SIMILAR PATTERNS OF AMINO ACIDS FOR 5CXV_A_0HKA501_2

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site

Query pattern: Residues from known binding site for annotated drug that match the hit pattern


(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism
Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1a40 PHOSPHATE-BINDING
PERIPLASMIC PROTEIN
PRECURSOR


(Escherichia
coli)
PF12849
(PBP_like_2)
3 THR A 256
THR A 255
PHE A 224
None
0.81A 5cxvA-1a40A:
undetectable
5cxvA-1a40A:
21.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ad9 IGG CTM01 FAB (LIGHT
CHAIN)


(Homo sapiens)
no annotation 3 THR L 102
THR L  85
PHE L  83
None
0.80A 5cxvA-1ad9L:
undetectable
5cxvA-1ad9L:
17.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1btc BETA-AMYLASE

(Glycine max)
PF01373
(Glyco_hydro_14)
3 THR A 253
THR A 256
PHE A 261
None
0.60A 5cxvA-1btcA:
undetectable
5cxvA-1btcA:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cee GTP-BINDING RHO-LIKE
PROTEIN
WISKOTT-ALDRICH
SYNDROME PROTEIN
WASP


(Homo sapiens)
PF00071
(Ras)
PF00786
(PBD)
3 THR A  52
THR A  43
PHE B  15
None
0.82A 5cxvA-1ceeA:
undetectable
5cxvA-1ceeA:
20.04
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.
1crz TOLB PROTEIN

(Escherichia
coli)
PF04052
(TolB_N)
PF07676
(PD40)
3 THR A 366
THR A 385
PHE A 389
None
0.80A 5cxvA-1crzA:
undetectable
5cxvA-1crzA:
21.71
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.
1dm1 MYOGLOBIN

(Aplysia
limacina)
PF00042
(Globin)
3 THR A  66
THR A  69
PHE A  74
HEM  A 148 (-4.5A)
None
None
0.91A 5cxvA-1dm1A:
0.0
5cxvA-1dm1A:
14.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f4h BETA-GALACTOSIDASE

(Escherichia
coli)
PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981)
3 THR A 104
THR A 101
PHE A 601
None
0.71A 5cxvA-1f4hA:
undetectable
5cxvA-1f4hA:
19.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hfs STROMELYSIN-1

(Homo sapiens)
PF00413
(Peptidase_M10)
3 THR A 193
THR A 187
PHE A 196
None
0.89A 5cxvA-1hfsA:
undetectable
5cxvA-1hfsA:
14.88
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.
1ixk METHYLTRANSFERASE

(Pyrococcus
horikoshii)
PF01189
(Methyltr_RsmB-F)
PF17125
(Methyltr_RsmF_N)
3 THR A 198
THR A 202
PHE A 307
None
0.89A 5cxvA-1ixkA:
undetectable
5cxvA-1ixkA:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ogy PERIPLASMIC NITRATE
REDUCTASE


(Rhodobacter
sphaeroides)
PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4)
3 THR A 545
THR A 544
PHE A 566
None
0.91A 5cxvA-1ogyA:
undetectable
5cxvA-1ogyA:
19.57
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.
1sdd COAGULATION FACTOR V

(Bos taurus)
PF00754
(F5_F8_type_C)
PF07732
(Cu-oxidase_3)
3 THR B2005
THR B1914
PHE B1916
None
0.62A 5cxvA-1sddB:
undetectable
5cxvA-1sddB:
23.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t71 PHOSPHATASE

(Mycoplasma
pneumoniae)
PF13277
(YmdB)
3 THR A 134
THR A 135
PHE A 138
None
0.84A 5cxvA-1t71A:
undetectable
5cxvA-1t71A:
21.04
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.
1tol PROTEIN (FUSION
PROTEIN CONSISTING
OF MINOR COAT
PROTEIN, GLYCINE
RICH LINKER, TOLA,
AND A HIS TAG)


(Escherichia
coli;
Escherichia
virus M13)
PF05357
(Phage_Coat_A)
PF06519
(TolA)
3 THR A  56
THR A  41
PHE A 211
None
0.80A 5cxvA-1tolA:
undetectable
5cxvA-1tolA:
19.05
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.
1z06 RAS-RELATED PROTEIN
RAB-33B


(Mus musculus)
PF00071
(Ras)
3 THR A  47
THR A  50
PHE A  70
MG  A 203 ( 3.0A)
None
None
0.85A 5cxvA-1z06A:
undetectable
5cxvA-1z06A:
15.77
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.
1zh1 NON-STRUCTURAL
POLYPROTEIN


(Hepacivirus C)
PF08300
(HCV_NS5a_1a)
PF08301
(HCV_NS5a_1b)
3 THR A 134
THR A 135
PHE A 175
None
0.92A 5cxvA-1zh1A:
undetectable
5cxvA-1zh1A:
15.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d86 VAV-3 PROTEIN

(Homo sapiens)
PF11971
(CAMSAP_CH)
3 THR A  84
THR A  87
PHE A  93
None
0.86A 5cxvA-2d86A:
undetectable
5cxvA-2d86A:
14.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ep7 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Aquifex
aeolicus)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
3 THR A 209
THR A 208
PHE A 195
None
0.87A 5cxvA-2ep7A:
undetectable
5cxvA-2ep7A:
19.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2f5a PROTEIN (ANTIBODY
2F5 (LIGHT CHAIN))


(Homo sapiens)
PF07654
(C1-set)
PF07686
(V-set)
3 THR L 102
THR L  85
PHE L  83
None
0.87A 5cxvA-2f5aL:
undetectable
5cxvA-2f5aL:
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.
2ghi TRANSPORT PROTEIN

(Plasmodium
yoelii)
PF00005
(ABC_tran)
3 THR A  47
THR A 206
PHE A  14
None
0.80A 5cxvA-2ghiA:
undetectable
5cxvA-2ghiA:
18.63
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.
2hmf PROBABLE
ASPARTOKINASE


(Methanocaldococcus
jannaschii)
PF00696
(AA_kinase)
PF01842
(ACT)
PF13840
(ACT_7)
3 THR A 238
THR A 237
PHE A 467
None
0.87A 5cxvA-2hmfA:
undetectable
5cxvA-2hmfA:
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.
2m07 OUTER MEMBRANE
PROTEIN X


(Escherichia
coli)
PF13505
(OMP_b-brl)
3 THR A  93
THR A  92
PHE A  90
None
0.91A 5cxvA-2m07A:
undetectable
5cxvA-2m07A:
15.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pbe AMINOGLYCOSIDE
6-ADENYLYLTRANSFERAS
E


(Bacillus
subtilis)
PF04439
(Adenyl_transf)
3 THR A 230
THR A 245
PHE A 250
None
0.63A 5cxvA-2pbeA:
undetectable
5cxvA-2pbeA:
19.81
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.
2pql D7R4 PROTEIN

(Anopheles
gambiae)
PF01395
(PBP_GOBP)
3 THR A 102
THR A 105
PHE A 110
None
None
TSS  A 145 (-4.4A)
0.84A 5cxvA-2pqlA:
undetectable
5cxvA-2pqlA:
14.26
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.
2q1f CHONDROITINASE

(Bacteroides
thetaiotaomicron)
PF02278
(Lyase_8)
PF09092
(Lyase_N)
PF09093
(Lyase_catalyt)
3 THR A 908
THR A 895
PHE A 893
None
0.91A 5cxvA-2q1fA:
undetectable
5cxvA-2q1fA:
18.95
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.
2q1f CHONDROITINASE

(Bacteroides
thetaiotaomicron)
PF02278
(Lyase_8)
PF09092
(Lyase_N)
PF09093
(Lyase_catalyt)
3 THR A 910
THR A 895
PHE A 893
None
0.55A 5cxvA-2q1fA:
undetectable
5cxvA-2q1fA:
18.95
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.
2q83 YTAA PROTEIN

(Bacillus
subtilis)
PF01636
(APH)
3 THR A 242
THR A 245
PHE A 139
None
0.90A 5cxvA-2q83A:
undetectable
5cxvA-2q83A:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qn0 NEUROTOXIN

(Clostridium
botulinum)
PF01742
(Peptidase_M27)
3 THR A 126
THR A 309
PHE A 315
None
0.91A 5cxvA-2qn0A:
undetectable
5cxvA-2qn0A:
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.
2rbc SUGAR KINASE

(Agrobacterium
fabrum)
PF00294
(PfkB)
3 THR A  20
THR A 102
PHE A 116
EDO  A 328 (-3.5A)
EDO  A 328 (-3.4A)
None
0.89A 5cxvA-2rbcA:
undetectable
5cxvA-2rbcA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rgh ALPHA-GLYCEROPHOSPHA
TE OXIDASE


(Streptococcus
sp.)
PF01266
(DAO)
PF16901
(DAO_C)
3 THR A 299
THR A 298
PHE A 296
None
FAD  A 609 (-3.9A)
None
0.78A 5cxvA-2rghA:
undetectable
5cxvA-2rghA:
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.
2v6j RNA HELICASE

(Kokobera virus)
PF00271
(Helicase_C)
PF07652
(Flavi_DEAD)
3 THR A 133
THR A 131
PHE A 104
None
0.83A 5cxvA-2v6jA:
undetectable
5cxvA-2v6jA:
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.
2v8o FLAVIVIRIN PROTEASE
NS3


(Murray Valley
encephalitis
virus)
PF00271
(Helicase_C)
PF07652
(Flavi_DEAD)
3 THR A 318
THR A 316
PHE A 289
None
0.82A 5cxvA-2v8oA:
undetectable
5cxvA-2v8oA:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vdt LEVANSUCRASE

(Bacillus
subtilis)
PF02435
(Glyco_hydro_68)
3 THR A 194
THR A 193
PHE A 218
None
0.88A 5cxvA-2vdtA:
undetectable
5cxvA-2vdtA:
21.99
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.
2wv9 FLAVIVIRIN PROTEASE
NS2B REGULATORY
SUBUNIT, FLAVIVIRIN
PROTEASE NS3
CATALYTIC SUBUNIT


(Murray Valley
encephalitis
virus)
PF00271
(Helicase_C)
PF00949
(Peptidase_S7)
PF01002
(Flavi_NS2B)
PF07652
(Flavi_DEAD)
3 THR A 318
THR A 316
PHE A 289
None
0.84A 5cxvA-2wv9A:
undetectable
5cxvA-2wv9A:
20.17
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.
2x3l ORN/LYS/ARG
DECARBOXYLASE FAMILY
PROTEIN


(Staphylococcus
aureus)
PF01276
(OKR_DC_1)
PF03711
(OKR_DC_1_C)
3 THR A  30
THR A 339
PHE A 342
None
0.90A 5cxvA-2x3lA:
undetectable
5cxvA-2x3lA:
22.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x75 ADENYLOSUCCINATE
LYASE


(Staphylococcus
aureus)
PF00206
(Lyase_1)
PF10397
(ADSL_C)
3 THR A 385
THR A 387
PHE A 389
None
0.92A 5cxvA-2x75A:
1.2
5cxvA-2x75A:
21.92
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.
2ybu ACIDIC MAMMALIAN
CHITINASE


(Homo sapiens)
PF00704
(Glyco_hydro_18)
3 THR A 118
THR A 121
PHE A 126
None
0.71A 5cxvA-2ybuA:
undetectable
5cxvA-2ybuA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yy5 TRYPTOPHANYL-TRNA
SYNTHETASE


(Mycoplasma
pneumoniae)
PF00579
(tRNA-synt_1b)
3 THR A 326
THR A 329
PHE A 334
None
0.91A 5cxvA-2yy5A:
undetectable
5cxvA-2yy5A:
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.
2z22 PERIPLASMIC
PHOSPHATE-BINDING
PROTEIN


(Yersinia pestis)
no annotation 3 THR X 256
THR X 255
PHE X 224
None
0.82A 5cxvA-2z22X:
undetectable
5cxvA-2z22X:
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.
3b7m CELLULASE

(Rhodothermus
marinus)
PF01670
(Glyco_hydro_12)
3 THR A  13
THR A  20
PHE A  64
None
0.87A 5cxvA-3b7mA:
undetectable
5cxvA-3b7mA:
19.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ho6 TOXIN A

(Clostridioides
difficile)
PF11713
(Peptidase_C80)
3 THR A 170
THR A 120
PHE A 123
None
0.83A 5cxvA-3ho6A:
undetectable
5cxvA-3ho6A:
19.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hvs THIOL PEROXIDASE

(Escherichia
coli)
PF08534
(Redoxin)
3 THR A  73
THR A  78
PHE A  43
None
0.89A 5cxvA-3hvsA:
undetectable
5cxvA-3hvsA:
18.63
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.
3iv6 PUTATIVE
ZN-DEPENDENT ALCOHOL
DEHYDROGENASE


(Rhodobacter
sphaeroides)
no annotation 3 THR A 122
THR A 121
PHE A 177
None
0.87A 5cxvA-3iv6A:
undetectable
5cxvA-3iv6A:
18.69
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.
3jst PUTATIVE
PTERIN-4-ALPHA-CARBI
NOLAMINE DEHYDRATASE


(Brucella
melitensis)
PF01329
(Pterin_4a)
3 THR A  31
THR A  72
PHE A  63
EDO  A  98 ( 4.8A)
EDO  A  98 (-3.9A)
None
0.85A 5cxvA-3jstA:
undetectable
5cxvA-3jstA:
10.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nnk UREIDOGLYCINE-GLYOXY
LATE
AMINOTRANSFERASE


(Klebsiella
pneumoniae)
PF00266
(Aminotran_5)
3 THR A 173
THR A 144
PHE A  99
None
None
LLP  A 200 ( 3.7A)
0.82A 5cxvA-3nnkA:
undetectable
5cxvA-3nnkA:
23.16
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.
3pa8 TOXIN B

(Clostridioides
difficile)
PF11713
(Peptidase_C80)
3 THR A 167
THR A 117
PHE A 120
None
0.79A 5cxvA-3pa8A:
undetectable
5cxvA-3pa8A:
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.
3poy NEUREXIN-1-ALPHA

(Bos taurus)
PF00008
(EGF)
PF02210
(Laminin_G_2)
3 THR A 760
THR A 652
PHE A 650
None
0.63A 5cxvA-3poyA:
undetectable
5cxvA-3poyA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qyq DEOXYRIBOSE-PHOSPHAT
E ALDOLASE, PUTATIVE


(Toxoplasma
gondii)
no annotation 3 THR A  11
THR A  14
PHE A  19
None
0.62A 5cxvA-3qyqA:
undetectable
5cxvA-3qyqA:
19.49
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.
3s99 BASIC MEMBRANE
LIPOPROTEIN


(Brucella
abortus)
PF02608
(Bmp)
3 THR A  86
THR A  87
PHE A  89
None
0.90A 5cxvA-3s99A:
undetectable
5cxvA-3s99A:
21.04
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.
3t5o COMPLEMENT COMPONENT
C6


(Homo sapiens)
PF00057
(Ldl_recept_a)
PF00084
(Sushi)
PF00090
(TSP_1)
PF01823
(MACPF)
3 THR A 693
THR A 710
PHE A 715
None
0.74A 5cxvA-3t5oA:
undetectable
5cxvA-3t5oA:
18.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tva XYLOSE ISOMERASE
DOMAIN PROTEIN TIM
BARREL


(Planctopirus
limnophila)
PF01261
(AP_endonuc_2)
3 THR A  82
THR A  85
PHE A  71
None
0.80A 5cxvA-3tvaA:
undetectable
5cxvA-3tvaA:
20.94
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.
3u44 ATP-DEPENDENT
HELICASE/DEOXYRIBONU
CLEASE SUBUNIT B


(Bacillus
subtilis)
PF12705
(PDDEXK_1)
3 THR B 236
THR B 255
PHE B 210
None
0.70A 5cxvA-3u44B:
undetectable
5cxvA-3u44B:
18.10
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.
3ufa SERINE PROTEASE SPLA

(Staphylococcus
aureus)
PF00089
(Trypsin)
3 THR A 141
THR A 187
PHE A 193
None
0.79A 5cxvA-3ufaA:
undetectable
5cxvA-3ufaA:
17.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3uon HUMAN M2 MUSCARINIC
ACETYLCHOLINE,
RECEPTOR T4 LYSOZYME
FUSION PROTEIN


(Escherichia
virus T4;
Homo sapiens)
PF00001
(7tm_1)
PF00959
(Phage_lysozyme)
3 THR A 187
THR A 190
PHE A 195
QNB  A1162 (-4.8A)
QNB  A1162 (-4.3A)
QNB  A1162 (-4.4A)
0.51A 5cxvA-3uonA:
39.7
5cxvA-3uonA:
68.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vzm ENDO-1,4-BETA-XYLANA
SE


(Bacillus
circulans)
PF00457
(Glyco_hydro_11)
3 THR A 145
THR A  50
PHE A  48
None
0.86A 5cxvA-3vzmA:
undetectable
5cxvA-3vzmA:
16.14
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.
3wfl BETA-MANNANASE

(Talaromyces
trachyspermus)
PF00150
(Cellulase)
3 THR A  39
THR A  45
PHE A  36
None
0.80A 5cxvA-3wflA:
undetectable
5cxvA-3wflA:
20.04
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.
3wv4 NON-RIBOSOMAL
PEPTIDE SYNTHETASE


(Streptomyces
halstedii)
PF00501
(AMP-binding)
3 THR A 292
THR A 267
PHE A 222
None
0.92A 5cxvA-3wv4A:
undetectable
5cxvA-3wv4A:
21.47
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.
3zlc ER-DERIVED VESICLES
PROTEIN ERV41


(Saccharomyces
cerevisiae)
PF07970
(COPIIcoated_ERV)
PF13850
(ERGIC_N)
3 THR A 243
THR A 254
PHE A 208
None
0.84A 5cxvA-3zlcA:
undetectable
5cxvA-3zlcA:
18.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zs6 PERIPLASMIC
OLIGOPEPTIDE-BINDING
PROTEIN


(Burkholderia
pseudomallei)
PF00496
(SBP_bac_5)
3 THR A 339
THR A 343
PHE A 289
None
0.66A 5cxvA-3zs6A:
undetectable
5cxvA-3zs6A:
22.58
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.
4cgt CYCLODEXTRIN
GLYCOSYLTRANSFERASE


(Bacillus
circulans)
PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C)
3 THR A  95
THR A  86
PHE A  84
None
0.75A 5cxvA-4cgtA:
undetectable
5cxvA-4cgtA:
22.29
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.
4f4c MULTIDRUG RESISTANCE
PROTEIN PGP-1


(Caenorhabditis
elegans)
PF00005
(ABC_tran)
PF00664
(ABC_membrane)
3 THR A1045
THR A 738
PHE A 741
None
0.91A 5cxvA-4f4cA:
2.8
5cxvA-4f4cA:
17.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f92 U5 SMALL NUCLEAR
RIBONUCLEOPROTEIN
200 KDA HELICASE


(Homo sapiens)
PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63)
3 THR B 583
THR B 565
PHE B 555
None
0.68A 5cxvA-4f92B:
undetectable
5cxvA-4f92B:
14.28
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.
4gqz PUTATIVE PERIPLASMIC
OR EXPORTED PROTEIN


(Salmonella
enterica)
no annotation 3 THR A  61
THR A 171
PHE A  97
None
0.73A 5cxvA-4gqzA:
undetectable
5cxvA-4gqzA:
15.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h8n CONJUGATED
POLYKETONE REDUCTASE
C2


(Candida
parapsilosis)
PF00248
(Aldo_ket_red)
3 THR A 261
THR A 260
PHE A 214
NDP  A3001 (-4.0A)
NDP  A3001 (-3.4A)
NDP  A3001 (-3.2A)
0.82A 5cxvA-4h8nA:
undetectable
5cxvA-4h8nA:
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.
4i3h TOPOISOMERASE IV
SUBUNIT B, DNA
TOPOISOMERASE 4
SUBUNIT A CHIMERA


(Streptococcus
pneumoniae)
PF00204
(DNA_gyraseB)
PF00521
(DNA_topoisoIV)
PF00986
(DNA_gyraseB_C)
PF01751
(Toprim)
PF02518
(HATPase_c)
3 THR A1168
THR A1176
PHE A1327
None
0.85A 5cxvA-4i3hA:
undetectable
5cxvA-4i3hA:
18.19
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.
4kpn NUCLEOSIDE
N-RIBOHYDROLASE 1


(Physcomitrella
patens)
PF01156
(IU_nuc_hydro)
3 THR A  49
THR A  50
PHE A  82
None
0.91A 5cxvA-4kpnA:
undetectable
5cxvA-4kpnA:
20.42
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.
4ld7 DIMETHYLALLYL
TRYPTOPHAN SYNTHASE


(Aspergillus
fischeri)
PF11991
(Trp_DMAT)
3 THR A 404
THR A 406
PHE A 427
None
0.88A 5cxvA-4ld7A:
undetectable
5cxvA-4ld7A:
22.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4mqt MUSCARINIC
ACETYLCHOLINE
RECEPTOR M2


(Homo sapiens)
PF00001
(7tm_1)
3 THR A 187
THR A 190
PHE A 195
None
0.49A 5cxvA-4mqtA:
32.6
5cxvA-4mqtA:
41.67
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.
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2


(Mus musculus)
PF00008
(EGF)
PF03098
(An_peroxidase)
3 THR A 579
THR A 428
PHE A 199
None
0.86A 5cxvA-4ph9A:
undetectable
5cxvA-4ph9A:
21.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pka PATATIN-17

(Solanum
cardiophyllum)
PF01734
(Patatin)
3 THR X  76
THR X 187
PHE X 155
MIS  X  77 ( 3.8A)
MIS  X  77 ( 3.0A)
None
0.76A 5cxvA-4pkaX:
undetectable
5cxvA-4pkaX:
23.00
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.
4pu5 TOXIN-ANTITOXIN
SYSTEM TOXIN HIPA
FAMILY


(Shewanella
oneidensis)
PF07804
(HipA_C)
PF13657
(Couple_hipA)
3 THR A   3
THR A   6
PHE A  23
None
0.90A 5cxvA-4pu5A:
undetectable
5cxvA-4pu5A:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qqr 3,5-EPIMERASE/4-REDU
CTASE


(Arabidopsis
thaliana)
PF04321
(RmlD_sub_bind)
3 THR A 222
THR A 198
PHE A 180
None
0.80A 5cxvA-4qqrA:
undetectable
5cxvA-4qqrA:
21.65
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.
4txw HYALURONOGLUCOSAMINI
DASE


(Clostridium
perfringens)
PF00754
(F5_F8_type_C)
3 THR A  57
THR A  96
PHE A  94
None
0.70A 5cxvA-4txwA:
undetectable
5cxvA-4txwA:
16.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4u14 MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,ENDOLYSIN,MUSCARI
NIC ACETYLCHOLINE
RECEPTOR M3


(Escherichia
virus T4;
Rattus
norvegicus)
PF00001
(7tm_1)
PF00959
(Phage_lysozyme)
3 THR A 231
THR A 234
PHE A 239
0HK  A2000 (-4.3A)
None
None
0.52A 5cxvA-4u14A:
42.6
5cxvA-4u14A:
73.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4u16 MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,LYSOZYME,MUSCARIN
IC ACETYLCHOLINE
RECEPTOR M3


(Escherichia
virus T4;
Rattus
norvegicus)
PF00001
(7tm_1)
PF00959
(Phage_lysozyme)
3 THR A 231
THR A 234
PHE A 239
None
0.51A 5cxvA-4u16A:
39.2
5cxvA-4u16A:
67.80
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.
4u5a SPOROZOITE MICRONEME
PROTEIN ESSENTIAL
FOR CELL TRAVERSAL


(Plasmodium
berghei)
no annotation 3 THR A  68
THR A  71
PHE A  76
None
0.85A 5cxvA-4u5aA:
3.4
5cxvA-4u5aA:
17.87
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.
4w8o LUCIFERASE-LIKE
ENZYMEAMP-COA-LIGASE


(Zophobas
atratus)
PF00501
(AMP-binding)
3 THR A  78
THR A 224
PHE A 222
None
0.57A 5cxvA-4w8oA:
undetectable
5cxvA-4w8oA:
19.62
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.
4x81 MYCINAMICIN III
3''-O-METHYLTRANSFER
ASE


(Micromonospora
griseorubida)
PF05711
(TylF)
3 THR A 145
THR A 149
PHE A 154
None
0.92A 5cxvA-4x81A:
undetectable
5cxvA-4x81A:
18.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xyd NORC-LIKE PROTEIN

(Roseobacter
denitrificans)
PF00034
(Cytochrom_C)
3 THR B  45
THR B  47
PHE B 132
None
0.75A 5cxvA-4xydB:
undetectable
5cxvA-4xydB:
16.03
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.
5ao5 C-TYPE MANNOSE
RECEPTOR 2


(Homo sapiens)
PF00040
(fn2)
PF00059
(Lectin_C)
3 THR A 216
THR A 188
PHE A 198
SO4  A1512 (-4.1A)
SO4  A1512 ( 4.0A)
None
0.64A 5cxvA-5ao5A:
undetectable
5cxvA-5ao5A:
22.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bs5 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE


(Acinetobacter
baumannii)
PF00275
(EPSP_synthase)
3 THR A 733
THR A 736
PHE A 738
None
0.89A 5cxvA-5bs5A:
undetectable
5cxvA-5bs5A:
23.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bz0 REPLICASE
POLYPROTEIN 1AB


(Avian
coronavirus)
PF08715
(Viral_protease)
3 THR A 291
THR A 202
PHE A 207
None
0.91A 5cxvA-5bz0A:
undetectable
5cxvA-5bz0A:
21.12
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.
5djq CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCOP1


(Pseudomonas
stutzeri)
PF13442
(Cytochrome_CBB3)
PF14715
(FixP_N)
3 THR C  13
THR C  16
PHE C  21
None
0.81A 5cxvA-5djqC:
undetectable
5cxvA-5djqC:
20.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4


(Escherichia
virus T4;
Homo sapiens)
PF00001
(7tm_1)
PF00959
(Phage_lysozyme)
3 THR A 196
THR A 199
PHE A 204
P6G  A1205 (-4.6A)
OLC  A1208 (-4.4A)
None
0.42A 5cxvA-5dsgA:
42.1
5cxvA-5dsgA:
61.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ep8 PYRIMIDINE-NUCLEOSID
E PHOSPHORYLASE


(Bacillus
subtilis)
PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C)
3 THR A 210
THR A 202
PHE A 207
THR  A 210 ( 0.8A)
THR  A 202 ( 0.8A)
PHE  A 207 ( 1.3A)
0.83A 5cxvA-5ep8A:
undetectable
5cxvA-5ep8A:
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.
5f0g GLUTATHIONE
S-TRANSFERASE D2


(Drosophila
melanogaster)
PF00043
(GST_C)
PF02798
(GST_N)
3 THR A 162
THR A 165
PHE A 171
None
0.68A 5cxvA-5f0gA:
undetectable
5cxvA-5f0gA:
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.
5fp2 FERRIC ENTEROBACTIN
RECEPTOR PIRA


(Pseudomonas
aeruginosa)
PF00593
(TonB_dep_Rec)
PF07715
(Plug)
3 THR A 452
THR A 458
PHE A 519
None
0.75A 5cxvA-5fp2A:
undetectable
5cxvA-5fp2A:
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.
5fsa CYP51 VARIANT1

(Candida
albicans)
PF00067
(p450)
3 THR A 196
THR A 199
PHE A 205
None
0.86A 5cxvA-5fsaA:
undetectable
5cxvA-5fsaA:
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.
5h42 UNCHARACTERIZED
PROTEIN


(Lachnoclostridium
phytofermentans)
PF17167
(Glyco_hydro_36)
3 THR A1052
THR A1047
PHE A 583
None
0.92A 5cxvA-5h42A:
undetectable
5cxvA-5h42A:
18.21
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.
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)
3 THR A  24
THR A  25
PHE A  28
None
None
GTP  A 401 (-4.8A)
0.89A 5cxvA-5hzhA:
undetectable
5cxvA-5hzhA:
20.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ikr PROSTAGLANDIN G/H
SYNTHASE 2


(Homo sapiens)
PF00008
(EGF)
PF03098
(An_peroxidase)
3 THR A 578
THR A 427
PHE A 198
None
0.85A 5cxvA-5ikrA:
undetectable
5cxvA-5ikrA:
22.82
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.
5ikz OXALATE BIOSYNTHETIC
COMPONENT 1


(Burkholderia
thailandensis)
PF05853
(BKACE)
3 THR A1038
THR A1054
PHE A1057
None
0.92A 5cxvA-5ikzA:
undetectable
5cxvA-5ikzA:
19.14
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.
5ir6 BD-TYPE QUINOL
OXIDASE SUBUNIT I


(Geobacillus
stearothermophilus)
PF01654
(Cyt_bd_oxida_I)
3 THR A 303
THR A 262
PHE A 260
None
0.53A 5cxvA-5ir6A:
2.7
5cxvA-5ir6A:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k1r BURKHOLDERIA
PSEUDOMALLEI
SPHINGOSINE-1-PHOSPH
ATE LYASE BPSS2021


(Burkholderia
pseudomallei)
PF00282
(Pyridoxal_deC)
3 THR A 409
THR A 344
PHE A 366
None
0.75A 5cxvA-5k1rA:
undetectable
5cxvA-5k1rA:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5txr 5-AMINOLEVULINATE
SYNTHASE,
MITOCHONDRIAL


(Saccharomyces
cerevisiae)
no annotation 3 THR B 368
THR B 367
PHE B 365
None
0.92A 5cxvA-5txrB:
undetectable
5cxvA-5txrB:
9.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ubc PROTEIN TOC75-3,
CHLOROPLASTIC


(Arabidopsis
thaliana)
no annotation 3 THR A 215
THR A 218
PHE A 349
None
0.61A 5cxvA-5ubcA:
undetectable
5cxvA-5ubcA:
19.73
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.
5xk8 UNDECAPRENYL
DIPHOSPHATE SYNTHASE


(Streptomyces
sp. CNH189)
no annotation 3 THR A   2
THR A  46
PHE A  48
None
0.85A 5cxvA-5xk8A:
undetectable
5cxvA-5xk8A:
9.38
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.
5xsy SODIUM CHANNEL
PROTEIN


(Electrophorus
electricus)
PF00520
(Ion_trans)
PF06512
(Na_trans_assoc)
3 THR A 992
THR A 995
PHE A1002
None
0.91A 5cxvA-5xsyA:
undetectable
5cxvA-5xsyA:
13.68
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.
6c6l V-TYPE PROTON ATPASE
SUBUNIT A, VACUOLAR
ISOFORM


(Saccharomyces
cerevisiae)
no annotation 3 THR A 411
THR A 414
PHE A 419
None
0.60A 5cxvA-6c6lA:
undetectable
5cxvA-6c6lA:
8.74
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.
6co9 PROBABLE
COA-TRANSFERASE BETA
SUBUNIT


(Rhodococcus
jostii)
no annotation 3 THR B  47
THR B  48
PHE B  22
None
0.84A 5cxvA-6co9B:
undetectable
5cxvA-6co9B:
12.30