aB-2gf9A:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jgp TYROCIDINE
SYNTHETASE 3


(Brevibacillus
brevis)
PF00550
(PP-binding)
PF00668
(Condensation)
5 THR A 220
ILE A 226
LEU A 236
VAL A 230
MET A 123
DIO  A1525 ( 3.8A)
None
DIO  A1525 ( 3.8A)
None
None
1.17A 4r3aB-2jgpA:
undetectable
4r3aB-2jgpA:
22.12
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.
2mwg BLUE-LIGHT
PHOTORECEPTOR


(Bacillus
subtilis)
PF01740
(STAS)
PF13426
(PAS_9)
5 ASN A  61
LEU A  65
GLN A  66
VAL A  75
PHE A 119
FMN  A 900 (-2.0A)
FMN  A 900 ( 4.1A)
FMN  A 900 (-2.6A)
None
None
1.14A 4r3aB-2mwgA:
12.5
4r3aB-2mwgA:
29.94
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.
2nzt HEXOKINASE-2

(Homo sapiens)
PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2)
5 THR A 172
ILE A 229
ASN A 208
LEU A 168
LEU A  85
GLC  A1001 (-2.7A)
GLC  A1001 (-4.2A)
GLC  A1001 ( 3.0A)
None
None
1.49A 4r3aB-2nztA:
undetectable
4r3aB-2nztA:
18.03
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.
2pr5 BLUE-LIGHT
PHOTORECEPTOR


(Bacillus
subtilis)
PF13426
(PAS_9)
5 ASN A  61
LEU A  65
GLN A  66
VAL A  75
PHE A 119
FMN  A 500 (-3.2A)
FMN  A 500 (-4.4A)
FMN  A 500 (-3.1A)
FMN  A 500 (-4.6A)
FMN  A 500 ( 4.8A)
0.58A 4r3aB-2pr5A:
14.7
4r3aB-2pr5A:
19.76
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.
2v4y URIDYLATE KINASE

(Escherichia
coli)
PF00696
(AA_kinase)
5 GLU A  19
ASN A  59
LEU A  34
LEU A  16
MET A 220
GTP  A1243 (-2.7A)
None
None
None
None
1.38A 4r3aB-2v4yA:
undetectable
4r3aB-2v4yA:
23.50
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.
2wkp NPH1-1, RAS-RELATED
C3 BOTULINUM TOXIN
SUBSTRATE 1


(Avena sativa;
Homo sapiens)
PF00071
(Ras)
PF13426
(PAS_9)
5 ASN A 449
LEU A 453
GLN A 454
VAL A 463
PHE A 509
FMN  A1725 (-3.0A)
FMN  A1725 (-4.2A)
FMN  A1725 (-3.1A)
FMN  A1725 (-4.6A)
None
0.65A 4r3aB-2wkpA:
17.7
4r3aB-2wkpA:
26.65
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.
2xf4 HYDROXYACYLGLUTATHIO
NE HYDROLASE


(Salmonella
enterica)
PF00753
(Lactamase_B)
5 ILE A 189
GLN A  51
VAL A 117
LEU A 124
MET A   1
None
1.48A 4r3aB-2xf4A:
undetectable
4r3aB-2xf4A:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS


(Leptospira
interrogans)
PF00682
(HMGL-like)
5 ILE A 289
GLU A 247
ASN A 235
LEU A  42
PHE A 321
None
1.44A 4r3aB-3bleA:
undetectable
4r3aB-3bleA:
23.43
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.
3cai POSSIBLE
AMINOTRANSFERASE


(Mycobacterium
tuberculosis)
PF00266
(Aminotran_5)
5 THR A 174
ILE A 109
ASN A 118
VAL A 212
MET A 179
None
1.32A 4r3aB-3caiA:
undetectable
4r3aB-3caiA:
22.51
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.
3cmm UBIQUITIN-ACTIVATING
ENZYME E1 1


(Saccharomyces
cerevisiae)
PF00899
(ThiF)
PF09358
(E1_UFD)
PF10585
(UBA_e1_thiolCys)
PF16190
(E1_FCCH)
PF16191
(E1_4HB)
5 THR A 540
GLU A 448
ASN A 452
LEU A 458
VAL A 502
None
1.35A 4r3aB-3cmmA:
undetectable
4r3aB-3cmmA:
17.28
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.
3j1c CHAPERONIN ALPHA
SUBUNIT


(Acidianus
tengchongensis)
PF00118
(Cpn60_TCP1)
5 THR A 517
ILE A 454
GLU A 422
LEU A 134
LEU A 429
None
1.34A 4r3aB-3j1cA:
undetectable
4r3aB-3j1cA:
22.88
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.
3m0z PUTATIVE ALDOLASE

(Klebsiella
pneumoniae)
PF07071
(KDGP_aldolase)
5 THR A 190
ILE A 213
LEU A  17
VAL A 234
LEU A 237
None
1.19A 4r3aB-3m0zA:
undetectable
4r3aB-3m0zA:
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.
3mtq PUTATIVE
PHOSPHOENOLPYRUVATE-
DEPENDENT SUGAR
PHOSPHOTRANSFERASE
SYSTEM (PTS)
PERMEASE


(Klebsiella
pneumoniae)
PF03610
(EIIA-man)
5 ILE A  64
LEU A  44
VAL A  52
LEU A  51
PHE A   7
None
1.48A 4r3aB-3mtqA:
undetectable
4r3aB-3mtqA:
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.
3o0r NITRIC OXIDE
REDUCTASE SUBUNIT B


(Pseudomonas
aeruginosa)
PF00115
(COX1)
5 ILE B 364
LEU B  63
GLN B  30
LEU B  68
PHE B  20
None
None
HEM  B 801 (-3.5A)
None
None
1.50A 4r3aB-3o0rB:
undetectable
4r3aB-3o0rB:
22.43
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.
3ovz CATHEPSIN K

(Homo sapiens)
PF00112
(Peptidase_C1)
5 THR A  42
LEU A  46
VAL A  31
LEU A  34
MET A 215
None
1.38A 4r3aB-3ovzA:
undetectable
4r3aB-3ovzA:
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.
3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN


(Staphylococcus
aureus)
PF00753
(Lactamase_B)
5 ILE A 147
GLN A 239
LEU A 235
MET A 175
PHE A 146
None
1.44A 4r3aB-3r2uA:
undetectable
4r3aB-3r2uA:
22.22
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.
3rg1 CD180 MOLECULE

(Bos taurus)
PF00560
(LRR_1)
PF13855
(LRR_8)
5 ILE A 137
LEU A 127
VAL A 107
LEU A 108
MET A 116
None
1.46A 4r3aB-3rg1A:
undetectable
4r3aB-3rg1A:
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.
3rg1 CD180 MOLECULE

(Bos taurus)
PF00560
(LRR_1)
PF13855
(LRR_8)
5 ILE A 137
VAL A 107
LEU A 108
MET A 116
PHE A 142
None
1.25A 4r3aB-3rg1A:
undetectable
4r3aB-3rg1A:
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.
3slc ACETATE KINASE

(Salmonella
enterica)
PF00871
(Acetate_kinase)
5 THR A 331
ILE A 207
GLN A 191
VAL A 201
LEU A 204
None
1.45A 4r3aB-3slcA:
undetectable
4r3aB-3slcA:
22.25
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.
3tbk RIG-I HELICASE
DOMAIN


(Mus musculus)
PF00271
(Helicase_C)
PF04851
(ResIII)
5 THR A 378
ILE A 371
ASN A 260
LEU A 392
LEU A 364
None
1.36A 4r3aB-3tbkA:
undetectable
4r3aB-3tbkA:
20.32
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.
3ty4 PROBABLE
HOMOISOCITRATE
DEHYDROGENASE


(Schizosaccharomyces
pombe)
PF00180
(Iso_dh)
5 ILE A  93
ASN A 105
LEU A 311
VAL A 272
PHE A  76
None
1.48A 4r3aB-3ty4A:
undetectable
4r3aB-3ty4A:
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.
3umm PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE


(Salmonella
enterica)
PF02769
(AIRS_C)
PF13507
(GATase_5)
5 THR A 721
ILE A 734
LEU A 714
VAL A 760
LEU A 764
None
1.39A 4r3aB-3ummA:
undetectable
4r3aB-3ummA:
15.51
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.
3zpp CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN


(Streptococcus
pneumoniae)
PF12708
(Pectate_lyase_3)
PF13229
(Beta_helix)
5 THR A 490
ILE A 508
ASN A 461
LEU A 413
VAL A 404
None
1.46A 4r3aB-3zppA:
undetectable
4r3aB-3zppA:
22.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gcz BLUE-LIGHT
PHOTORECEPTOR,
SENSOR PROTEIN FIXL


(Bacillus
subtilis;
Bradyrhizobium
diazoefficiens)
PF00512
(HisKA)
PF02518
(HATPase_c)
PF13426
(PAS_9)
5 ASN A  61
LEU A  65
GLN A  66
VAL A  75
PHE A 119
FMN  A 401 (-3.1A)
FMN  A 401 (-4.5A)
FMN  A 401 (-3.2A)
FMN  A 401 ( 4.6A)
FMN  A 401 (-4.7A)
0.70A 4r3aB-4gczA:
14.4
4r3aB-4gczA:
31.44
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.
4hhd PHOTOTROPIN-1

(Arabidopsis
thaliana)
PF13426
(PAS_9)
5 ASN A 511
LEU A 515
GLN A 516
VAL A 525
PHE A 571
FMN  A 701 (-2.9A)
FMN  A 701 (-4.4A)
FMN  A 701 (-3.3A)
FMN  A 701 (-4.9A)
FMN  A 701 (-4.9A)
0.66A 4r3aB-4hhdA:
16.8
4r3aB-4hhdA:
20.51
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.
4hj3 LOV PROTEIN

(Rhodobacter
sphaeroides)
PF13426
(PAS_9)
5 THR A  21
ASN A  54
LEU A  58
GLN A  59
PHE A 114
FMN  A 201 (-4.4A)
FMN  A 201 (-3.1A)
FMN  A 201 (-4.4A)
FMN  A 201 (-3.6A)
None
0.43A 4r3aB-4hj3A:
13.9
4r3aB-4hj3A:
24.29
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.
4jkl BETA-GLUCURONIDASE

(Streptococcus
agalactiae)
PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
5 ILE A 442
GLU A 408
ASN A 407
LEU A 136
PHE A 357
None
1.29A 4r3aB-4jklA:
undetectable
4r3aB-4jklA:
19.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4m6w FANCONI ANEMIA GROUP
M PROTEIN
FANCONI
ANEMIA-ASSOCIATED
PROTEIN OF 24 KDA


(Homo sapiens)
PF02732
(ERCC4)
PF12826
(HHH_2)
5 THR B 108
ILE A1932
LEU B  59
VAL B 129
PHE A1934
None
1.40A 4r3aB-4m6wB:
undetectable
4r3aB-4m6wB:
22.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ovy HALOACID
DEHALOGENASE DOMAIN
PROTEIN HYDROLASE


(Planctopirus
limnophila)
PF12710
(HAD)
5 THR A 283
GLU A  73
ASN A 257
LEU A 304
PHE A 289
None
CA  A 409 ( 4.1A)
CA  A 409 (-2.8A)
None
None
1.38A 4r3aB-4ovyA:
undetectable
4r3aB-4ovyA:
23.26
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.
4q0g PROBABLE
ACETYL-/PROPIONYL-CO
A CARBOXYLASE (BETA
SUBUNIT) ACCD1


(Mycobacterium
tuberculosis)
PF01039
(Carboxyl_trans)
5 THR A 503
ILE A 497
LEU A 367
GLN A 368
LEU A 428
None
1.33A 4r3aB-4q0gA:
undetectable
4r3aB-4q0gA:
22.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r38 BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2


(Erythrobacter
litoralis)
PF13426
(PAS_9)
10 THR A  21
ILE A  25
GLU A  30
ASN A  54
LEU A  58
GLN A  59
VAL A  68
LEU A  71
MET A 101
PHE A 114
RBF  A 201 (-3.1A)
None
None
RBF  A 201 (-2.6A)
RBF  A 201 (-3.9A)
RBF  A 201 (-3.0A)
RBF  A 201 (-3.3A)
RBF  A 201 ( 3.6A)
RBF  A 201 (-3.2A)
RBF  A 201 (-4.4A)
0.59A 4r3aB-4r38A:
16.8
4r3aB-4r38A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r38 BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2


(Erythrobacter
litoralis)
PF13426
(PAS_9)
5 THR A  21
ILE A  75
LEU A  58
MET A 101
PHE A 114
RBF  A 201 (-3.1A)
RBF  A 201 (-4.2A)
RBF  A 201 (-3.9A)
RBF  A 201 (-3.2A)
RBF  A 201 (-4.4A)
1.42A 4r3aB-4r38A:
16.8
4r3aB-4r38A:
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.
4ri2 PHOTOSYSTEM II 22
KDA PROTEIN,
CHLOROPLASTIC


(Spinacia
oleracea)
PF00504
(Chloroa_b-bind)
5 THR A 174
ILE A 178
GLU A 182
VAL A 189
LEU A  52
None
1.40A 4r3aB-4ri2A:
undetectable
4r3aB-4ri2A:
21.29
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.
4wuj GLYCOSIDE HYDROLASE
FAMILY 15, CELLULOSE
SIGNALING ASSOCIATED
PROTEIN ENVOY


(Trichoderma
reesei)
PF13426
(PAS_9)
6 THR A 101
ILE A 105
ASN A 134
LEU A 138
GLN A 139
VAL A 154
FMN  A5201 (-3.4A)
None
FMN  A5201 (-2.5A)
FMN  A5201 (-3.7A)
FMN  A5201 (-3.1A)
FMN  A5201 (-3.6A)
0.65A 4r3aB-4wujA:
12.2
4r3aB-4wujA:
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.
5a8b PTAUREO1A LOV2
DOMAIN


(Phaeodactylum
tricornutum)
PF13426
(PAS_9)
5 ASN A 286
LEU A 290
GLN A 291
VAL A 300
PHE A 346
FMN  A 500 (-3.2A)
FMN  A 500 (-4.0A)
FMN  A 500 (-3.0A)
None
FMN  A 500 (-4.8A)
0.78A 4r3aB-5a8bA:
14.0
4r3aB-5a8bA:
18.68
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.
5cwv NUCLEOPORIN NUP192

(Chaetomium
thermophilum)
PF11894
(Nup192)
5 GLU A1545
LEU A1584
VAL A1536
LEU A1535
MET A1495
None
1.35A 4r3aB-5cwvA:
undetectable
4r3aB-5cwvA:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dju NPH1-2

(Avena sativa)
PF13426
(PAS_9)
5 ASN A 449
LEU A 453
GLN A 454
VAL A 463
PHE A 509
FMN  A 601 ( 3.1A)
FMN  A 601 (-4.0A)
FMN  A 601 (-3.1A)
FMN  A 601 (-4.6A)
None
0.63A 4r3aB-5djuA:
17.9
4r3aB-5djuA:
21.18
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.
5gqf LACTO-N-BIOSIDASE

(Bifidobacterium
longum)
no annotation 5 THR A 159
ILE A 103
ASN A  76
VAL A  51
LEU A  90
None
1.43A 4r3aB-5gqfA:
undetectable
4r3aB-5gqfA:
19.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hb0 NUCLEOPORIN NUP170

(Chaetomium
thermophilum)
no annotation 5 THR B1242
ILE B1170
GLN B1234
LEU B1189
PHE B1171
None
1.38A 4r3aB-5hb0B:
undetectable
4r3aB-5hb0B:
22.55
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.
5hb1 NUCLEOPORIN NUP170

(Chaetomium
thermophilum)
PF03177
(Nucleoporin_C)
5 THR A1242
ILE A1170
GLN A1234
LEU A1189
PHE A1171
None
1.48A 4r3aB-5hb1A:
undetectable
4r3aB-5hb1A:
18.04
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.
5hzh RAS-RELATED C3
BOTULINUM TOXIN
SUBSTRATE
1,NPH1-1,RAS-RELATED
C3 BOTULINUM TOXIN
SUBSTRATE 1


(Avena sativa;
Homo sapiens)
PF00071
(Ras)
PF13426
(PAS_9)
5 ASN A  96
LEU A 100
GLN A 101
VAL A 110
PHE A 156
FMN  A 402 (-3.2A)
FMN  A 402 (-4.1A)
FMN  A 402 (-2.9A)
FMN  A 402 (-4.5A)
FMN  A 402 (-4.9A)
0.59A 4r3aB-5hzhA:
18.2
4r3aB-5hzhA:
26.18
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.
5hzk INTERSECTIN-1,NPH1-1
,INTERSECTIN-1


(Avena sativa;
Homo sapiens)
PF00621
(RhoGEF)
PF13426
(PAS_9)
PF16652
(PH_13)
5 ASN B1354
LEU B1358
GLN B1359
VAL B1368
PHE B1414
FMN  B1801 (-3.0A)
FMN  B1801 (-4.2A)
FMN  B1801 (-3.0A)
FMN  B1801 (-4.5A)
FMN  B1801 (-4.8A)
0.66A 4r3aB-5hzkB:
18.1
4r3aB-5hzkB:
26.42
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.
5it3 LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1A


(Homo sapiens)
PF04433
(SWIRM)
5 THR A 234
ILE A 227
ASN A 263
LEU A 256
LEU A 222
None
1.40A 4r3aB-5it3A:
undetectable
4r3aB-5it3A:
12.65
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.
5k1c WD REPEAT-CONTAINING
PROTEIN 48


(Homo sapiens)
PF00400
(WD40)
5 THR B 115
ILE B 141
LEU B 149
VAL B  82
LEU B 123
None
1.49A 4r3aB-5k1cB:
undetectable
4r3aB-5k1cB:
20.77
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.
5oom ACYL CARRIER
PROTEIN,
MITOCHONDRIAL
MIEF1 UPSTREAM OPEN
READING FRAME
PROTEIN


(Homo sapiens)
PF00467
(KOW)
PF01016
(Ribosomal_L27)
PF17136
(ribosomal_L24)
5 ILE v  35
LEU w 110
GLN w 115
LEU v  10
PHE v  39
None
1.22A 4r3aB-5oomv:
undetectable
4r3aB-5oomv:
13.72
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.
5svw ADAGIO PROTEIN 1

(Arabidopsis
thaliana)
no annotation 5 ILE B 122
ASN B  53
LEU B  57
GLN B  58
VAL B  76
FMN  B5201 (-3.1A)
FMN  B5201 (-2.9A)
FMN  B5201 (-3.7A)
FMN  B5201 (-3.1A)
FMN  B5201 (-3.8A)
1.00A 4r3aB-5svwB:
13.9
4r3aB-5svwB:
19.60
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.
5u4h UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE


(Acinetobacter
baumannii)
PF00275
(EPSP_synthase)
5 THR A 252
ILE A 234
LEU A 410
VAL A 378
LEU A 379
None
1.44A 4r3aB-5u4hA:
undetectable
4r3aB-5u4hA:
23.25
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.
5u9p GLUCONATE
5-DEHYDROGENASE


(Burkholderia
cenocepacia)
PF13561
(adh_short_C2)
5 ILE A 144
ASN A  96
LEU A 198
VAL A 224
LEU A 227
None
NAP  A 301 (-3.3A)
NAP  A 301 ( 3.5A)
None
None
1.30A 4r3aB-5u9pA:
undetectable
4r3aB-5u9pA:
25.14
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.
5veh KYNURENINE
AMINOTRANSFERASE


(Aedes aegypti)
no annotation 5 THR A 256
GLU A 222
LEU A  86
VAL A  94
LEU A  93
LLP  A 255 ( 4.4A)
None
None
None
None
1.08A 4r3aB-5vehA:
undetectable
4r3aB-5vehA:
22.12
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.
5wna MAB 3D3 FAB HEAVY
CHAIN
MAJOR SURFACE
GLYCOPROTEIN G


(Homo sapiens;
Human
orthopneumovirus)
no annotation 5 ILE B 189
GLU H  30
ASN H  74
LEU H  79
LEU H  27
None
1.26A 4r3aB-5wnaB:
undetectable
4r3aB-5wnaB:
5.85
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.
5wsl KERATINASE

(Meiothermus
taiwanensis)
no annotation 5 THR A 177
ILE A 147
LEU A 139
MET A 129
PHE A 153
CA  A 302 (-3.5A)
None
None
None
None
1.24A 4r3aB-5wslA:
undetectable
4r3aB-5wslA:
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.
6gbv PUTATIVE BLUE-LIGHT
PHOTORECEPTOR


(Dinoroseobacter
shibae)
no annotation 5 ASN A  71
LEU A  75
GLN A  76
VAL A  85
PHE A 131
FMN  A 500 ( 3.2A)
FMN  A 500 (-4.0A)
FMN  A 500 (-4.2A)
FMN  A 500 (-4.3A)
FMN  A 500 (-4.8A)
1.03A 4r3aB-6gbvA:
14.8
4r3aB-6gbvA:
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.
1jnu PHY3 PROTEIN

(Adiantum
capillus-veneris)
PF13426
(PAS_9)
6 CYH A 966
ARG A 967
ASN A 998
ASN A1008
GLY A1027
GLN A1029
FMN  A1033 (-1.8A)
FMN  A1033 (-3.6A)
FMN  A1033 (-3.2A)
FMN  A1033 (-4.1A)
FMN  A1033 (-3.7A)
FMN  A1033 (-4.2A)
0.50A 4r3aB-1jnuA:
15.7
4r3aB-1jnuA:
23.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n9l PUTATIVE BLUE LIGHT
RECEPTOR


(Chlamydomonas
reinhardtii)
PF13426
(PAS_9)
10 ALA A  25
LEU A  34
CYH A  57
ARG A  58
ILE A  77
ASN A  89
ASN A  99
LEU A 101
GLY A 118
GLN A 120
FMN  A 500 ( 3.7A)
None
FMN  A 500 (-3.4A)
FMN  A 500 (-4.0A)
FMN  A 500 (-4.7A)
FMN  A 500 (-3.0A)
FMN  A 500 (-3.9A)
FMN  A 500 (-4.1A)
FMN  A 500 (-3.9A)
FMN  A 500 (-3.7A)
0.44A 4r3aB-1n9lA:
15.6
4r3aB-1n9lA:
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.
1q1p EPITHELIAL-CADHERIN

(Mus musculus)
PF00028
(Cadherin)
5 LEU A  66
ILE A  52
ILE A  94
LEU A  76
GLY A  42
None
1.02A 4r3aB-1q1pA:
undetectable
4r3aB-1q1pA:
20.66
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.
1qhg ATP-DEPENDENT
HELICASE PCRA


(Geobacillus
stearothermophilus)
PF00580
(UvrD-helicase)
PF13361
(UvrD_C)
5 ALA A 248
ILE A 280
LEU A 282
GLY A  36
GLN A  16
None
None
None
ATP  A 726 (-3.4A)
ATP  A 726 (-3.3A)
0.97A 4r3aB-1qhgA:
undetectable
4r3aB-1qhgA:
21.10
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.
1qhh PROTEIN (PCRA
(SUBUNIT))


(Geobacillus
stearothermophilus)
PF00580
(UvrD-helicase)
PF13361
(UvrD_C)
5 ALA B 248
ILE B 280
LEU B 282
GLY A  36
GLN A  16
None
None
None
ATP  A 700 (-3.4A)
ATP  A 700 (-2.8A)
0.94A 4r3aB-1qhhB:
undetectable
4r3aB-1qhhB:
20.86
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.
1uaq CYTOSINE DEAMINASE

(Saccharomyces
cerevisiae)
PF00383
(dCMP_cyt_deam_1)
5 CYH A  71
ILE A  65
ILE A 103
LEU A  84
GLY A  35
None
0.89A 4r3aB-1uaqA:
undetectable
4r3aB-1uaqA:
17.32
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.
1ufr PYR MRNA-BINDING
ATTENUATION PROTEIN


(Thermus
thermophilus)
PF00156
(Pribosyltran)
5 ALA A 115
LEU A 119
ALA A 145
ILE A  24
GLY A  38
None
0.97A 4r3aB-1ufrA:
undetectable
4r3aB-1ufrA:
21.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vhk HYPOTHETICAL PROTEIN
YQEU


(Bacillus
subtilis)
PF04452
(Methyltrans_RNA)
5 LEU A 227
ALA A 105
ILE A  83
ILE A  79
LEU A 199
None
1.02A 4r3aB-1vhkA:
undetectable
4r3aB-1vhkA:
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.
1wuf HYPOTHETICAL PROTEIN
LIN2664


(Listeria
innocua)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 LEU A1262
ALA A1121
ILE A1124
LEU A1106
GLY A1269
None
0.97A 4r3aB-1wufA:
undetectable
4r3aB-1wufA:
22.40
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.
1wuu GALACTOKINASE

(Homo sapiens)
PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg)
5 ALA A 387
ALA A 164
ILE A 163
ILE A 201
LEU A 199
None
1.01A 4r3aB-1wuuA:
undetectable
4r3aB-1wuuA:
24.41
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.
1ybw HEPATOCYTE GROWTH
FACTOR ACTIVATOR
PRECURSOR


(Homo sapiens)
PF00089
(Trypsin)
5 ALA A 584
LEU A 561
ALA A 538
ILE A 537
ILE A 520
None
0.99A 4r3aB-1ybwA:
undetectable
4r3aB-1ybwA:
22.01
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.
2g5c PREPHENATE
DEHYDROGENASE


(Aquifex
aeolicus)
PF02153
(PDH)
5 ALA A 222
LEU A 223
ALA A 273
ILE A 274
LEU A 281
None
1.02A 4r3aB-2g5cA:
undetectable
4r3aB-2g5cA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hes YDR267CP

(Saccharomyces
cerevisiae)
PF00400
(WD40)
5 ALA X  28
LEU X  27
ALA X 114
ASN X 255
GLY X  30
None
0.90A 4r3aB-2hesX:
undetectable
4r3aB-2hesX:
22.37
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.
2ji9 OXALYL-COA
DECARBOXYLASE


(Oxalobacter
formigenes)
PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
5 LEU A 103
CYH A  76
ALA A  40
ILE A  36
GLY A  83
None
0.96A 4r3aB-2ji9A:
undetectable
4r3aB-2ji9A:
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.
2jnk HYALURONONGLUCOSAMIN
IDASE


(Clostridium
perfringens)
PF00404
(Dockerin_1)
PF07554
(FIVAR)
6 ILE A  90
ILE A 118
ASN A 101
ASN A 107
LEU A 110
GLY A  86
None
1.38A 4r3aB-2jnkA:
undetectable
4r3aB-2jnkA:
16.86
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.
2mwg BLUE-LIGHT
PHOTORECEPTOR


(Bacillus
subtilis)
PF01740
(STAS)
PF13426
(PAS_9)
7 CYH A  62
ARG A  63
ASN A  94
ASN A 104
LEU A 106
GLY A 121
GLN A 123
FMN  A 900 (-3.3A)
FMN  A 900 (-4.9A)
FMN  A 900 (-2.9A)
FMN  A 900 (-3.9A)
FMN  A 900 (-4.3A)
FMN  A 900 (-2.9A)
FMN  A 900 (-4.2A)
1.09A 4r3aB-2mwgA:
12.5
4r3aB-2mwgA:
29.94
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.
2mwg BLUE-LIGHT
PHOTORECEPTOR


(Bacillus
subtilis)
PF01740
(STAS)
PF13426
(PAS_9)
7 CYH A  62
ILE A  92
ASN A  94
ASN A 104
LEU A 106
GLY A 121
GLN A 123
FMN  A 900 (-3.3A)
FMN  A 900 ( 4.1A)
FMN  A 900 (-2.9A)
FMN  A 900 (-3.9A)
FMN  A 900 (-4.3A)
FMN  A 900 (-2.9A)
FMN  A 900 (-4.2A)
0.60A 4r3aB-2mwgA:
12.5
4r3aB-2mwgA:
29.94
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.
2o56 PUTATIVE MANDELATE
RACEMASE


(Salmonella
enterica)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 ALA A 330
ALA A 103
ILE A 102
ILE A  10
GLY A 325
None
1.02A 4r3aB-2o56A:
undetectable
4r3aB-2o56A:
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.
2pjr PROTEIN (HELICASE
PCRA)


(Geobacillus
stearothermophilus)
PF00580
(UvrD-helicase)
PF13361
(UvrD_C)
5 ALA A 248
ILE A 280
LEU A 282
GLY A  36
GLN A  16
None
1.01A 4r3aB-2pjrA:
undetectable
4r3aB-2pjrA:
22.46
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.
2pr5 BLUE-LIGHT
PHOTORECEPTOR


(Bacillus
subtilis)
PF13426
(PAS_9)
8 CYH A  62
ARG A  63
ILE A  92
ASN A  94
ASN A 104
LEU A 106
GLY A 121
GLN A 123
FMN  A 500 (-3.5A)
FMN  A 500 (-3.8A)
FMN  A 500 ( 4.6A)
FMN  A 500 (-3.1A)
FMN  A 500 (-3.7A)
FMN  A 500 (-4.1A)
FMN  A 500 (-3.9A)
FMN  A 500 (-3.9A)
0.47A 4r3aB-2pr5A:
14.7
4r3aB-2pr5A:
19.76
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.
2r0l HEPATOCYTE GROWTH
FACTOR ACTIVATOR


(Homo sapiens)
PF00089
(Trypsin)
5 ALA A 183
LEU A 162
ALA A 139
ILE A 138
ILE A 121
None
0.96A 4r3aB-2r0lA:
undetectable
4r3aB-2r0lA:
20.11
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.
2wkp NPH1-1, RAS-RELATED
C3 BOTULINUM TOXIN
SUBSTRATE 1


(Avena sativa;
Homo sapiens)
PF00071
(Ras)
PF13426
(PAS_9)
6 ARG A 451
ILE A 470
ASN A 482
ASN A 492
GLY A 511
GLN A 513
FMN  A1725 (-3.8A)
FMN  A1725 (-4.7A)
FMN  A1725 (-3.0A)
FMN  A1725 (-3.8A)
FMN  A1725 (-3.7A)
FMN  A1725 (-3.8A)
0.41A 4r3aB-2wkpA:
17.7
4r3aB-2wkpA:
26.65
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.
2wkp NPH1-1, RAS-RELATED
C3 BOTULINUM TOXIN
SUBSTRATE 1


(Avena sativa;
Homo sapiens)
PF00071
(Ras)
PF13426
(PAS_9)
6 CYH A 450
ARG A 451
ILE A 470
ASN A 492
GLY A 511
GLN A 513
FMN  A1725 (-3.4A)
FMN  A1725 (-3.8A)
FMN  A1725 (-4.7A)
FMN  A1725 (-3.8A)
FMN  A1725 (-3.7A)
FMN  A1725 (-3.8A)
0.86A 4r3aB-2wkpA:
17.7
4r3aB-2wkpA:
26.65
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.
2xax RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE 1
SUBUNIT ALPHA


(Escherichia
coli)
PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone)
5 ALA A 302
LEU A 438
ALA A 243
ILE A 244
GLY A 300
None
1.02A 4r3aB-2xaxA:
undetectable
4r3aB-2xaxA:
20.08
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.
2ywj GLUTAMINE
AMIDOTRANSFERASE
SUBUNIT PDXT


(Methanocaldococcus
jannaschii)
PF01174
(SNO)
5 LEU A  92
ALA A   7
ILE A   8
ILE A  38
LEU A  35
None
0.96A 4r3aB-2ywjA:
undetectable
4r3aB-2ywjA:
18.26
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.
2z6c PHOTOTROPIN-1

(Arabidopsis
thaliana)
PF13426
(PAS_9)
8 CYH A 234
ARG A 235
ILE A 264
ASN A 266
ASN A 276
LEU A 278
GLY A 295
GLN A 297
FMN  A 500 (-3.4A)
FMN  A 500 (-3.9A)
None
FMN  A 500 (-3.0A)
FMN  A 500 (-3.6A)
FMN  A 500 (-4.3A)
FMN  A 500 (-3.9A)
FMN  A 500 (-3.6A)
0.69A 4r3aB-2z6cA:
14.6
4r3aB-2z6cA:
17.33
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.
2z6d PHOTOTROPIN-2

(Arabidopsis
thaliana)
PF13426
(PAS_9)
7 CYH A 170
ARG A 171
ASN A 202
ASN A 212
LEU A 214
GLY A 231
GLN A 233
FMN  A 500 (-3.5A)
FMN  A 500 (-3.7A)
FMN  A 500 (-3.1A)
FMN  A 500 (-3.7A)
FMN  A 500 (-4.3A)
FMN  A 500 (-3.7A)
FMN  A 500 (-3.8A)
0.48A 4r3aB-2z6dA:
14.9
4r3aB-2z6dA:
16.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zcx TETR-FAMILY
TRANSCRIPTIONAL
REGULATOR


(Streptomyces
coelicolor)
PF00440
(TetR_N)
6 LEU A  90
ARG A 154
ILE A 168
ILE A 220
LEU A 217
GLY A 102
None
1.27A 4r3aB-2zcxA:
undetectable
4r3aB-2zcxA:
23.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3clk TRANSCRIPTION
REGULATOR


(Lactobacillus
plantarum)
PF13377
(Peripla_BP_3)
5 ALA A 210
ILE A 211
ILE A 174
ASN A 171
GLY A 199
None
1.00A 4r3aB-3clkA:
undetectable
4r3aB-3clkA:
22.37
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.
3eu8 PUTATIVE
GLUCOAMYLASE


(Bacteroides
fragilis)
PF10091
(Glycoamylase)
PF11329
(DUF3131)
6 ALA A  65
LEU A  64
ILE A  95
ILE A 184
LEU A 163
GLY A  89
EDO  A 474 (-3.6A)
None
None
None
None
None
1.40A 4r3aB-3eu8A:
undetectable
4r3aB-3eu8A:
22.99
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.
3grk ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(NADH)


(Brucella
melitensis)
PF13561
(adh_short_C2)
5 ALA A  32
LEU A   8
ILE A  15
ILE A 144
GLY A 232
None
0.83A 4r3aB-3grkA:
undetectable
4r3aB-3grkA:
23.32
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.
3j0a TOLL-LIKE RECEPTOR 5

(Homo sapiens)
PF01582
(TIR)
PF13855
(LRR_8)
5 LEU A 341
ILE A 372
ASN A 394
ASN A 370
LEU A 347
None
0.99A 4r3aB-3j0aA:
undetectable
4r3aB-3j0aA:
16.95
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.
3p7n SENSOR HISTIDINE
KINASE


(Erythrobacter
litoralis)
PF00196
(GerE)
PF13426
(PAS_9)
8 LEU A  52
CYH A  75
ARG A  76
ILE A 105
ASN A 107
ASN A 117
GLY A 136
GLN A 138
None
FMN  A 500 (-3.3A)
FMN  A 500 (-3.8A)
FMN  A 500 (-4.1A)
FMN  A 500 (-3.1A)
FMN  A 500 (-4.1A)
FMN  A 500 ( 4.0A)
FMN  A 500 (-3.9A)
0.51A 4r3aB-3p7nA:
14.5
4r3aB-3p7nA:
24.06
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.
3q13 SPONDIN-1

(Homo sapiens)
PF06468
(Spond_N)
5 ALA A 401
LEU A 350
ALA A 233
ILE A 283
LEU A 209
None
0.88A 4r3aB-3q13A:
undetectable
4r3aB-3q13A:
21.49
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.
3q2w CADHERIN-2

(Mus musculus)
PF00028
(Cadherin)
5 LEU A  66
ILE A  52
ILE A  94
LEU A  76
GLY A  42
None
0.98A 4r3aB-3q2wA:
undetectable
4r3aB-3q2wA:
21.17
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.
3q60 ROP5B

(Toxoplasma
gondii)
PF14531
(Kinase-like)
5 ARG A 480
ALA A 435
LEU A 444
GLY A 388
GLN A 448
None
0.99A 4r3aB-3q60A:
undetectable
4r3aB-3q60A:
23.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rh8 VIVID PAS PROTEIN
VVD


(Neurospora
crassa)
PF13426
(PAS_9)
8 CYH B 108
ARG B 109
ILE B 139
ASN B 151
ASN B 161
LEU B 163
GLY B 180
GLN B 182
FAD  B5201 (-1.8A)
FAD  B5201 (-4.3A)
FAD  B5201 (-4.6A)
FAD  B5201 (-3.0A)
FAD  B5201 (-3.7A)
FAD  B5201 (-3.8A)
FAD  B5201 (-3.8A)
FAD  B5201 (-4.1A)
0.60A 4r3aB-3rh8B:
12.5
4r3aB-3rh8B:
17.13
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.
3t50 BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE


(Brucella
melitensis)
PF13426
(PAS_9)
6 ALA A  84
ILE A  99
ASN A 101
ASN A 111
LEU A 113
GLN A 132
None
FMN  A 200 ( 4.4A)
FMN  A 200 (-3.1A)
FMN  A 200 (-3.8A)
FMN  A 200 (-4.3A)
FMN  A 200 (-3.9A)
1.22A 4r3aB-3t50A:
15.5
4r3aB-3t50A:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t50 BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE


(Brucella
melitensis)
PF13426
(PAS_9)
8 CYH A  69
ARG A  70
ILE A  89
ILE A  99
ASN A 101
ASN A 111
LEU A 113
GLN A 132
FMN  A 200 (-3.4A)
FMN  A 200 (-3.9A)
FMN  A 200 (-4.5A)
FMN  A 200 ( 4.4A)
FMN  A 200 (-3.1A)
FMN  A 200 (-3.8A)
FMN  A 200 (-4.3A)
FMN  A 200 (-3.9A)
0.73A 4r3aB-3t50A:
15.5
4r3aB-3t50A:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u4c BACILYSIN
BIOSYNTHESIS
OXIDOREDUCTASE YWFH


(Bacillus
subtilis)
PF13561
(adh_short_C2)
5 ALA A 237
ALA A  18
ILE A  19
ILE A  47
LEU A  30
None
0.96A 4r3aB-3u4cA:
undetectable
4r3aB-3u4cA:
21.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ue6 AUREOCHROME1

(Vaucheria
frigida)
PF13426
(PAS_9)
6 ARG A 255
ILE A 274
ASN A 286
ASN A 296
GLY A 315
GLN A 317
FMN  A 500 (-3.6A)
FMN  A 500 (-4.9A)
FMN  A 500 (-3.3A)
FMN  A 500 (-4.3A)
FMN  A 500 (-3.7A)
FMN  A 500 (-4.1A)
0.57A 4r3aB-3ue6A:
15.1
4r3aB-3ue6A:
19.84
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.
3ue6 AUREOCHROME1

(Vaucheria
frigida)
PF13426
(PAS_9)
6 CYH A 254
ARG A 255
ILE A 274
ASN A 296
GLY A 315
GLN A 317
FMN  A 500 (-3.5A)
FMN  A 500 (-3.6A)
FMN  A 500 (-4.9A)
FMN  A 500 (-4.3A)
FMN  A 500 (-3.7A)
FMN  A 500 (-4.1A)
0.85A 4r3aB-3ue6A:
15.1
4r3aB-3ue6A:
19.84
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.
3w21 PUTATIVE
UNCHARACTERIZED
PROTEIN


(Burkholderia
ambifaria)
no annotation 5 ALA A  24
ILE A  27
ILE A  42
LEU A 237
GLY A 180
None
0.85A 4r3aB-3w21A:
undetectable
4r3aB-3w21A:
19.95
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.
3wj2 CARBOXYLESTERASE

(Ferroplasma
acidiphilum)
PF07859
(Abhydrolase_3)
5 ALA A 153
ALA A 103
ILE A 110
LEU A 308
GLY A 151
None
0.99A 4r3aB-3wj2A:
undetectable
4r3aB-3wj2A:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4af0 INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE


(Cryptococcus
neoformans)
PF00478
(IMPDH)
PF00571
(CBS)
5 ALA B  73
ALA B 262
ILE B 108
ILE B 304
GLY B 334
None
0.92A 4r3aB-4af0B:
undetectable
4r3aB-4af0B:
21.66
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.
4cby HISTONE DEACETYLASE
4


(Homo sapiens)
PF00850
(Hist_deacetyl)
5 ALA A 935
LEU A 948
ALA A 893
ASN A1010
GLY A 945
None
1.00A 4r3aB-4cbyA:
undetectable
4r3aB-4cbyA:
21.38
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.
4crm TRANSLATION
INITIATION FACTOR
RLI1


(Saccharomyces
cerevisiae)
PF00005
(ABC_tran)
PF00037
(Fer4)
PF04068
(RLI)
5 ALA P   9
ILE P  10
ASN P  78
LEU P  79
GLY P 302
None
0.99A 4r3aB-4crmP:
undetectable
4r3aB-4crmP:
21.31
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.
4cza NA+/H+ ANTIPORTER,
PUTATIVE


(Pyrococcus
abyssi)
PF00999
(Na_H_Exchanger)
5 ALA A 169
LEU A 173
ALA A 370
ILE A 125
GLY A 119
None
0.98A 4r3aB-4czaA:
undetectable
4r3aB-4czaA:
23.66
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.
4e69 2-DEHYDRO-3-DEOXYGLU
CONOKINASE


(Oceanicola
granulosus)
PF00294
(PfkB)
5 ALA A 147
LEU A 116
ALA A 159
ILE A 158
LEU A 133
None
0.95A 4r3aB-4e69A:
undetectable
4r3aB-4e69A:
24.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ees PHOTOTROPIN-2

(Arabidopsis
thaliana)
PF13426
(PAS_9)
7 ARG A 427
ILE A 446
ASN A 458
ASN A 468
LEU A 470
GLY A 487
GLN A 489
FMN  A1001 (-3.8A)
FMN  A1001 (-4.6A)
FMN  A1001 (-3.0A)
FMN  A1001 (-3.9A)
FMN  A1001 (-4.2A)
FMN  A1001 (-3.8A)
FMN  A1001 (-3.9A)
0.44A 4r3aB-4eesA:
15.8
4r3aB-4eesA:
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.
4f92 U5 SMALL NUCLEAR
RIBONUCLEOPROTEIN
200 KDA HELICASE


(Homo sapiens)
PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63)
5 ALA B 471
ARG B 558
ALA B 513
ILE B 585
GLY B 522
None
1.02A 4r3aB-4f92B:
undetectable
4r3aB-4f92B:
11.84
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.
4fsf PENICILLIN-BINDING
PROTEIN 3


(Pseudomonas
aeruginosa)
PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
5 ALA A 306
ALA A 358
ILE A 361
ILE A 345
LEU A 342
None
0.94A 4r3aB-4fsfA:
3.5
4r3aB-4fsfA:
23.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gcz BLUE-LIGHT
PHOTORECEPTOR,
SENSOR PROTEIN FIXL


(Bacillus
subtilis;
Bradyrhizobium
diazoefficiens)
PF00512
(HisKA)
PF02518
(HATPase_c)
PF13426
(PAS_9)
8 CYH A  62
ARG A  63
ILE A  92
ASN A  94
ASN A 104
LEU A 106
GLY A 121
GLN A 123
FMN  A 401 (-3.3A)
FMN  A 401 (-3.9A)
FMN  A 401 ( 4.6A)
FMN  A 401 (-3.1A)
FMN  A 401 (-3.7A)
FMN  A 401 (-4.3A)
FMN  A 401 (-3.7A)
FMN  A 401 (-3.8A)
0.72A 4r3aB-4gczA:
14.4
4r3aB-4gczA:
31.44
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.
4hhd PHOTOTROPIN-1

(Arabidopsis
thaliana)
PF13426
(PAS_9)
7 CYH A 512
ARG A 513
ILE A 532
ASN A 544
ASN A 554
GLY A 573
GLN A 575
FMN  A 701 (-3.7A)
FMN  A 701 (-2.6A)
FMN  A 701 (-4.7A)
FMN  A 701 (-2.8A)
FMN  A 701 (-3.8A)
FMN  A 701 (-3.7A)
FMN  A 701 (-3.6A)
0.75A 4r3aB-4hhdA:
16.8
4r3aB-4hhdA:
20.51
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.
4hj3 LOV PROTEIN

(Rhodobacter
sphaeroides)
PF13426
(PAS_9)
8 LEU A  32
CYH A  55
ARG A  56
ASN A  87
ASN A  97
LEU A  99
GLY A 116
GLN A 118
None
FMN  A 201 (-3.7A)
FMN  A 201 (-3.4A)
FMN  A 201 (-2.9A)
FMN  A 201 (-3.8A)
FMN  A 201 (-4.4A)
FMN  A 201 (-3.9A)
FMN  A 201 (-3.8A)
0.78A 4r3aB-4hj3A:
13.9
4r3aB-4hj3A:
24.29
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.
4lb8 UNCHARACTERIZED
PROTEIN


(Bacteroides
thetaiotaomicron)
PF16140
(DUF4848)
5 ALA A 214
LEU A 205
ALA A 265
ILE A 266
GLY A 280
None
None
None
PEG  A 406 (-4.6A)
None
0.98A 4r3aB-4lb8A:
undetectable
4r3aB-4lb8A:
23.37
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.
4mbu SIMILAR TO
N-ACETYLTRANSFERASE


(Staphylococcus
aureus)
PF13420
(Acetyltransf_4)
5 ALA A 155
LEU A 154
ALA A 125
ILE A 127
ILE A  84
None
1.02A 4r3aB-4mbuA:
undetectable
4r3aB-4mbuA:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mp3 PUTATIVE ORNITHINE
CYCLODEAMINASE


(Staphylococcus
aureus)
PF02423
(OCD_Mu_crystall)
5 ALA A  27
ALA A  73
ILE A  68
ILE A 110
LEU A 101
None
0.98A 4r3aB-4mp3A:
undetectable
4r3aB-4mp3A:
23.11
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.
4nuq CADHERIN-2

(Mus musculus)
PF00028
(Cadherin)
5 LEU A  66
ILE A  52
ILE A  94
LEU A  76
GLY A  42
None
1.01A 4r3aB-4nuqA:
undetectable
4r3aB-4nuqA:
20.06
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.
4oou BETA-1,4-MANNANASE

(Cryptopygus
antarcticus)
no annotation 5 ALA B 266
ILE B 222
ILE B 156
ASN B 153
LEU B 152
None
1.02A 4r3aB-4oouB:
undetectable
4r3aB-4oouB:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oqj PKS

(Streptomyces
albus)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc)
5 ALA A 200
ALA A  21
ILE A  20
ILE A 382
LEU A 378
None
0.99A 4r3aB-4oqjA:
undetectable
4r3aB-4oqjA:
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.
4p05 ARYLSULFATE
SULFOTRANSFERASE
ASST


(Escherichia
coli)
PF05935
(Arylsulfotrans)
PF17425
(Arylsulfotran_N)
5 LEU A 316
ALA A 392
ASN A 358
ASN A 436
GLY A 452
None
None
4NS  A 601 (-3.6A)
4NS  A 601 (-3.3A)
None
0.87A 4r3aB-4p05A:
undetectable
4r3aB-4p05A:
20.84
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.
4q66 PROTEIN BCH1

(Saccharomyces
cerevisiae)
no annotation 5 LEU K 551
ALA K 480
ILE K 395
GLY K 589
GLN K 489
None
0.85A 4r3aB-4q66K:
undetectable
4r3aB-4q66K:
18.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r38 BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2


(Erythrobacter
litoralis)
PF13426
(PAS_9)
7 ALA A  23
LEU A  32
CYH A  55
ALA A  72
ILE A  75
ILE A  85
ASN A  87
RBF  A 201 ( 3.4A)
None
RBF  A 201 (-3.3A)
RBF  A 201 ( 3.3A)
RBF  A 201 (-4.2A)
RBF  A 201 ( 4.2A)
RBF  A 201 (-2.4A)
1.33A 4r3aB-4r38A:
16.8
4r3aB-4r38A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r38 BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2


(Erythrobacter
litoralis)
PF13426
(PAS_9)
12 ALA A  23
LEU A  32
CYH A  55
ARG A  56
ALA A  72
ILE A  75
ILE A  85
ASN A  87
ASN A  97
LEU A  99
GLY A 116
GLN A 118
RBF  A 201 ( 3.4A)
None
RBF  A 201 (-3.3A)
RBF  A 201 (-3.7A)
RBF  A 201 ( 3.3A)
RBF  A 201 (-4.2A)
RBF  A 201 ( 4.2A)
RBF  A 201 (-2.4A)
RBF  A 201 (-3.7A)
RBF  A 201 (-4.2A)
RBF  A 201 ( 3.3A)
RBF  A 201 (-4.0A)
0.48A 4r3aB-4r38A:
16.8
4r3aB-4r38A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r38 BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2


(Erythrobacter
litoralis)
PF13426
(PAS_9)
6 ALA A  23
LEU A  32
CYH A  55
ARG A  56
ILE A  75
ASN A  97
RBF  A 201 ( 3.4A)
None
RBF  A 201 (-3.3A)
RBF  A 201 (-3.7A)
RBF  A 201 (-4.2A)
RBF  A 201 (-3.7A)
1.05A 4r3aB-4r38A:
16.8
4r3aB-4r38A:
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.
4ru0 PUTATIVE
BRANCHED-CHAIN AMINO
ACID ABC
TRANSPORTER,
PERIPLASMIC
BRANCHED-CHAIN AMINO
ACID-BINDING PROTEIN


(Pseudomonas
protegens)
PF13458
(Peripla_BP_6)
5 ALA A 334
ILE A 129
ILE A 364
LEU A 381
GLN A 379
None
1.00A 4r3aB-4ru0A:
undetectable
4r3aB-4ru0A:
23.01
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.
4ufc GH95

(Bacteroides
ovatus)
PF14498
(Glyco_hyd_65N_2)
5 LEU A 684
ALA A 382
ASN A 714
ASN A 734
GLY A 708
None
0.89A 4r3aB-4ufcA:
undetectable
4r3aB-4ufcA:
17.84
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.
4wn9 NITROGENASE
MOLYBDENUM-IRON
PROTEIN ALPHA CHAIN


(Clostridium
pasteurianum)
PF00148
(Oxidored_nitro)
5 ARG A 297
ALA A 317
ILE A 320
ILE A 232
GLY A 492
None
1.01A 4r3aB-4wn9A:
undetectable
4r3aB-4wn9A:
19.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wuj GLYCOSIDE HYDROLASE
FAMILY 15, CELLULOSE
SIGNALING ASSOCIATED
PROTEIN ENVOY


(Trichoderma
reesei)
PF13426
(PAS_9)
7 ALA A 200
ILE A 161
ILE A 171
ASN A 173
ASN A 183
GLY A 202
GLN A 204
FMN  A5201 (-2.8A)
FMN  A5201 (-3.8A)
FMN  A5201 ( 4.4A)
FMN  A5201 (-2.4A)
FMN  A5201 (-4.1A)
FMN  A5201 (-3.0A)
FMN  A5201 (-3.7A)
1.42A 4r3aB-4wujA:
12.2
4r3aB-4wujA:
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.
4wuj GLYCOSIDE HYDROLASE
FAMILY 15, CELLULOSE
SIGNALING ASSOCIATED
PROTEIN ENVOY


(Trichoderma
reesei)
PF13426
(PAS_9)
8 CYH A 135
ARG A 136
ILE A 161
ILE A 171
ASN A 173
ASN A 183
GLY A 202
GLN A 204
FMN  A5201 (-3.5A)
FMN  A5201 (-3.7A)
FMN  A5201 (-3.8A)
FMN  A5201 ( 4.4A)
FMN  A5201 (-2.4A)
FMN  A5201 (-4.1A)
FMN  A5201 (-3.0A)
FMN  A5201 (-3.7A)
0.70A 4r3aB-4wujA:
12.2
4r3aB-4wujA:
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.
4wz9 AGAP004809-PA

(Anopheles
gambiae)
PF01433
(Peptidase_M1)
PF11838
(ERAP1_C)
5 ALA A 264
ALA A 323
ILE A 322
GLY A 336
GLN A 371
None
0.89A 4r3aB-4wz9A:
undetectable
4r3aB-4wz9A:
16.72
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.
4wz9 AGAP004809-PA

(Anopheles
gambiae)
PF01433
(Peptidase_M1)
PF11838
(ERAP1_C)
5 ALA A 323
ILE A 322
ILE A 364
GLY A 336
GLN A 371
None
1.01A 4r3aB-4wz9A:
undetectable
4r3aB-4wz9A:
16.72
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.
5a8b PTAUREO1A LOV2
DOMAIN


(Phaeodactylum
tricornutum)
PF13426
(PAS_9)
6 ARG A 288
ILE A 307
ASN A 319
ASN A 329
GLY A 348
GLN A 350
FMN  A 500 (-4.1A)
FMN  A 500 (-4.8A)
FMN  A 500 (-3.0A)
FMN  A 500 (-4.2A)
FMN  A 500 (-3.8A)
FMN  A 500 (-3.9A)
0.53A 4r3aB-5a8bA:
14.0
4r3aB-5a8bA:
18.68
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.
5a8b PTAUREO1A LOV2
DOMAIN


(Phaeodactylum
tricornutum)
PF13426
(PAS_9)
6 CYH A 287
ARG A 288
ILE A 307
ASN A 319
GLY A 348
GLN A 350
FMN  A 500 (-3.6A)
FMN  A 500 (-4.1A)
FMN  A 500 (-4.8A)
FMN  A 500 (-3.0A)
FMN  A 500 (-3.8A)
FMN  A 500 (-3.9A)
0.81A 4r3aB-5a8bA:
14.0
4r3aB-5a8bA:
18.68
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.
5dju NPH1-2

(Avena sativa)
PF13426
(PAS_9)
6 ARG A 451
ILE A 470
ASN A 482
ASN A 492
GLY A 511
GLN A 513
FMN  A 601 ( 3.8A)
CL  A 603 (-4.4A)
FMN  A 601 (-3.1A)
FMN  A 601 (-3.9A)
FMN  A 601 (-3.8A)
FMN  A 601 (-3.8A)
0.38A 4r3aB-5djuA:
17.9
4r3aB-5djuA:
21.18
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.
5dkk LOV DOMAIN

(Phaeodactylum
tricornutum)
PF13426
(PAS_9)
7 CYH A 287
ARG A 288
ILE A 307
ASN A 319
ASN A 329
GLY A 348
GLN A 350
FMN  A 401 (-3.4A)
FMN  A 401 (-4.1A)
FMN  A 401 (-4.6A)
FMN  A 401 (-3.0A)
FMN  A 401 (-4.1A)
FMN  A 401 (-3.7A)
FMN  A 401 (-3.8A)
0.83A 4r3aB-5dkkA:
14.4
4r3aB-5dkkA:
18.47
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.
5fd4 COMR

(Streptococcus
suis)
PF13560
(HTH_31)
5 ALA A  22
ARG A  14
ALA A  60
ILE A  44
LEU A  41
None
1.02A 4r3aB-5fd4A:
undetectable
4r3aB-5fd4A:
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.
5fmg PROTEASOME SUBUNIT
BETA TYPE
PROTEASOME, PUTATIVE


(Plasmodium
falciparum)
PF00227
(Proteasome)
5 ALA H 166
ALA N  35
LEU N  58
GLY H 171
GLN N  62
None
0.83A 4r3aB-5fmgH:
undetectable
4r3aB-5fmgH:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hzh RAS-RELATED C3
BOTULINUM TOXIN
SUBSTRATE
1,NPH1-1,RAS-RELATED
C3 BOTULINUM TOXIN
SUBSTRATE 1


(Avena sativa;
Homo sapiens)
PF00071
(Ras)
PF13426
(PAS_9)
6 ARG A  98
ILE A 117
ASN A 129
ASN A 139
GLY A 158
GLN A 160
FMN  A 402 (-3.3A)
FMN  A 402 (-4.8A)
FMN  A 402 (-2.9A)
FMN  A 402 (-4.2A)
FMN  A 402 (-3.7A)
FMN  A 402 (-3.6A)
0.46A 4r3aB-5hzhA:
18.2
4r3aB-5hzhA:
26.18
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.
5hzk INTERSECTIN-1,NPH1-1
,INTERSECTIN-1


(Avena sativa;
Homo sapiens)
PF00621
(RhoGEF)
PF13426
(PAS_9)
PF16652
(PH_13)
6 ARG B1356
ILE B1375
ASN B1387
ASN B1397
GLY B1416
GLN B1418
FMN  B1801 (-3.9A)
FMN  B1801 (-4.9A)
FMN  B1801 (-3.0A)
FMN  B1801 (-4.2A)
FMN  B1801 (-3.7A)
FMN  B1801 (-3.7A)
0.50A 4r3aB-5hzkB:
18.1
4r3aB-5hzkB:
26.42
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.
5hzk INTERSECTIN-1,NPH1-1
,INTERSECTIN-1


(Avena sativa;
Homo sapiens)
PF00621
(RhoGEF)
PF13426
(PAS_9)
PF16652
(PH_13)
5 CYH B1355
ARG B1356
ILE B1375
GLY B1416
GLN B1418
FMN  B1801 (-3.5A)
FMN  B1801 (-3.9A)
FMN  B1801 (-4.9A)
FMN  B1801 (-3.7A)
FMN  B1801 (-3.7A)
0.95A 4r3aB-5hzkB:
18.1
4r3aB-5hzkB:
26.42
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.
5icq METHYLOCYSTIS PARVUS
OBBP MBNE


(Methylocystis
parvus)
PF00496
(SBP_bac_5)
5 LEU A  70
ALA A 579
ILE A 584
LEU A 602
GLY A 599
None
0.98A 4r3aB-5icqA:
undetectable
4r3aB-5icqA:
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.
5it5 ATP BINDING
MOTIF-CONTAINING
PROTEIN PILF


(Thermus
thermophilus)
no annotation 5 ARG F 754
ALA F 851
ILE F 765
LEU F 769
GLY F 771
None
0.96A 4r3aB-5it5F:
2.8
4r3aB-5it5F:
21.18
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.
5j3w SENSORY BOX PROTEIN

(Pseudomonas
putida)
PF13426
(PAS_9)
9 ALA A  21
LEU A  30
CYH A  53
ARG A  54
ASN A  85
ASN A  95
LEU A  97
GLY A 114
GLN A 116
FMN  A 500 (-3.6A)
None
FMN  A 500 (-3.6A)
FMN  A 500 (-3.5A)
FMN  A 500 (-3.0A)
FMN  A 500 (-4.3A)
FMN  A 500 (-4.2A)
FMN  A 500 (-3.8A)
FMN  A 500 (-4.5A)
0.63A 4r3aB-5j3wA:
13.4
4r3aB-5j3wA:
20.11
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.
5j6s ENDOPLASMIC
RETICULUM
AMINOPEPTIDASE 2


(Homo sapiens)
PF01433
(Peptidase_M1)
PF11838
(ERAP1_C)
5 ALA A 265
ALA A 327
ILE A 326
GLY A 340
GLN A 375
None
0.93A 4r3aB-5j6sA:
undetectable
4r3aB-5j6sA:
15.82
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.
5m0y CELLULOSOME
ANCHORING PROTEIN
COHESIN REGION
IG DOMAIN PROTEIN
GROUP 2 DOMAIN
PROTEIN


(Ruminiclostridium
thermocellum)
PF00963
(Cohesin)
no annotation
5 ALA A 110
LEU A 109
ALA B 151
ILE B 150
GLY A  91
None
1.01A 4r3aB-5m0yA:
undetectable
4r3aB-5m0yA:
19.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mfb YIII(DQ)4CQI

(synthetic
construct)
PF00514
(Arm)
5 ALA A 180
ALA A 204
ILE A 203
ASN A 169
ASN A 210
None
0.98A 4r3aB-5mfbA:
undetectable
4r3aB-5mfbA:
23.25
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.
5ng6 CRISPR-ASSOCIATED
ENDONUCLEASE CPF1


(Francisella
tularensis)
no annotation 5 ALA A 459
LEU A 460
ILE A 542
LEU A 399
GLY A 414
None
0.81A 4r3aB-5ng6A:
undetectable
4r3aB-5ng6A:
13.63
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.
5no7 LYTIC POLYSACCHARIDE
MONOOXYGENASE


(Trametes
cinnabarina)
no annotation 5 ALA A 242
ILE A 241
ILE A 165
GLY A 172
GLN A 174
BMA  A 321 ( 4.4A)
MAN  A 322 (-4.7A)
None
None
None
0.99A 4r3aB-5no7A:
undetectable
4r3aB-5no7A:
13.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5svw ADAGIO PROTEIN 1

(Arabidopsis
thaliana)
no annotation 7 CYH B  54
ARG B  55
ILE B  83
ASN B  95
ASN B 105
LEU B 107
GLN B 126
FMN  B5201 (-3.3A)
FMN  B5201 (-3.8A)
FMN  B5201 (-4.2A)
FMN  B5201 (-2.4A)
FMN  B5201 (-3.8A)
FMN  B5201 ( 4.5A)
FMN  B5201 (-3.8A)
0.95A 4r3aB-5svwB:
13.9
4r3aB-5svwB:
19.60
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.
5svw ADAGIO PROTEIN 1

(Arabidopsis
thaliana)
no annotation 7 CYH B  54
ARG B  55
ILE B  83
ASN B  95
ASN B 105
LEU B 107
GLY B 124
FMN  B5201 (-3.3A)
FMN  B5201 (-3.8A)
FMN  B5201 (-4.2A)
FMN  B5201 (-2.4A)
FMN  B5201 (-3.8A)
FMN  B5201 ( 4.5A)
FMN  B5201 (-3.0A)
0.63A 4r3aB-5svwB:
13.9
4r3aB-5svwB:
19.60
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.
5xoe ATP-DEPENDENT
6-PHOSPHOFRUCTOKINAS
E


(Staphylococcus
aureus)
no annotation 5 LEU A 276
ALA A   5
ILE A   4
ILE A 100
GLY A 271
None
1.01A 4r3aB-5xoeA:
undetectable
4r3aB-5xoeA:
13.43
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.
5xxo PERIPLASMIC
BETA-GLUCOSIDASE


(Bacteroides
thetaiotaomicron)
no annotation 5 LEU A 410
ALA A 419
ILE A 418
LEU A 447
GLY A 587
None
0.83A 4r3aB-5xxoA:
undetectable
4r3aB-5xxoA:
18.29
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.
6bv2 AMINOPEPTIDASE N

(Sus scrofa)
no annotation 5 ALA A 276
ALA A 340
ILE A 339
GLY A 353
GLN A 388
None
0.90A 4r3aB-6bv2A:
undetectable
4r3aB-6bv2A:
14.66
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.
6bv2 AMINOPEPTIDASE N

(Sus scrofa)
no annotation 5 ALA A 340
ILE A 339
ILE A 381
GLY A 353
GLN A 388
None
0.99A 4r3aB-6bv2A:
undetectable
4r3aB-6bv2A:
14.66
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.
6c6l V-TYPE PROTON ATPASE
SUBUNIT A, VACUOLAR
ISOFORM
V-TYPE PROTON ATPASE
SUBUNIT C'
V-TYPE PROTON ATPASE
SUBUNIT C''


(Saccharomyces
cerevisiae)
no annotation 5 ALA D  77
LEU D  74
ALA C 206
ILE A 613
LEU A 617
None
0.96A 4r3aB-6c6lD:
undetectable
4r3aB-6c6lD:
11.66
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.
6gbv PUTATIVE BLUE-LIGHT
PHOTORECEPTOR


(Dinoroseobacter
shibae)
no annotation 8 CYH A  72
ARG A  73
ILE A 102
ASN A 104
ASN A 114
LEU A 116
GLY A 133
GLN A 135
FMN  A 500 (-3.7A)
FMN  A 500 (-4.5A)
FMN  A 500 ( 4.3A)
FMN  A 500 (-3.0A)
FMN  A 500 (-4.0A)
FMN  A 500 (-4.1A)
FMN  A 500 (-3.9A)
FMN  A 500 (-3.8A)
0.65A 4r3aB-6gbvA:
14.8
4r3aB-6gbvA:
undetectable