SIMILAR PATTERNS OF AMINO ACIDS FOR 5VKQ_B_PCFB1805_0

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.
1ci6 TRANSCRIPTION FACTOR
ATF-4

(Homo sapiens) 		PF00170
(bZIP_1) 		4 LEU A 320
LYS A 321
ALA A 324
LEU A 327
 None
 0.70A 5vkqA-1ci6A:
undetectable
5vkqB-1ci6A:
undetectable		 5vkqA-1ci6A:
3.17
5vkqB-1ci6A:
3.17
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.
1gey HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		4 LEU A  91
LEU A 227
ALA A 207
LEU A 206
 None
 0.87A 5vkqA-1geyA:
0.0
5vkqB-1geyA:
0.0		 5vkqA-1geyA:
11.73
5vkqB-1geyA:
11.73
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.
1hl2 N-ACETYLNEURAMINATE
LYASE SUBUNIT

(Escherichia
coli) 		PF00701
(DHDPS) 		4 LEU A 285
LYS A 286
ALA A 289
LEU A 292
 None
 0.85A 5vkqA-1hl2A:
0.0
5vkqB-1hl2A:
0.0		 5vkqA-1hl2A:
10.72
5vkqB-1hl2A:
10.72
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.
1io0 TROPOMODULIN

(Gallus gallus) 		no annotation 4 LEU A 213
LYS A 214
ALA A 217
LEU A 220
 None
 0.82A 5vkqA-1io0A:
0.1
5vkqB-1io0A:
0.2		 5vkqA-1io0A:
7.67
5vkqB-1io0A:
7.67
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.
1iuq GLYCEROL-3-PHOSPHATE
ACYLTRANSFERASE

(Cucurbita
moschata) 		PF01553
(Acyltransferase)
PF14829
(GPAT_N) 		4 LEU A 213
LYS A 214
ALA A 217
LEU A 220
 None
 0.53A 5vkqA-1iuqA:
0.0
5vkqB-1iuqA:
0.0		 5vkqA-1iuqA:
12.42
5vkqB-1iuqA:
12.42
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.
1la2 MYO-INOSITOL-1-PHOSP
HATE SYNTHASE

(Saccharomyces
cerevisiae) 		PF01658
(Inos-1-P_synth)
PF07994
(NAD_binding_5) 		4 LEU A 164
LEU A  81
ALA A  83
LEU A  86
 None
 0.72A 5vkqA-1la2A:
0.0
5vkqB-1la2A:
0.0		 5vkqA-1la2A:
15.58
5vkqB-1la2A:
15.58
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.
1nrw HYPOTHETICAL
PROTEIN, HALOACID
DEHALOGENASE-LIKE
HYDROLASE

(Bacillus
subtilis) 		PF08282
(Hydrolase_3) 		4 LEU A 229
LYS A 219
ALA A 222
LEU A 225
 None
 0.82A 5vkqA-1nrwA:
0.0
5vkqB-1nrwA:
0.0		 5vkqA-1nrwA:
11.46
5vkqB-1nrwA:
11.46
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.
1nw1 CHOLINE KINASE (49.2
KD)

(Caenorhabditis
elegans) 		PF01633
(Choline_kinase) 		5 LEU A  76
LEU A  52
LYS A  53
ALA A  56
LEU A  59
 None
 1.17A 5vkqA-1nw1A:
2.1
5vkqB-1nw1A:
2.1		 5vkqA-1nw1A:
13.40
5vkqB-1nw1A:
13.40
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.
1sj7 TALIN 1

(Mus musculus) 		PF09141
(Talin_middle) 		5 LEU A 609
LEU A 593
LYS A 592
ALA A 595
LEU A 598
 None
 1.39A 5vkqA-1sj7A:
3.5
5vkqB-1sj7A:
3.5		 5vkqA-1sj7A:
7.73
5vkqB-1sj7A:
7.73
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.
1svv THREONINE ALDOLASE

(Leishmania
major) 		PF01212
(Beta_elim_lyase) 		4 LEU A 232
LYS A 233
ALA A 236
LEU A 239
 None
 0.84A 5vkqA-1svvA:
0.0
5vkqB-1svvA:
0.0		 5vkqA-1svvA:
12.70
5vkqB-1svvA:
12.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t5o TRANSLATION
INITIATION FACTOR
EIF2B, SUBUNIT DELTA

(Archaeoglobus
fulgidus) 		PF01008
(IF-2B) 		4 LEU A  77
LYS A  78
ALA A  81
LEU A  84
 None
 0.70A 5vkqA-1t5oA:
2.3
5vkqB-1t5oA:
2.3		 5vkqA-1t5oA:
12.03
5vkqB-1t5oA:
12.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vl8 GLUCONATE
5-DEHYDROGENASE

(Thermotoga
maritima) 		PF13561
(adh_short_C2) 		4 LEU A 226
LYS A 227
ALA A 230
LEU A 233
 None
 0.87A 5vkqA-1vl8A:
undetectable
5vkqB-1vl8A:
undetectable		 5vkqA-1vl8A:
10.14
5vkqB-1vl8A:
10.14
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.
1wdy 2-5A-DEPENDENT
RIBONUCLEASE

(Homo sapiens) 		PF12796
(Ank_2)
PF13857
(Ank_5) 		4 LEU A 285
LYS A 286
ALA A 289
LEU A 292
 None
 0.70A 5vkqA-1wdyA:
23.9
5vkqB-1wdyA:
17.0		 5vkqA-1wdyA:
10.93
5vkqB-1wdyA:
10.93
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.
1wiw GLUCOSE-6-PHOSPHATE
ISOMERASE LIKE
PROTEIN

(Thermus
thermophilus) 		PF10432
(bact-PGI_C) 		4 LEU A 118
LEU A  42
ALA A  51
LEU A  52
 None
 0.80A 5vkqA-1wiwA:
undetectable
5vkqB-1wiwA:
undetectable		 5vkqA-1wiwA:
11.52
5vkqB-1wiwA:
11.52
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.
1x7p RRNA
METHYLTRANSFERASE

(Streptomyces
viridochromogenes) 		PF00588
(SpoU_methylase) 		4 LEU A 180
LEU A 150
ALA A 152
LEU A 127
 None
 0.86A 5vkqA-1x7pA:
undetectable
5vkqB-1x7pA:
undetectable		 5vkqA-1x7pA:
10.91
5vkqB-1x7pA:
10.91
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.
1y4c MALTOSE BINDING
PROTEIN FUSED WITH
DESIGNED HELICAL
PROTEIN

(Escherichia
coli) 		PF13416
(SBP_bac_8) 		4 LEU A 556
LEU A 644
ALA A 648
LEU A 651
 None
 0.74A 5vkqA-1y4cA:
5.1
5vkqB-1y4cA:
5.1		 5vkqA-1y4cA:
15.21
5vkqB-1y4cA:
15.21
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.
1y4c MALTOSE BINDING
PROTEIN FUSED WITH
DESIGNED HELICAL
PROTEIN

(Escherichia
coli) 		PF13416
(SBP_bac_8) 		4 LEU A 583
LEU A 617
ALA A 621
LEU A 624
 None
 0.85A 5vkqA-1y4cA:
5.1
5vkqB-1y4cA:
5.1		 5vkqA-1y4cA:
15.21
5vkqB-1y4cA:
15.21
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.
1yrw PROTEIN ARNA

(Escherichia
coli) 		PF00551
(Formyl_trans_N)
PF02911
(Formyl_trans_C) 		4 LEU A  14
LEU A 165
ALA A 169
LEU A 172
 None
 0.81A 5vkqA-1yrwA:
undetectable
5vkqB-1yrwA:
undetectable		 5vkqA-1yrwA:
11.52
5vkqB-1yrwA:
11.52
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.
1yz6 PROBABLE TRANSLATION
INITIATION FACTOR 2
ALPHA SUBUNIT

(Pyrococcus
abyssi) 		PF00575
(S1)
PF07541
(EIF_2_alpha) 		4 LEU A 107
LYS A 108
ALA A 111
LEU A 114
 None
 0.80A 5vkqA-1yz6A:
undetectable
5vkqB-1yz6A:
undetectable		 5vkqA-1yz6A:
9.42
5vkqB-1yz6A:
9.42
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.
1yz7 PROBABLE TRANSLATION
INITIATION FACTOR 2
ALPHA SUBUNIT

(Pyrococcus
abyssi) 		PF07541
(EIF_2_alpha) 		4 LEU A 107
LYS A 108
ALA A 111
LEU A 114
 None
 0.75A 5vkqA-1yz7A:
2.7
5vkqB-1yz7A:
2.7		 5vkqA-1yz7A:
7.27
5vkqB-1yz7A:
7.27
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.
1z7e PROTEIN ARNA

(Escherichia
coli) 		PF00551
(Formyl_trans_N)
PF01370
(Epimerase)
PF02911
(Formyl_trans_C) 		4 LEU A  14
LEU A 165
ALA A 169
LEU A 172
 None
 0.85A 5vkqA-1z7eA:
2.1
5vkqB-1z7eA:
undetectable		 5vkqA-1z7eA:
17.19
5vkqB-1z7eA:
17.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zzm PUTATIVE
DEOXYRIBONUCLEASE
YJJV

(Escherichia
coli) 		PF01026
(TatD_DNase) 		4 LEU A 122
LYS A 121
ALA A 123
LEU A 128
 None
 0.87A 5vkqA-1zzmA:
undetectable
5vkqB-1zzmA:
undetectable		 5vkqA-1zzmA:
10.03
5vkqB-1zzmA:
10.03
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.
2a7w PHOSPHORIBOSYL-ATP
PYROPHOSPHATASE

(Chromobacterium
violaceum) 		PF01503
(PRA-PH) 		4 LEU A   6
LYS A   7
ALA A  10
LEU A  13
 None
 0.83A 5vkqA-2a7wA:
3.5
5vkqB-2a7wA:
3.5		 5vkqA-2a7wA:
5.25
5vkqB-2a7wA:
5.25
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.
2bb6 TRANSCOBALAMIN II

(Bos taurus) 		PF01122
(Cobalamin_bind) 		4 LEU A 113
LEU A 144
ALA A  88
LEU A  89
 None
 0.82A 5vkqA-2bb6A:
2.1
5vkqB-2bb6A:
2.0		 5vkqA-2bb6A:
13.87
5vkqB-2bb6A:
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.
2bjs ISOPENICILLIN N
SYNTHETASE

(Aspergillus
nidulans) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		4 LEU A 157
LYS A 158
ALA A 161
LEU A 164
 None
 0.70A 5vkqA-2bjsA:
undetectable
5vkqB-2bjsA:
undetectable		 5vkqA-2bjsA:
10.80
5vkqB-2bjsA:
10.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cu6 DTDP-4-KETO-L-RHAMNO
SE REDUCTASE-RELATED
PROTEIN

(Thermus
thermophilus) 		PF01883
(FeS_assembly_P) 		4 LEU A  36
LEU A   7
ALA A  11
LEU A  14
 None
 0.83A 5vkqA-2cu6A:
undetectable
5vkqB-2cu6A:
undetectable		 5vkqA-2cu6A:
4.91
5vkqB-2cu6A:
4.91
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.
2cw5 BACTERIAL
FLUORINATING ENZYME
HOMOLOG

(Thermus
thermophilus) 		PF01887
(SAM_adeno_trans) 		4 LEU A 179
LEU A  45
ALA A  49
LEU A  52
 None
 0.84A 5vkqA-2cw5A:
undetectable
5vkqB-2cw5A:
undetectable		 5vkqA-2cw5A:
9.79
5vkqB-2cw5A:
9.79
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.
2dxa PROTEIN YBAK

(Escherichia
coli) 		PF04073
(tRNA_edit) 		4 LEU A  72
LYS A  73
ALA A  76
LEU A  79
 CL  A1201 (-3.9A)
None
None
None
 0.77A 5vkqA-2dxaA:
undetectable
5vkqB-2dxaA:
undetectable		 5vkqA-2dxaA:
7.60
5vkqB-2dxaA:
7.60
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.
2f1s VIRAL CASP8 AND
FADD-LIKE APOPTOSIS
REGULATOR

(Molluscum
contagiosum
virus) 		PF01335
(DED) 		4 LEU A 130
LEU A 115
ALA A 119
LEU A 122
 None
 0.86A 5vkqA-2f1sA:
undetectable
5vkqB-2f1sA:
undetectable		 5vkqA-2f1sA:
7.62
5vkqB-2f1sA:
7.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ldx APO-LACTATE
DEHYDROGENASE

(Mus musculus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 LEU A 315
LYS A 316
ALA A 319
LEU A 322
 None
 0.59A 5vkqA-2ldxA:
undetectable
5vkqB-2ldxA:
undetectable		 5vkqA-2ldxA:
11.79
5vkqB-2ldxA:
11.79
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.
2luh VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN VTA1

(Saccharomyces
cerevisiae) 		PF04652
(Vta1) 		4 LEU A  52
LEU A  27
ALA A  31
LEU A  34
 None
 0.83A 5vkqA-2luhA:
3.4
5vkqB-2luhA:
3.4		 5vkqA-2luhA:
7.09
5vkqB-2luhA:
7.09
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.
2nn6 EXOSOME COMPONENT 6

(Homo sapiens) 		PF01138
(RNase_PH) 		4 LEU F 130
LEU F 179
ALA F 166
LEU F 167
 None
 0.85A 5vkqA-2nn6F:
undetectable
5vkqB-2nn6F:
undetectable		 5vkqA-2nn6F:
10.91
5vkqB-2nn6F:
10.91
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.
2oas 4-HYDROXYBUTYRATE
COENZYME A
TRANSFERASE

(Shewanella
oneidensis) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		4 LEU A 428
LEU A 397
ALA A 401
LEU A 404
 None
 0.77A 5vkqA-2oasA:
undetectable
5vkqB-2oasA:
undetectable		 5vkqA-2oasA:
13.71
5vkqB-2oasA:
13.71
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.
2q6q SPINDLE POLE BODY
COMPONENT SPC42

(Saccharomyces
cerevisiae) 		PF11544
(Spc42p) 		4 LEU A  86
LYS A  87
ALA A  90
LEU A  93
 None
 0.76A 5vkqA-2q6qA:
undetectable
5vkqB-2q6qA:
undetectable		 5vkqA-2q6qA:
3.71
5vkqB-2q6qA:
3.71
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.
2qq6 MANDELATE
RACEMASE/MUCONATE
LACTONIZING
ENZYME-LIKE PROTEIN

(Rubrobacter
xylanophilus) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 LEU A 111
LEU A  96
ALA A 100
LEU A 103
 None
 0.84A 5vkqA-2qq6A:
undetectable
5vkqB-2qq6A:
undetectable		 5vkqA-2qq6A:
13.13
5vkqB-2qq6A:
13.13
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.
2r4q PHOSPHOTRANSFERASE
SYSTEM (PTS)
FRUCTOSE-SPECIFIC
ENZYME IIABC
COMPONENT

(Bacillus
subtilis) 		PF02302
(PTS_IIB) 		4 LEU A 192
LYS A 193
ALA A 196
LEU A 199
 None
 0.76A 5vkqA-2r4qA:
undetectable
5vkqB-2r4qA:
undetectable		 5vkqA-2r4qA:
5.21
5vkqB-2r4qA:
5.21
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.
2vg8 HYDROQUINONE
GLUCOSYLTRANSFERASE

(Arabidopsis
thaliana) 		PF00201
(UDPGT) 		4 LEU A  59
LEU A  23
ALA A  27
LEU A  30
 None
 0.77A 5vkqA-2vg8A:
undetectable
5vkqB-2vg8A:
undetectable		 5vkqA-2vg8A:
14.01
5vkqB-2vg8A:
14.01
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.
2wae PENICILLIN-BINDING
PROTEIN 2B

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		4 LEU A  93
LYS A  94
ALA A  97
LEU A 100
 None
 0.66A 5vkqA-2waeA:
2.1
5vkqB-2waeA:
2.1		 5vkqA-2waeA:
17.60
5vkqB-2waeA:
17.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ygk NURA

(Sulfolobus
solfataricus) 		PF09376
(NurA) 		4 LEU A 162
LEU A 110
ALA A 114
LEU A 117
 None
 0.80A 5vkqA-2ygkA:
undetectable
5vkqB-2ygkA:
undetectable		 5vkqA-2ygkA:
11.95
5vkqB-2ygkA:
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.
2yk6 CMP-N-ACETYLNEURAMIN
ATE-BETA-GALACTOSAMI
DE-ALPHA-2,3-SIALYLT
RANSFERASE

(Neisseria
meningitidis) 		PF07922
(Glyco_transf_52) 		4 LEU A 125
LYS A 126
ALA A 129
LEU A 132
 None
 0.83A 5vkqA-2yk6A:
undetectable
5vkqB-2yk6A:
undetectable		 5vkqA-2yk6A:
12.17
5vkqB-2yk6A:
12.17
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.
2ysk HYPOTHETICAL PROTEIN
TTHA1432

(Thermus
thermophilus) 		PF10025
(DUF2267) 		5 LEU A  27
LEU A  37
LYS A  34
ALA A  38
LEU A  39
 None
 1.44A 5vkqA-2yskA:
undetectable
5vkqB-2yskA:
undetectable		 5vkqA-2yskA:
6.69
5vkqB-2yskA:
6.69
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.
2z3b ATP-DEPENDENT
PROTEASE HSLV

(Bacillus
subtilis) 		PF00227
(Proteasome) 		4 LEU A  77
LYS A  78
ALA A  81
LEU A  84
 None
 0.74A 5vkqA-2z3bA:
undetectable
5vkqB-2z3bA:
undetectable		 5vkqA-2z3bA:
9.12
5vkqB-2z3bA:
9.12
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.
2z4g HISTIDINOL
PHOSPHATASE

(Thermus
thermophilus) 		PF02811
(PHP)
PF13263
(PHP_C) 		4 LEU A 219
LEU A 208
ALA A 212
LEU A 215
 None
 0.81A 5vkqA-2z4gA:
undetectable
5vkqB-2z4gA:
undetectable		 5vkqA-2z4gA:
10.22
5vkqB-2z4gA:
10.22
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.
3ah6 DIVALENT-CATION
TOLERANCE PROTEIN
CUTA

(Escherichia
coli) 		PF03091
(CutA1) 		5 LEU A 111
LEU A  32
LYS A  35
ALA A  37
LEU A  66
 None
 1.45A 5vkqA-3ah6A:
undetectable
5vkqB-3ah6A:
undetectable		 5vkqA-3ah6A:
6.04
5vkqB-3ah6A:
6.04
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.
3bf0 PROTEASE 4

(Escherichia
coli) 		PF01343
(Peptidase_S49) 		4 LEU A 285
LYS A 274
ALA A 276
LEU A 281
 None
 0.86A 5vkqA-3bf0A:
undetectable
5vkqB-3bf0A:
undetectable		 5vkqA-3bf0A:
16.39
5vkqB-3bf0A:
16.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dla GLUTAMINE-DEPENDENT
NAD(+) SYNTHETASE

(Mycobacterium
tuberculosis) 		PF00795
(CN_hydrolase)
PF02540
(NAD_synthase) 		4 LEU A 197
LEU A 225
ALA A 190
LEU A 191
 None
 0.81A 5vkqA-3dlaA:
2.0
5vkqB-3dlaA:
undetectable		 5vkqA-3dlaA:
17.44
5vkqB-3dlaA:
17.44
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.
3e4d ESTERASE D

(Agrobacterium
fabrum) 		PF00756
(Esterase) 		4 LEU A 269
LYS A 270
ALA A 273
LEU A 276
 None
 0.73A 5vkqA-3e4dA:
undetectable
5vkqB-3e4dA:
undetectable		 5vkqA-3e4dA:
10.47
5vkqB-3e4dA:
10.47
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.
3fhg N-GLYCOSYLASE/DNA
LYASE

(Sulfolobus
solfataricus) 		PF00730
(HhH-GPD) 		4 LEU A 179
LYS A 180
ALA A 183
LEU A 186
 None
 0.80A 5vkqA-3fhgA:
undetectable
5vkqB-3fhgA:
undetectable		 5vkqA-3fhgA:
8.03
5vkqB-3fhgA:
8.03
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.
3j70 ENVELOPE
GLYCOPROTEIN GP120

(Human
immunodeficiency
virus 1) 		PF00516
(GP120) 		4 LEU D 342
LYS D 343
ALA D 346
LEU D 349
 None
 0.78A 5vkqA-3j70D:
undetectable
5vkqB-3j70D:
undetectable		 5vkqA-3j70D:
12.76
5vkqB-3j70D:
12.76
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.
3jth TRANSCRIPTION
ACTIVATOR HLYU

(Vibrio
vulnificus) 		PF01022
(HTH_5) 		4 LEU A  17
LYS A  18
ALA A  21
LEU A  26
 None
 0.87A 5vkqA-3jthA:
undetectable
5vkqB-3jthA:
undetectable		 5vkqA-3jthA:
4.73
5vkqB-3jthA:
4.73
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.
3l7y PUTATIVE
UNCHARACTERIZED
PROTEIN SMU.1108C

(Streptococcus
mutans) 		PF08282
(Hydrolase_3) 		4 LEU A 127
LEU A 153
ALA A 106
LEU A 107
 None
 0.78A 5vkqA-3l7yA:
undetectable
5vkqB-3l7yA:
undetectable		 5vkqA-3l7yA:
10.57
5vkqB-3l7yA:
10.57
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.
3lhq ACRAB OPERON
REPRESSOR (TETR/ACRR
FAMILY)

(Salmonella
enterica) 		PF00440
(TetR_N)
PF08361
(TetR_C_2) 		4 LEU A 145
LEU A 159
ALA A 163
LEU A 166
 None
 0.86A 5vkqA-3lhqA:
undetectable
5vkqB-3lhqA:
undetectable		 5vkqA-3lhqA:
9.17
5vkqB-3lhqA:
9.17
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.
3moz MYO-INOSITOL
HEXAPHOSPHATE
PHOSPHOHYDROLASE

(Selenomonas
ruminantium) 		PF14566
(PTPlike_phytase) 		4 LEU A 113
LYS A 114
ALA A 117
LEU A 120
 None
None
GOL  A1004 (-3.6A)
None
 0.83A 5vkqA-3mozA:
undetectable
5vkqB-3mozA:
undetectable		 5vkqA-3mozA:
11.14
5vkqB-3mozA:
11.14
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.
3msu CITRATE SYNTHASE

(Francisella
tularensis) 		PF00285
(Citrate_synt) 		4 LEU A 331
LEU A 338
ALA A 342
LEU A 345
 None
 0.85A 5vkqA-3msuA:
undetectable
5vkqB-3msuA:
undetectable		 5vkqA-3msuA:
13.74
5vkqB-3msuA:
13.74
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.
3qkb UNCHARACTERIZED
PROTEIN

(Pediococcus
pentosaceus) 		no annotation 4 LEU A  48
LYS A  49
ALA A  52
LEU A  55
 None
 0.87A 5vkqA-3qkbA:
undetectable
5vkqB-3qkbA:
undetectable		 5vkqA-3qkbA:
5.08
5vkqB-3qkbA:
5.08
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.
3qkc GERANYL DIPHOSPHATE
SYNTHASE SMALL
SUBUNIT

(Antirrhinum
majus) 		no annotation 4 LEU B 258
LEU B 233
LYS B 234
ALA B 237
 None
 0.82A 5vkqA-3qkcB:
undetectable
5vkqB-3qkcB:
undetectable		 5vkqA-3qkcB:
9.92
5vkqB-3qkcB:
9.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r0s ACYL-[ACYL-CARRIER-P
ROTEIN]--UDP-N-ACETY
LGLUCOSAMINE
O-ACYLTRANSFERASE

(Campylobacter
jejuni) 		PF00132
(Hexapep)
PF13720
(Acetyltransf_11) 		5 LEU A 248
LEU A 224
LYS A 225
ALA A 228
LEU A 231
 None
 1.14A 5vkqA-3r0sA:
undetectable
5vkqB-3r0sA:
undetectable		 5vkqA-3r0sA:
11.10
5vkqB-3r0sA:
11.10
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.
3rk6 POLYADENYLATE-BINDIN
G
PROTEIN-INTERACTING
PROTEIN 1

(Homo sapiens) 		PF02854
(MIF4G) 		4 LEU A 290
LEU A 246
LYS A 245
LEU A 251
 None
 0.67A 5vkqA-3rk6A:
3.7
5vkqB-3rk6A:
3.7		 5vkqA-3rk6A:
8.83
5vkqB-3rk6A:
8.83
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.
3tch PERIPLASMIC
OLIGOPEPTIDE-BINDING
PROTEIN

(Escherichia
coli) 		PF00496
(SBP_bac_5) 		4 LEU A 389
LEU A 400
ALA A 404
LEU A 407
 None
 0.80A 5vkqA-3tchA:
2.2
5vkqB-3tchA:
2.2		 5vkqA-3tchA:
14.37
5vkqB-3tchA:
14.37
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.
3wwh (R)-AMINE
TRANSAMINASE

(Arthrobacter
sp. KNK168) 		PF01063
(Aminotran_4) 		4 LEU A  80
LYS A 106
ALA A 109
LEU A 112
 None
 0.65A 5vkqA-3wwhA:
undetectable
5vkqB-3wwhA:
undetectable		 5vkqA-3wwhA:
11.58
5vkqB-3wwhA:
11.58
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.
4ci6 PROTEIN KINASE YOPO

(Yersinia
enterocolitica) 		PF00069
(Pkinase)
PF09632
(Rac1) 		4 LEU B 405
LYS B 245
ALA B 248
LEU B 251
 None
 0.70A 5vkqA-4ci6B:
4.2
5vkqB-4ci6B:
4.2		 5vkqA-4ci6B:
17.29
5vkqB-4ci6B:
17.29
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.
4ckk DNA GYRASE SUBUNIT A

(Escherichia
coli) 		PF00521
(DNA_topoisoIV) 		4 LEU A 424
LEU A 380
ALA A 384
LEU A 387
 None
 0.85A 5vkqA-4ckkA:
2.6
5vkqB-4ckkA:
2.6		 5vkqA-4ckkA:
15.08
5vkqB-4ckkA:
15.08
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.
4elz DNA GYRASE SUBUNIT A

(Aliivibrio
fischeri) 		PF00521
(DNA_topoisoIV) 		4 LEU A 424
LEU A 380
ALA A 384
LEU A 387
 None
 0.86A 5vkqA-4elzA:
3.5
5vkqB-4elzA:
3.5		 5vkqA-4elzA:
6.63
5vkqB-4elzA:
6.63
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.
4h8l CC-HEX-D24-A5/7C

(synthetic
construct) 		no annotation 4 LEU A  10
LYS A  11
ALA A  14
LEU A  17
 None
 0.65A 5vkqA-4h8lA:
undetectable
5vkqB-4h8lA:
undetectable		 5vkqA-4h8lA:
3.04
5vkqB-4h8lA:
3.04
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.
4h8m CC-HEX-H24-A5/7C

(synthetic
construct) 		no annotation 4 LEU A  10
LYS A  11
ALA A  14
LEU A  17
 None
 0.58A 5vkqA-4h8mA:
undetectable
5vkqB-4h8mA:
undetectable		 5vkqA-4h8mA:
1.71
5vkqB-4h8mA:
1.71
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.
4hxd RNA-DIRECTED RNA
POLYMERASE L

(Dugbe
orthonairovirus) 		PF02338
(OTU) 		4 LEU B 118
LEU B 103
ALA B 105
LEU B 108
 None
 0.86A 5vkqA-4hxdB:
undetectable
5vkqB-4hxdB:
undetectable		 5vkqA-4hxdB:
7.01
5vkqB-4hxdB:
7.01
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.
4kvt 6-HELIX COILED COIL
CC-HEX-L24C PEPTIDE

(-) 		no annotation 4 LEU A  10
LYS A  11
ALA A  14
LEU A  17
 None
 0.73A 5vkqA-4kvtA:
undetectable
5vkqB-4kvtA:
undetectable		 5vkqA-4kvtA:
2.79
5vkqB-4kvtA:
2.79
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.
4mo0 PROTEIN TRANSLATION
FACTOR SUI1 HOMOLOG

(Methanocaldococcus
jannaschii) 		PF01253
(SUI1) 		4 LEU A  53
LYS A  54
ALA A  57
LEU A  60
 None
 0.61A 5vkqA-4mo0A:
undetectable
5vkqB-4mo0A:
undetectable		 5vkqA-4mo0A:
4.80
5vkqB-4mo0A:
4.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o01 BACTERIOPHYTOCHROME

(Deinococcus
radiodurans) 		PF00360
(PHY)
PF01590
(GAF)
PF08446
(PAS_2) 		4 LEU A 395
LEU A 438
ALA A 427
LEU A 426
 None
 0.86A 5vkqA-4o01A:
undetectable
5vkqB-4o01A:
undetectable		 5vkqA-4o01A:
15.39
5vkqB-4o01A:
15.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oav PROTEIN (RNASE L)

(Homo sapiens) 		PF00069
(Pkinase)
PF06479
(Ribonuc_2-5A)
PF12796
(Ank_2)
PF13857
(Ank_5) 		4 LEU B 316
LEU B 285
ALA B 289
LEU B 292
 None
 0.80A 5vkqA-4oavB:
15.8
5vkqB-4oavB:
undetectable		 5vkqA-4oavB:
19.31
5vkqB-4oavB:
19.31
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.
4pka PATATIN-17

(Solanum
cardiophyllum) 		PF01734
(Patatin) 		4 LEU X 366
LYS X 367
ALA X 370
LEU X 373
 None
 0.66A 5vkqA-4pkaX:
undetectable
5vkqB-4pkaX:
undetectable		 5vkqA-4pkaX:
11.99
5vkqB-4pkaX:
11.99
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.
4ras OXIDOREDUCTASE,
NAD-BINDING/IRON-SUL
FUR CLUSTER-BINDING
PROTEIN

(Nitratireductor
pacificus) 		PF12838
(Fer4_7)
PF13486
(Dehalogenase) 		4 LEU A  83
LYS A  84
ALA A  87
LEU A  90
 None
 0.83A 5vkqA-4rasA:
undetectable
5vkqB-4rasA:
undetectable		 5vkqA-4rasA:
18.77
5vkqB-4rasA:
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.
4w6v DI-/TRIPEPTIDE
TRANSPORTER

(Yersinia
enterocolitica) 		PF00854
(PTR2) 		4 LEU A 501
LYS A 289
ALA A 292
LEU A 295
 None
 0.79A 5vkqA-4w6vA:
2.7
5vkqB-4w6vA:
2.7		 5vkqA-4w6vA:
14.65
5vkqB-4w6vA:
14.65
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.
4xj6 VC0179-LIKE PROTEIN

(Escherichia
coli) 		no annotation 5 LEU A 373
LEU A 324
LYS A 323
ALA A 326
LEU A 329
 None
 1.19A 5vkqA-4xj6A:
undetectable
5vkqB-4xj6A:
undetectable		 5vkqA-4xj6A:
12.73
5vkqB-4xj6A:
12.73
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.
4ynv ACL4

(Chaetomium
thermophilum) 		PF13432
(TPR_16) 		4 LEU A  73
LEU A  33
ALA A  37
LEU A  40
 None
 0.85A 5vkqA-4ynvA:
3.6
5vkqB-4ynvA:
3.6		 5vkqA-4ynvA:
11.04
5vkqB-4ynvA:
11.04
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.
4zrq TRANSCOBALAMIN-2

(Homo sapiens) 		PF01122
(Cobalamin_bind)
PF14478
(DUF4430) 		4 LEU A 113
LEU A 144
ALA A  88
LEU A  89
 None
 0.87A 5vkqA-4zrqA:
2.5
5vkqB-4zrqA:
2.5		 5vkqA-4zrqA:
14.46
5vkqB-4zrqA:
14.46
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.
5a31 ANAPHASE-PROMOTING
COMPLEX SUBUNIT 5

(Homo sapiens) 		PF12862
(ANAPC5) 		4 LEU O 652
LYS O 660
ALA O 663
LEU O 666
 None
 0.81A 5vkqA-5a31O:
5.0
5vkqB-5a31O:
5.0		 5vkqA-5a31O:
18.91
5vkqB-5a31O:
18.91
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.
5c3l NUCLEOPORIN NUP62

(Xenopus laevis) 		PF05064
(Nsp1_C) 		4 LEU C 469
LYS C 470
ALA C 473
LEU C 476
 None
 0.82A 5vkqA-5c3lC:
undetectable
5vkqB-5c3lC:
undetectable		 5vkqA-5c3lC:
6.84
5vkqB-5c3lC:
6.84
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.
5c9d APRICK PROTEASE

(Rickettsia
conorii) 		PF13975
(gag-asp_proteas) 		4 LEU A 160
LYS A 150
ALA A 153
LEU A 156
 None
 0.77A 5vkqA-5c9dA:
undetectable
5vkqB-5c9dA:
undetectable		 5vkqA-5c9dA:
6.18
5vkqB-5c9dA:
6.18
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.
5ch8 MONO- AND
DIACYLGLYCEROL
LIPASE

(Penicillium
cyclopium) 		PF01764
(Lipase_3)
PF03893
(Lipase3_N) 		4 LEU A 153
LEU A 110
ALA A 108
LEU A 107
 None
 0.83A 5vkqA-5ch8A:
undetectable
5vkqB-5ch8A:
undetectable		 5vkqA-5ch8A:
10.55
5vkqB-5ch8A:
10.55
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.
5cwl DESIGNED HELICAL
REPEAT PROTEIN

(synthetic
construct) 		no annotation 4 LEU A  96
LEU A 123
ALA A 138
LEU A 139
 None
 0.71A 5vkqA-5cwlA:
3.2
5vkqB-5cwlA:
3.3		 5vkqA-5cwlA:
7.45
5vkqB-5cwlA:
7.45
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.
5cxv MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M1,ENDOLYSIN,MUSCARI
NIC ACETYLCHOLINE
RECEPTOR M1

(Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		4 LEU A 131
LYS A1059
ALA A1062
LEU A1065
 None
 0.83A 5vkqA-5cxvA:
3.5
5vkqB-5cxvA:
3.5		 5vkqA-5cxvA:
14.74
5vkqB-5cxvA:
14.74
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.
5dlq EXPORTIN-4

(Mus musculus) 		no annotation 4 LEU B 642
LYS B 643
ALA B 646
LEU B 650
 None
 0.74A 5vkqA-5dlqB:
4.0
5vkqB-5dlqB:
3.9		 5vkqA-5dlqB:
22.01
5vkqB-5dlqB:
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.
5elp NRPS/PKS PROTEIN

(Bacillus
amyloliquefaciens) 		no annotation 4 LEU C 461
LYS C 462
ALA C 465
LEU C 468
 None
 0.78A 5vkqA-5elpC:
undetectable
5vkqB-5elpC:
undetectable		 5vkqA-5elpC:
16.11
5vkqB-5elpC:
16.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gvx TREHALOSE-PHOSPHATE
PHOSPHATASE

(Mycobacterium
tuberculosis) 		PF02358
(Trehalose_PPase) 		4 LEU A 231
LYS A 232
ALA A 235
LEU A 238
 None
 0.66A 5vkqA-5gvxA:
2.5
5vkqB-5gvxA:
2.5		 5vkqA-5gvxA:
13.38
5vkqB-5gvxA:
13.38
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.
5hdt SISTER CHROMATID
COHESION PROTEIN
PDS5 HOMOLOG B

(Homo sapiens) 		no annotation 4 LEU A 962
LEU A1021
ALA A 944
LEU A 945
 None
 0.85A 5vkqA-5hdtA:
2.0
5vkqB-5hdtA:
2.0		 5vkqA-5hdtA:
21.61
5vkqB-5hdtA:
21.61
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.
5iys PHYTOENE SYNTHASE

(Enterococcus
hirae) 		PF00494
(SQS_PSY) 		4 LEU A 253
LEU A 216
ALA A 220
LEU A 223
 None
 0.83A 5vkqA-5iysA:
2.7
5vkqB-5iysA:
2.7		 5vkqA-5iysA:
10.57
5vkqB-5iysA:
10.57
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.
5kp7 CURD

(Moorea
producens) 		PF01154
(HMG_CoA_synt_N)
PF08540
(HMG_CoA_synt_C) 		4 LEU A  23
LYS A  22
ALA A  24
LEU A  29
 None
 0.84A 5vkqA-5kp7A:
undetectable
5vkqB-5kp7A:
undetectable		 5vkqA-5kp7A:
13.41
5vkqB-5kp7A:
13.41
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.
5l75 FIG000988: PREDICTED
PERMEASE

(Klebsiella
pneumoniae) 		PF03739
(YjgP_YjgQ) 		4 LEU F  73
LEU F 300
ALA F 302
LEU F 305
 None
 0.86A 5vkqA-5l75F:
2.4
5vkqB-5l75F:
2.4		 5vkqA-5l75F:
12.66
5vkqB-5l75F:
12.66
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.
5nd1 CAPSID PROTEIN

(Rosellinia
necatrix
quadrivirus 1) 		no annotation 4 LEU A 419
LEU A 377
ALA A 381
LEU A 384
 None
 0.72A 5vkqA-5nd1A:
undetectable
5vkqB-5nd1A:
undetectable		 5vkqA-5nd1A:
undetectable
5vkqB-5nd1A:
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.
5nl1 TALIN-1

(Mus musculus) 		no annotation 5 LEU A 609
LEU A 593
LYS A 592
ALA A 595
LEU A 598
 None
 1.34A 5vkqA-5nl1A:
4.0
5vkqB-5nl1A:
4.0		 5vkqA-5nl1A:
undetectable
5vkqB-5nl1A:
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.
5ntf AMINOPEPTIDASE

(Trypanosoma
cruzi) 		PF00883
(Peptidase_M17) 		4 LEU A 334
LEU A 323
ALA A 325
LEU A 328
 None
 0.76A 5vkqA-5ntfA:
undetectable
5vkqB-5ntfA:
undetectable		 5vkqA-5ntfA:
15.53
5vkqB-5ntfA:
15.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5vkq NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L

(Drosophila
melanogaster) 		PF00023
(Ank)
PF00520
(Ion_trans)
PF12796
(Ank_2)
PF13637
(Ank_4) 		4 LEU A1437
LYS A1438
ALA A1441
LEU A1444
 PCF  A1808 ( 3.3A)
PCF  A1808 (-4.2A)
PCF  A1808 (-3.2A)
PCF  A1808 (-4.9A)
 0.00A 5vkqA-5vkqA:
49.7
5vkqB-5vkqA:
48.6		 5vkqA-5vkqA:
100.00
5vkqB-5vkqA:
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.
5wc2 PACHYTENE CHECKPOINT
PROTEIN 2 HOMOLOG

(Homo sapiens) 		no annotation 4 LEU A 209
LYS A 190
ALA A 193
LEU A 196
 None
 0.82A 5vkqA-5wc2A:
undetectable
5vkqB-5wc2A:
undetectable		 5vkqA-5wc2A:
undetectable
5vkqB-5wc2A:
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.
5woy PHOSPHOENOLPYRUVATE-
PROTEIN
PHOSPHOTRANSFERASE

(Caldanaerobacter
subterraneus) 		no annotation 4 LEU A 123
LYS A 124
ALA A 127
LEU A 130
 None
 0.83A 5vkqA-5woyA:
3.3
5vkqB-5woyA:
3.3		 5vkqA-5woyA:
undetectable
5vkqB-5woyA:
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.
5y89 PUTATIVE HEMIN
TRANSPORT SYSTEM,
SUBSTRATE-BINDING
PROTEIN

(Burkholderia
cenocepacia) 		no annotation 4 LEU A  66
LEU A  49
ALA A  53
LEU A  56
 None
 0.86A 5vkqA-5y89A:
undetectable
5vkqB-5y89A:
undetectable		 5vkqA-5y89A:
9.97
5vkqB-5y89A:
9.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5z9x SMALL RNA DEGRADING
NUCLEASE 1

(Arabidopsis
thaliana) 		no annotation 4 LEU A  73
LYS A  74
ALA A  77
LEU A  80
 None
 0.74A 5vkqA-5z9xA:
undetectable
5vkqB-5z9xA:
undetectable		 5vkqA-5z9xA:
undetectable
5vkqB-5z9xA:
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.
6bhu MULTIDRUG
RESISTANCE-ASSOCIATE
D PROTEIN 1

(Bos taurus) 		no annotation 4 LEU A1387
LEU A1436
ALA A1440
LEU A1443
 None
 0.84A 5vkqA-6bhuA:
6.2
5vkqB-6bhuA:
6.2		 5vkqA-6bhuA:
undetectable
5vkqB-6bhuA:
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.
6c1d UNCONVENTIONAL
MYOSIN-IB

(Rattus
norvegicus) 		no annotation 4 LEU P 312
LEU P 272
ALA P 276
LEU P 279
 None
 0.66A 5vkqA-6c1dP:
undetectable
5vkqB-6c1dP:
undetectable		 5vkqA-6c1dP:
undetectable
5vkqB-6c1dP:
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.
6fht BACTERIOPHYTOCHROME,
ADENYLATE CYCLASE

(Synechocystis
sp. PCC 6803;
Deinococcus
radiodurans) 		no annotation 4 LEU A 395
LEU A 438
ALA A 427
LEU A 426
 None
 0.81A 5vkqA-6fhtA:
undetectable
5vkqB-6fhtA:
undetectable		 5vkqA-6fhtA:
undetectable
5vkqB-6fhtA:
undetectable