SIMILAR PATTERNS OF AMINO ACIDS FOR 4L49_A_CAMA502_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.
1d6h CHALCONE SYNTHASE

(Medicago sativa)
PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C)
4 PHE A 373
LEU A 310
VAL A 313
VAL A 369
None
1.21A 4l49A-1d6hA:
0.0
4l49A-1d6hA:
23.13
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.
1ij5 PLASMODIAL SPECIFIC
LAV1-2 PROTEIN


(Physarum
polycephalum)
PF13202
(EF-hand_5)
4 PHE A 344
LEU A 311
VAL A 310
VAL A 286
None
1.14A 4l49A-1ij5A:
0.0
4l49A-1ij5A:
22.87
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.
1lfp HYPOTHETICAL PROTEIN
AQ_1575


(Aquifex
aeolicus)
PF01709
(Transcrip_reg)
4 PHE A 117
LEU A 222
VAL A 234
VAL A 130
None
0.85A 4l49A-1lfpA:
0.0
4l49A-1lfpA:
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.
1pwe L-SERINE DEHYDRATASE

(Rattus
norvegicus)
PF00291
(PALP)
4 TYR A 278
LEU A  19
VAL A 300
VAL A 266
None
1.19A 4l49A-1pweA:
0.0
4l49A-1pweA:
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.
1s7h YKOF

(Bacillus
subtilis)
PF07615
(Ykof)
4 PHE A  59
LEU A 187
VAL A 185
VAL A 170
None
1.16A 4l49A-1s7hA:
0.0
4l49A-1s7hA:
18.18
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.
1taq TAQ DNA POLYMERASE

(Thermus
aquaticus)
PF00476
(DNA_pol_A)
PF01367
(5_3_exonuc)
PF02739
(5_3_exonuc_N)
PF09281
(Taq-exonuc)
4 PHE A 564
LEU A 560
VAL A 449
VAL A 783
None
1.16A 4l49A-1taqA:
0.0
4l49A-1taqA:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tw9 GLUTATHIONE
S-TRANSFERASE 2


(Heligmosomoides
polygyrus)
PF02798
(GST_N)
PF14497
(GST_C_3)
4 PHE A 132
LEU A 148
VAL A 156
VAL A 164
None
1.14A 4l49A-1tw9A:
0.0
4l49A-1tw9A:
19.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wk4 TTK003001606

(Thermus
thermophilus)
PF00583
(Acetyltransf_1)
4 PHE A 139
TYR A 140
LEU A  91
VAL A  96
MES  A 201 ( 4.3A)
None
None
MES  A 201 ( 4.4A)
1.19A 4l49A-1wk4A:
undetectable
4l49A-1wk4A:
17.51
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.
1wyt GLYCINE
DEHYDROGENASE
(DECARBOXYLATING)
SUBUNIT 1


(Thermus
thermophilus)
PF02347
(GDC-P)
4 PHE A 415
LEU A 393
VAL A 389
VAL A 363
None
1.06A 4l49A-1wytA:
0.0
4l49A-1wytA:
22.17
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.
1wyt GLYCINE
DEHYDROGENASE
(DECARBOXYLATING)
SUBUNIT 1


(Thermus
thermophilus)
PF02347
(GDC-P)
4 PHE A 415
LEU A 393
VAL A 389
VAL A 366
None
1.22A 4l49A-1wytA:
0.0
4l49A-1wytA:
22.17
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.
1ys9 PROTEIN SPY1043

(Streptococcus
pyogenes)
PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6)
4 PHE A  27
LEU A 246
VAL A 225
VAL A 202
None
1.12A 4l49A-1ys9A:
undetectable
4l49A-1ys9A:
19.13
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.
1yyr TRICHODIENE SYNTHASE

(Fusarium
sporotrichioides)
PF06330
(TRI5)
4 TYR A  93
LEU A 150
VAL A 138
VAL A  81
SAZ  A 709 (-4.9A)
None
None
None
0.97A 4l49A-1yyrA:
undetectable
4l49A-1yyrA:
22.83
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.
2ajh LEUCYL-TRNA
SYNTHETASE


(Escherichia
coli)
PF13603
(tRNA-synt_1_2)
4 PHE A 253
LEU A 259
VAL A 245
VAL A 408
None
1.09A 4l49A-2ajhA:
undetectable
4l49A-2ajhA:
18.62
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.
2awa DNA POLYMERASE III,
BETA CHAIN


(Streptococcus
pneumoniae)
PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3)
4 PHE A  11
LEU A  77
VAL A  34
VAL A  38
None
0.92A 4l49A-2awaA:
undetectable
4l49A-2awaA:
22.27
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.
2awa DNA POLYMERASE III,
BETA CHAIN


(Streptococcus
pneumoniae)
PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3)
4 PHE A  96
LEU A  45
VAL A  34
VAL A  86
None
1.22A 4l49A-2awaA:
undetectable
4l49A-2awaA:
22.27
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.
2bg9 ACETYLCHOLINE
RECEPTOR PROTEIN,
ALPHA CHAIN


(Torpedo
marmorata)
PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb)
4 PHE A 205
TYR A 181
LEU A  35
VAL A  50
None
1.16A 4l49A-2bg9A:
undetectable
4l49A-2bg9A:
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.
2c9i GREEN FLUORESCENT
PROTEIN ASFP499


(Anemonia
sulcata)
PF01353
(GFP)
4 PHE A  80
TYR A 178
VAL A 147
VAL A 214
None
1.10A 4l49A-2c9iA:
undetectable
4l49A-2c9iA:
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.
2hcf HYDROLASE, HALOACID
DEHALOGENASE-LIKE
FAMILY


(Chlorobaculum
tepidum)
PF13419
(HAD_2)
4 PHE A   8
LEU A 224
VAL A 223
VAL A 173
None
1.18A 4l49A-2hcfA:
undetectable
4l49A-2hcfA:
20.67
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.
2hzr APOLIPOPROTEIN D

(Homo sapiens)
PF08212
(Lipocalin_2)
4 TYR A  22
LEU A 129
VAL A 111
VAL A  87
None
1.15A 4l49A-2hzrA:
undetectable
4l49A-2hzrA:
17.86
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.
2k8d PEPTIDE METHIONINE
SULFOXIDE REDUCTASE
MSRB


(Methanothermobacter
thermautotrophicus)
PF01641
(SelR)
4 PHE A  90
LEU A 123
VAL A 114
VAL A  94
None
0.96A 4l49A-2k8dA:
undetectable
4l49A-2k8dA:
17.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2m56 CAMPHOR
5-MONOOXYGENASE


(Pseudomonas
putida)
PF00067
(p450)
5 PHE A  87
TYR A  96
LEU A 244
VAL A 247
VAL A 295
CAM  A 502 (-4.6A)
CAM  A 502 (-4.5A)
HEM  A 501 (-4.5A)
None
HEM  A 501 (-4.6A)
0.17A 4l49A-2m56A:
68.2
4l49A-2m56A:
99.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2m56 CAMPHOR
5-MONOOXYGENASE


(Pseudomonas
putida)
PF00067
(p450)
4 PHE A  87
TYR A  96
LEU A 244
VAL A 396
CAM  A 502 (-4.6A)
CAM  A 502 (-4.5A)
HEM  A 501 (-4.5A)
None
0.68A 4l49A-2m56A:
68.2
4l49A-2m56A:
99.26
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.
2n67 HEMOLYSIN II

(Bacillus cereus)
no annotation 4 PHE B  66
TYR B  64
LEU B  36
VAL B  16
None
1.10A 4l49A-2n67B:
undetectable
4l49A-2n67B:
13.39
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.
2p22 SUPPRESSOR PROTEIN
STP22 OF
TEMPERATURE-SENSITIV
E ALPHA-FACTOR
RECEPTOR AND
ARGININE PERMEASE
PROTEIN SRN2
HYPOTHETICAL 12.0
KDA PROTEIN IN
ADE3-SER2 INTERGENIC
REGION


(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae)
PF09454
(Vps23_core)
PF07200
(Mod_r)
PF09452
(Mvb12)
4 PHE D  71
TYR D  75
LEU C  58
VAL A 232
None
1.19A 4l49A-2p22D:
undetectable
4l49A-2p22D:
12.58
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.
2p5r GLUTATHIONE
PEROXIDASE 5


(Populus
trichocarpa x
Populus
deltoides)
PF00255
(GSHPx)
4 PHE A  71
LEU A  35
VAL A  12
VAL A  25
None
1.14A 4l49A-2p5rA:
undetectable
4l49A-2p5rA:
20.31
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.
2peg HEMOGLOBIN SUBUNIT
BETA


(Trematomus
bernacchii)
PF00042
(Globin)
4 PHE B  42
LEU B  96
VAL B  98
VAL B  67
HEM  B 400 (-4.6A)
HEM  B 400 (-4.2A)
HEM  B 400 ( 4.5A)
HEM  B 400 (-3.7A)
1.21A 4l49A-2pegB:
undetectable
4l49A-2pegB:
15.20
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.
2w40 GLYCEROL KINASE,
PUTATIVE


(Plasmodium
falciparum)
PF00370
(FGGY_N)
PF02782
(FGGY_C)
4 TYR A 235
LEU A   5
VAL A   3
VAL A  64
None
1.19A 4l49A-2w40A:
undetectable
4l49A-2w40A:
21.93
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.
2wy4 SINGLE DOMAIN
HAEMOGLOBIN


(Campylobacter
jejuni)
PF00042
(Globin)
4 PHE A  42
TYR A  28
LEU A  56
VAL A  89
HEM  A 150 ( 3.5A)
CYN  A 151 (-4.7A)
CYN  A 151 (-4.1A)
HEM  A 150 (-3.8A)
1.10A 4l49A-2wy4A:
undetectable
4l49A-2wy4A:
16.83
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.
2yh2 ESTERASE

(Pyrobaculum
calidifontis)
PF07859
(Abhydrolase_3)
4 PHE A 123
TYR A 221
LEU A 162
VAL A 165
None
1.17A 4l49A-2yh2A:
undetectable
4l49A-2yh2A:
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.
2zhp BLEOMYCIN RESISTANCE
PROTEIN


(Streptoalloteichus
hindustanus)
no annotation 4 PHE A  29
LEU A 108
VAL A 116
VAL A  68
None
1.07A 4l49A-2zhpA:
undetectable
4l49A-2zhpA:
14.42
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.
3ail 303AA LONG
HYPOTHETICAL
ESTERASE


(Sulfurisphaera
tokodaii)
PF07859
(Abhydrolase_3)
4 PHE A 117
TYR A 210
LEU A 155
VAL A 158
None
1.14A 4l49A-3ailA:
undetectable
4l49A-3ailA:
20.89
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.
3b9t TWIN-ARGININE
TRANSLOCATION
PATHWAY SIGNAL
PROTEIN


(Methylobacillus
flagellatus)
PF03069
(FmdA_AmdA)
4 TYR A 227
LEU A 279
VAL A 278
VAL A 223
None
0.87A 4l49A-3b9tA:
undetectable
4l49A-3b9tA:
22.39
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.
3c9h ABC TRANSPORTER,
SUBSTRATE BINDING
PROTEIN


(Agrobacterium
fabrum)
PF13416
(SBP_bac_8)
4 PHE A 146
LEU A 162
VAL A 169
VAL A 223
None
1.12A 4l49A-3c9hA:
undetectable
4l49A-3c9hA:
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.
3cy5 HEMOGLOBIN SUBUNIT
BETA


(Bubalus bubalis)
PF00042
(Globin)
4 PHE B 122
LEU B 110
VAL B 134
VAL B  11
None
1.15A 4l49A-3cy5B:
undetectable
4l49A-3cy5B:
15.94
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.
3epr HYDROLASE, HALOACID
DEHALOGENASE-LIKE
FAMILY


(Streptococcus
agalactiae)
PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6)
4 PHE A  29
LEU A 247
VAL A 226
VAL A 203
None
1.21A 4l49A-3eprA:
undetectable
4l49A-3eprA:
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.
3etu PROTEIN TRANSPORT
PROTEIN DSL1


(Saccharomyces
cerevisiae)
PF11988
(Dsl1_N)
4 PHE A 179
TYR A 167
LEU A 123
VAL A  68
None
1.20A 4l49A-3etuA:
undetectable
4l49A-3etuA:
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.
3g5w MULTICOPPER OXIDASE
TYPE 1


(Nitrosomonas
europaea)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3)
4 TYR A 145
LEU A  50
VAL A  89
VAL A  81
None
1.18A 4l49A-3g5wA:
undetectable
4l49A-3g5wA:
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.
3g8m SERINE
HYDROXYMETHYLTRANSFE
RASE


(Escherichia
coli)
PF00464
(SHMT)
4 PHE A 302
LEU A  32
VAL A 344
VAL A 389
None
1.03A 4l49A-3g8mA:
undetectable
4l49A-3g8mA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gdj HEMOGLOBIN SUBUNIT
BETA


(Camelus
dromedarius)
PF00042
(Globin)
4 PHE B 122
LEU B 110
VAL B 134
VAL B  11
None
1.16A 4l49A-3gdjB:
undetectable
4l49A-3gdjB:
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.
3j1c CHAPERONIN ALPHA
SUBUNIT


(Acidianus
tengchongensis)
PF00118
(Cpn60_TCP1)
4 PHE A 105
TYR A 447
LEU A 425
VAL A 512
None
1.11A 4l49A-3j1cA:
1.8
4l49A-3j1cA:
21.80
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.
3kl2 PUTATIVE
ISOCHORISMATASE


(Streptomyces
avermitilis)
PF00857
(Isochorismatase)
4 PHE A 154
LEU A 173
VAL A 196
VAL A 168
None
1.12A 4l49A-3kl2A:
undetectable
4l49A-3kl2A:
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.
3lcv SISOMICIN-GENTAMICIN
RESISTANCE METHYLASE
SGM


(Micromonospora
zionensis)
PF07091
(FmrO)
4 PHE B 115
TYR B 116
LEU B 196
VAL B 225
None
1.18A 4l49A-3lcvB:
undetectable
4l49A-3lcvB:
19.91
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.
3mbt OUTER MEMBRANE
LIPOPROTEIN BLC


(Escherichia
coli)
PF08212
(Lipocalin_2)
4 TYR A  21
LEU A 123
VAL A 112
VAL A  88
None
1.06A 4l49A-3mbtA:
undetectable
4l49A-3mbtA:
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.
3pvl MYOSIN VIIA ISOFORM
1


(Mus musculus)
PF00784
(MyTH4)
4 PHE A1532
LEU A1511
VAL A1498
VAL A1489
None
None
None
GOL  A   1 ( 4.7A)
1.00A 4l49A-3pvlA:
undetectable
4l49A-3pvlA:
20.91
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.
3tr9 DIHYDROPTEROATE
SYNTHASE


(Coxiella
burnetii)
PF00809
(Pterin_bind)
4 PHE A 202
LEU A 172
VAL A 175
VAL A 231
None
0.91A 4l49A-3tr9A:
undetectable
4l49A-3tr9A:
21.58
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.
3ubc HEMOGLOBIN-LIKE
FLAVOPROTEIN


(Methylacidiphilum
infernorum)
PF00042
(Globin)
4 PHE A  43
TYR A  29
LEU A  54
VAL A  87
HEM  A 201 (-3.8A)
None
OXY  A 202 ( 4.3A)
HEM  A 201 (-4.1A)
1.05A 4l49A-3ubcA:
undetectable
4l49A-3ubcA:
17.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3umf ADENYLATE KINASE

(Schistosoma
mansoni)
PF00406
(ADK)
4 PHE A  13
TYR A  96
LEU A  74
VAL A 110
None
0.87A 4l49A-3umfA:
undetectable
4l49A-3umfA:
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.
4b8j IMPORTIN SUBUNIT
ALPHA-1A


(Oryza sativa)
PF00514
(Arm)
PF01749
(IBB)
PF16186
(Arm_3)
4 PHE A 228
LEU A 167
VAL A 164
VAL A 185
None
1.16A 4l49A-4b8jA:
undetectable
4l49A-4b8jA:
21.90
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.
4bgq CYCLIN-DEPENDENT
KINASE-LIKE 5


(Homo sapiens)
PF00069
(Pkinase)
4 PHE A 297
LEU A 277
VAL A 197
VAL A 112
None
1.10A 4l49A-4bgqA:
undetectable
4l49A-4bgqA:
23.44
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.
4boo ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA


(Torpedo
marmorata)
PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb)
4 PHE A 205
TYR A 181
LEU A  35
VAL A  50
None
1.16A 4l49A-4booA:
undetectable
4l49A-4booA:
19.58
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.
4bpl IMPORTIN SUBUNIT
ALPHA-1A


(Oryza sativa)
PF00514
(Arm)
PF16186
(Arm_3)
4 PHE A 228
LEU A 167
VAL A 164
VAL A 185
None
1.14A 4l49A-4bplA:
undetectable
4l49A-4bplA:
22.17
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.
4ehc PE-PGRS FAMILY
PROTEIN


(Mycobacterium
tuberculosis)
no annotation 4 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
1.01A 4l49A-4ehcA:
undetectable
4l49A-4ehcA:
18.94
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.
4eut SERINE/THREONINE-PRO
TEIN KINASE TBK1


(Homo sapiens)
PF00069
(Pkinase)
4 PHE A 112
LEU A 281
VAL A 280
VAL A 119
None
1.09A 4l49A-4eutA:
undetectable
4l49A-4eutA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4euu SERINE/THREONINE-PRO
TEIN KINASE TBK1


(Homo sapiens)
PF00069
(Pkinase)
4 PHE A 112
LEU A 281
VAL A 280
VAL A 119
None
1.09A 4l49A-4euuA:
undetectable
4l49A-4euuA:
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.
4g1p CYS-GLY
METALLODIPEPTIDASE
DUG1


(Saccharomyces
cerevisiae)
PF01546
(Peptidase_M20)
PF07687
(M20_dimer)
4 PHE A 429
LEU A 181
VAL A  83
VAL A 164
None
1.03A 4l49A-4g1pA:
undetectable
4l49A-4g1pA:
21.46
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.
4hdt 3-HYDROXYISOBUTYRYL-
COA HYDROLASE


(Mycolicibacterium
thermoresistibile)
PF16113
(ECH_2)
4 PHE A 172
LEU A 153
VAL A 118
VAL A 129
None
1.07A 4l49A-4hdtA:
undetectable
4l49A-4hdtA:
20.28
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.
4jlc SERINE/THREONINE-PRO
TEIN KINASE TBK1


(Mus musculus)
PF00069
(Pkinase)
4 PHE A 112
LEU A 281
VAL A 280
VAL A 119
None
1.13A 4l49A-4jlcA:
undetectable
4l49A-4jlcA:
20.47
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.
4ke4 HYDROXYCINNAMOYL-COA
:SHIKIMATE
HYDROXYCINNAMOYL
TRANSFERASE


(Sorghum bicolor)
PF02458
(Transferase)
4 PHE A 173
LEU A 144
VAL A 100
VAL A 164
None
1.21A 4l49A-4ke4A:
undetectable
4l49A-4ke4A:
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.
4kvs ALDEHYDE
DECARBONYLASE


(Prochlorococcus
marinus)
PF11266
(Ald_deCOase)
4 TYR A  30
LEU A  87
VAL A  89
VAL A  41
None
None
None
6NA  A 301 ( 4.2A)
1.14A 4l49A-4kvsA:
undetectable
4l49A-4kvsA:
21.50
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.
4n0r PUTATIVE GLYCOSIDE
HYDROLASE


(Bacteroides
vulgatus)
PF13204
(DUF4038)
PF16586
(DUF5060)
4 TYR A 314
LEU A 342
VAL A 350
VAL A 355
None
1.09A 4l49A-4n0rA:
undetectable
4l49A-4n0rA:
20.60
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.
4ofq PUTATIVE CELL
SURFACE PROTEIN


(Streptococcus
pyogenes)
PF16364
(Antigen_C)
4 TYR A1111
LEU A1057
VAL A1053
VAL A1103
None
1.12A 4l49A-4ofqA:
undetectable
4l49A-4ofqA:
20.63
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.
4ol9 PUTATIVE
2-DEHYDROPANTOATE
2-REDUCTASE


(Mycobacterium
tuberculosis)
PF02558
(ApbA)
PF08546
(ApbA_C)
4 PHE A 153
LEU A  21
VAL A  17
VAL A 164
None
1.15A 4l49A-4ol9A:
undetectable
4l49A-4ol9A:
20.71
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.
4p3m SERINE
HYDROXYMETHYLTRANSFE
RASE


(Psychromonas
ingrahamii)
PF00464
(SHMT)
4 PHE A 302
LEU A  32
VAL A 344
VAL A 389
None
1.16A 4l49A-4p3mA:
undetectable
4l49A-4p3mA:
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.
4puf E3 UBIQUITIN-PROTEIN
LIGASE SLRP


(Salmonella
enterica)
PF12468
(TTSSLRR)
PF14496
(NEL)
4 PHE A 663
LEU A 673
VAL A 672
VAL A 756
None
1.14A 4l49A-4pufA:
undetectable
4l49A-4pufA:
21.83
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.
4rhh BETA-XYLOSIDASE

(Geobacillus
stearothermophilus)
PF03512
(Glyco_hydro_52)
4 PHE A 353
LEU A 295
VAL A 102
VAL A  14
None
1.06A 4l49A-4rhhA:
undetectable
4l49A-4rhhA:
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.
4std SCYTALONE
DEHYDRATASE


(Magnaporthe
grisea)
PF02982
(Scytalone_dh)
4 PHE A  53
TYR A  50
VAL A  75
VAL A 108
None
BFS  A 173 (-4.3A)
BFS  A 173 (-4.5A)
BFS  A 173 ( 4.4A)
1.01A 4l49A-4stdA:
undetectable
4l49A-4stdA:
18.48
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.
4wy8 ESTERASE

(Rhizomucor
miehei)
PF07859
(Abhydrolase_3)
4 PHE A 128
TYR A 225
LEU A 169
VAL A 172
None
1.10A 4l49A-4wy8A:
undetectable
4l49A-4wy8A:
22.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xxw PROTOCADHERIN-15

(Mus musculus)
no annotation 5 PHE B 183
TYR B 207
LEU B 234
VAL B 135
VAL B 141
None
1.35A 4l49A-4xxwB:
undetectable
4l49A-4xxwB:
19.58
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.
4y96 TRIOSEPHOSPHATE
ISOMERASE


(Gemmata
obscuriglobus)
PF00121
(TIM)
4 PHE A 163
TYR A 202
VAL A 151
VAL A 117
None
0.92A 4l49A-4y96A:
undetectable
4l49A-4y96A:
22.67
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.
4yjy CHALCONE SYNTHASE 1

(Oryza sativa)
PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C)
4 PHE A 376
LEU A 313
VAL A 316
VAL A 372
None
1.20A 4l49A-4yjyA:
undetectable
4l49A-4yjyA:
23.57
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.
4ypv EST8

(Parvibaculum)
PF07859
(Abhydrolase_3)
4 PHE A 125
TYR A 220
LEU A 164
VAL A 167
None
1.12A 4l49A-4ypvA:
undetectable
4l49A-4ypvA:
23.15
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.
4yu4 HEMOGLOBIN

(Helogale
parvula)
PF00042
(Globin)
4 PHE B 122
LEU B 110
VAL B 134
VAL B  11
None
1.18A 4l49A-4yu4B:
undetectable
4l49A-4yu4B:
15.66
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.
4z1p CELL WALL SURFACE
ANCHOR PROTEIN


(Streptococcus
agalactiae)
PF16364
(Antigen_C)
4 TYR A 133
LEU A  79
VAL A  75
VAL A 125
None
1.16A 4l49A-4z1pA:
undetectable
4l49A-4z1pA:
22.53
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.
4z23 CELL WALL SURFACE
ANCHOR PROTEIN


(Streptococcus
agalactiae)
PF16364
(Antigen_C)
4 TYR A 133
LEU A  79
VAL A  75
VAL A 125
None
1.12A 4l49A-4z23A:
undetectable
4l49A-4z23A:
22.05
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.
5b04 PROBABLE TRANSLATION
INITIATION FACTOR
EIF-2B SUBUNIT BETA
PROBABLE TRANSLATION
INITIATION FACTOR
EIF-2B SUBUNIT DELTA


(Schizosaccharomyces
pombe;
Schizosaccharomyces
pombe)
PF01008
(IF-2B)
PF01008
(IF-2B)
4 TYR G 331
LEU C 351
VAL G 324
VAL G 270
None
1.12A 4l49A-5b04G:
undetectable
4l49A-5b04G:
22.90
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.
5cay ENVELOPE
GLYCOPROTEIN GP120
CORE FROM ST STRAIN
OF HIV-2


(Human
immunodeficiency
virus 2)
PF00516
(GP120)
4 PHE G 275
LEU G 409
VAL G 412
VAL G 357
None
1.10A 4l49A-5cayG:
undetectable
4l49A-5cayG:
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.
5cay ENVELOPE
GLYCOPROTEIN GP120
CORE FROM ST STRAIN
OF HIV-2


(Human
immunodeficiency
virus 2)
PF00516
(GP120)
4 PHE G 482
LEU G 301
VAL G 357
VAL G 412
None
0.99A 4l49A-5cayG:
undetectable
4l49A-5cayG:
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.
5cj3 ZBM BINDING PROTEIN

(Streptomyces
flavoviridis)
no annotation 4 PHE A  29
LEU A 108
VAL A 116
VAL A  68
None
1.08A 4l49A-5cj3A:
undetectable
4l49A-5cj3A:
15.53
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.
5ed1 DOUBLE-STRANDED
RNA-SPECIFIC EDITASE
1


(Homo sapiens)
PF02137
(A_deamin)
4 PHE A 406
LEU A 436
VAL A 440
VAL A 355
None
1.11A 4l49A-5ed1A:
undetectable
4l49A-5ed1A:
22.03
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.
5f5v PRP38

(Chaetomium
thermophilum)
PF03371
(PRP38)
4 TYR A 105
LEU A 119
VAL A  65
VAL A  56
None
0.97A 4l49A-5f5vA:
undetectable
4l49A-5f5vA:
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.
5f7s GLYCOSIDE HYDROLASE
FAMILY 31


(Trueperella
pyogenes)
PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
4 PHE A 655
TYR A 656
LEU A 277
VAL A 276
None
1.08A 4l49A-5f7sA:
undetectable
4l49A-5f7sA:
21.83
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.
5hu6 HEMOGLOBIN SUBUNIT
BETA


(Homo sapiens)
PF00042
(Globin)
4 PHE B 123
LEU B 111
VAL B 135
VAL B  12
None
1.14A 4l49A-5hu6B:
undetectable
4l49A-5hu6B:
17.07
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.
5irm UNCHARACTERIZED
PROTEIN


(Oryctolagus
cuniculus)
PF05729
(NACHT)
PF13516
(LRR_6)
4 PHE A 719
LEU A 762
VAL A 765
VAL A 744
None
1.19A 4l49A-5irmA:
undetectable
4l49A-5irmA:
19.25
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.
5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER


(Shigella
flexneri)
PF02395
(Peptidase_S6)
4 PHE A 745
LEU A 758
VAL A 732
VAL A 705
None
1.17A 4l49A-5j44A:
undetectable
4l49A-5j44A:
16.36
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.
5k52 ALDEHYDE
DECARBONYLASE


(Limnothrix sp.
KNUA012)
PF11266
(Ald_deCOase)
4 TYR A  17
LEU A  74
VAL A  76
VAL A  28
None
None
None
OCD  A 500 ( 4.6A)
1.16A 4l49A-5k52A:
undetectable
4l49A-5k52A:
21.73
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.
5k53 ALDEHYDE
DEFORMYLATING
OXYGENASE


(Oscillatoria
sp.)
PF11266
(Ald_deCOase)
4 TYR A  17
LEU A  74
VAL A  76
VAL A  28
None
None
None
STE  A 502 ( 4.8A)
1.03A 4l49A-5k53A:
undetectable
4l49A-5k53A:
21.96
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.
5kpe DE NOVO BETA SHEET
DESIGN PROTEIN OR664


(synthetic
construct)
no annotation 4 PHE A  94
LEU A  31
VAL A  39
VAL A 106
None
1.04A 4l49A-5kpeA:
undetectable
4l49A-5kpeA:
14.25
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.
5ldd MON1
CCZ1


(Chaetomium
thermophilum;
Chaetomium
thermophilum)
PF03164
(Mon1)
PF08217
(DUF1712)
4 PHE B 114
LEU A 226
VAL A 287
VAL A 274
None
0.95A 4l49A-5lddB:
undetectable
4l49A-5lddB:
21.91
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.
5sy7 NEURONAL PAS
DOMAIN-CONTAINING
PROTEIN 3


(Mus musculus)
PF00010
(HLH)
PF00989
(PAS)
PF08447
(PAS_3)
4 PHE B 176
LEU B 187
VAL B 183
VAL B 318
None
1.02A 4l49A-5sy7B:
undetectable
4l49A-5sy7B:
20.99
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.
5tpj DENOVO NTF2

(synthetic
construct)
PF12680
(SnoaL_2)
4 PHE A  89
LEU A  17
VAL A  62
VAL A  76
None
1.12A 4l49A-5tpjA:
undetectable
4l49A-5tpjA:
14.55
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.
5uba RNA PSEUDOURIDYLATE
SYNTHASE
DOMAIN-CONTAINING
PROTEIN 4


(Homo sapiens)
PF00849
(PseudoU_synth_2)
4 TYR A 185
LEU A 152
VAL A 159
VAL A 181
None
1.22A 4l49A-5ubaA:
undetectable
4l49A-5ubaA:
19.53
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.
5uc5 CHS2 CHALCONE
SYNTHASE


(Malus domestica)
no annotation 4 PHE A 373
LEU A 310
VAL A 313
VAL A 369
None
1.19A 4l49A-5uc5A:
undetectable
4l49A-5uc5A:
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.
5v1m U6 SNRNA
PHOSPHODIESTERASE


(Homo sapiens)
PF09749
(HVSL)
4 PHE A 151
LEU A 123
VAL A  87
VAL A 175
None
1.16A 4l49A-5v1mA:
undetectable
4l49A-5v1mA:
18.18
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.
5vmb SERINE
HYDROXYMETHYLTRANSFE
RASE


(Acinetobacter
baumannii)
PF00464
(SHMT)
4 PHE A 301
LEU A  31
VAL A 343
VAL A 388
None
1.08A 4l49A-5vmbA:
undetectable
4l49A-5vmbA:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wtn REPLICATION
INITIATION AND
MEMBRANE ATTACHMENT
PROTEIN


(Geobacillus
stearothermophilus)
no annotation 4 PHE A 211
LEU A 266
VAL A 229
VAL A 220
None
1.14A 4l49A-5wtnA:
undetectable
4l49A-5wtnA:
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.
5yew MITOFUSIN-1,MITOFUSI
N-1 FUSION PROTEIN


(Homo sapiens)
no annotation 4 PHE B 320
LEU B 176
VAL B  78
VAL B 205
None
1.08A 4l49A-5yewB:
undetectable
4l49A-5yewB:
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.
5yk2 PROBABLE CONSERVED
ATP-BINDING PROTEIN
ABC TRANSPORTER


(Mycobacterium
tuberculosis)
no annotation 4 PHE A 130
LEU A 119
VAL A 239
VAL A 154
None
1.08A 4l49A-5yk2A:
undetectable
4l49A-5yk2A:
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.
6co0 STYRYLPYRONE
SYNTHASE 1


(Piper
methysticum)
no annotation 4 PHE A 374
LEU A 311
VAL A 314
VAL A 370
None
1.18A 4l49A-6co0A:
undetectable
4l49A-6co0A:
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.
6ei9 TRNA-DIHYDROURIDINE
SYNTHASE B


(Escherichia
coli)
no annotation 4 PHE A 317
TYR A 316
LEU A 287
VAL A 283
None
1.21A 4l49A-6ei9A:
undetectable
4l49A-6ei9A:
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.
6gui -

(-)
no annotation 4 PHE A 165
LEU A 153
VAL A  52
VAL A 126
None
1.21A 4l49A-6guiA:
undetectable
4l49A-6guiA:
undetectable