SIMILAR PATTERNS OF AMINO ACIDS FOR 4G3R_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.
1ce7 PROTEIN
(RIBOSOME-INACTIVATI
NG PROTEIN TYPE II)


(Viscum album)
PF00161
(RIP)
4 PHE A  20
LEU A 154
VAL A  67
ASP A   7
None
1.07A 4g3rA-1ce7A:
undetectable
4g3rA-1ce7A:
20.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1h4v HISTIDYL-TRNA
SYNTHETASE


(Thermus
thermophilus)
PF03129
(HGTP_anticodon)
PF13393
(tRNA-synt_His)
4 PHE B 228
TYR B 175
VAL B 182
ASP B 227
None
1.06A 4g3rA-1h4vB:
0.0
4g3rA-1h4vB:
24.27
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.
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
1.11A 4g3rA-1ij5A:
0.0
4g3rA-1ij5A:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ktw IOTA-CARRAGEENASE

(Alteromonas sp.
ATCC 43554)
PF12708
(Pectate_lyase_3)
4 PHE A  94
VAL A 111
VAL A  52
ASP A  65
None
None
None
CA  A   7 (-2.2A)
1.13A 4g3rA-1ktwA:
0.0
4g3rA-1ktwA:
22.57
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.
1lfp HYPOTHETICAL PROTEIN
AQ_1575


(Aquifex
aeolicus)
PF01709
(Transcrip_reg)
4 PHE A 117
LEU A 222
VAL A 234
VAL A 130
None
0.86A 4g3rA-1lfpA:
undetectable
4g3rA-1lfpA:
23.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1s7h YKOF

(Bacillus
subtilis)
PF07615
(Ykof)
4 PHE A  59
LEU A 187
VAL A 185
VAL A 170
None
1.09A 4g3rA-1s7hA:
0.0
4g3rA-1s7hA:
17.75
Potential target for repurposing, i.e. matched protein structure has less than 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
1.08A 4g3rA-1wytA:
0.0
4g3rA-1wytA:
22.68
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.
1xf1 C5A PEPTIDASE

(Streptococcus
pyogenes)
PF00082
(Peptidase_S8)
PF02225
(PA)
PF06280
(fn3_5)
PF13585
(CHU_C)
4 LEU A 645
VAL A 628
VAL A 602
ASP A 604
None
0.91A 4g3rA-1xf1A:
0.0
4g3rA-1xf1A:
17.01
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.
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
1.11A 4g3rA-1ys9A:
0.0
4g3rA-1ys9A:
19.24
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.
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
0.99A 4g3rA-1yyrA:
undetectable
4g3rA-1yyrA:
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.
2aco OUTER MEMBRANE
LIPOPROTEIN BLC


(Escherichia
coli)
PF08212
(Lipocalin_2)
4 TYR A  39
LEU A 141
VAL A 130
VAL A 106
None
1.10A 4g3rA-2acoA:
undetectable
4g3rA-2acoA:
18.07
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.
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
1.05A 4g3rA-2ajhA:
undetectable
4g3rA-2ajhA:
18.66
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.
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
0.97A 4g3rA-2awaA:
undetectable
4g3rA-2awaA:
22.10
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.
2awg 38 KDA FK-506
BINDING PROTEIN


(Homo sapiens)
PF00254
(FKBP_C)
4 LEU A 200
VAL A 198
VAL A 152
ASP A 157
None
0.98A 4g3rA-2awgA:
undetectable
4g3rA-2awgA:
14.21
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.
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
1.14A 4g3rA-2bg9A:
undetectable
4g3rA-2bg9A:
21.70
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.
2ct8 METHIONYL-TRNA
SYNTHETASE


(Aquifex
aeolicus)
PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1)
PF09334
(tRNA-synt_1g)
4 PHE A   7
TYR A  38
VAL A 396
ASP A 252
None
1.08A 4g3rA-2ct8A:
undetectable
4g3rA-2ct8A:
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.
2dgk GLUTAMATE
DECARBOXYLASE BETA


(Escherichia
coli)
PF00282
(Pyridoxal_deC)
4 PHE A 380
TYR A 363
LEU A 445
VAL A 406
None
1.07A 4g3rA-2dgkA:
undetectable
4g3rA-2dgkA:
22.16
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.
2i62 NICOTINAMIDE
N-METHYLTRANSFERASE


(Mus musculus)
PF01234
(NNMT_PNMT_TEMT)
4 PHE A 254
LEU A 194
VAL A 226
ASP A 198
None
0.96A 4g3rA-2i62A:
undetectable
4g3rA-2i62A:
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.
2k8d PEPTIDE METHIONINE
SULFOXIDE REDUCTASE
MSRB


(Methanothermobacter
thermautotrophicus)
PF01641
(SelR)
4 PHE A  90
LEU A 123
VAL A 114
VAL A  94
None
1.02A 4g3rA-2k8dA:
undetectable
4g3rA-2k8dA:
17.26
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)
6 PHE A  87
TYR A  96
LEU A 244
VAL A 247
VAL A 295
ASP A 297
CAM  A 502 (-4.6A)
CAM  A 502 (-4.5A)
HEM  A 501 (-4.5A)
None
HEM  A 501 (-4.6A)
HEM  A 501 (-2.8A)
0.25A 4g3rA-2m56A:
68.2
4g3rA-2m56A:
99.50
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
0.63A 4g3rA-2m56A:
68.2
4g3rA-2m56A:
99.50
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.
2n67 HEMOLYSIN II

(Bacillus cereus)
no annotation 4 PHE B  66
TYR B  64
LEU B  36
VAL B  16
None
1.12A 4g3rA-2n67B:
undetectable
4g3rA-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.
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)
1.05A 4g3rA-2wy4A:
undetectable
4g3rA-2wy4A:
16.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xvg ALPHA XYLOSIDASE

(Cellvibrio
japonicus)
PF01055
(Glyco_hydro_31)
PF16338
(DUF4968)
PF17137
(DUF5110)
4 LEU A  68
VAL A  65
VAL A  91
ASP A 404
None
1.15A 4g3rA-2xvgA:
undetectable
4g3rA-2xvgA:
17.39
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.
2yh2 ESTERASE

(Pyrobaculum
calidifontis)
PF07859
(Abhydrolase_3)
4 PHE A 123
TYR A 221
LEU A 162
VAL A 165
None
1.13A 4g3rA-2yh2A:
undetectable
4g3rA-2yh2A:
22.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zhp BLEOMYCIN RESISTANCE
PROTEIN


(Streptoalloteichus
hindustanus)
no annotation 4 PHE A  29
LEU A 108
VAL A 116
VAL A  68
None
1.05A 4g3rA-2zhpA:
undetectable
4g3rA-2zhpA:
14.22
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.
3ail 303AA LONG
HYPOTHETICAL
ESTERASE


(Sulfurisphaera
tokodaii)
PF07859
(Abhydrolase_3)
4 PHE A 117
TYR A 210
LEU A 155
VAL A 158
None
1.10A 4g3rA-3ailA:
undetectable
4g3rA-3ailA:
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.
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
0.89A 4g3rA-3b9tA:
undetectable
4g3rA-3b9tA:
22.16
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.
3cy5 HEMOGLOBIN SUBUNIT
BETA


(Bubalus bubalis)
PF00042
(Globin)
4 PHE B 122
LEU B 110
VAL B 134
VAL B  11
None
1.13A 4g3rA-3cy5B:
undetectable
4g3rA-3cy5B:
16.84
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.
3g05 TRNA URIDINE
5-CARBOXYMETHYLAMINO
METHYL MODIFICATION
ENZYME MNMG


(Escherichia
coli)
PF01134
(GIDA)
PF13932
(GIDA_assoc)
4 LEU A 365
VAL A 151
VAL A 125
ASP A 127
None
0.95A 4g3rA-3g05A:
undetectable
4g3rA-3g05A:
22.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
1.12A 4g3rA-3g5wA:
undetectable
4g3rA-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
0.99A 4g3rA-3g8mA:
undetectable
4g3rA-3g8mA:
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.
3hp7 HEMOLYSIN, PUTATIVE

(Streptococcus
thermophilus)
PF01479
(S4)
PF01728
(FtsJ)
4 PHE A  77
LEU A 181
VAL A 261
ASP A 227
None
1.12A 4g3rA-3hp7A:
undetectable
4g3rA-3hp7A:
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.
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 4g3rA-3j1cA:
undetectable
4g3rA-3j1cA:
21.07
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.
3jxv 70 KDA
PEPTIDYL-PROLYL
ISOMERASE


(Triticum
aestivum)
PF00254
(FKBP_C)
4 LEU A 380
VAL A 378
VAL A 330
ASP A 335
None
1.00A 4g3rA-3jxvA:
undetectable
4g3rA-3jxvA:
22.69
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.
3kl2 PUTATIVE
ISOCHORISMATASE


(Streptomyces
avermitilis)
PF00857
(Isochorismatase)
4 PHE A 154
LEU A 173
VAL A 196
VAL A 168
None
1.08A 4g3rA-3kl2A:
undetectable
4g3rA-3kl2A:
20.95
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.
3ko7 D-TYROSYL-TRNA(TYR)
DEACYLASE


(Plasmodium
falciparum)
PF02580
(Tyr_Deacylase)
4 LEU A  79
VAL A  76
VAL A 151
ASP A 148
None
1.01A 4g3rA-3ko7A:
undetectable
4g3rA-3ko7A:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lcv SISOMICIN-GENTAMICIN
RESISTANCE METHYLASE
SGM


(Micromonospora
zionensis)
PF07091
(FmrO)
4 PHE B 115
TYR B 116
LEU B 196
VAL B 225
None
1.13A 4g3rA-3lcvB:
undetectable
4g3rA-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 4g3rA-3mbtA:
undetectable
4g3rA-3mbtA:
17.92
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.
3mnd SUPEROXIDE DISMUTASE
[CU-ZN]


(Taenia solium)
PF00080
(Sod_Cu)
4 LEU A 114
VAL A  17
VAL A  26
ASP A  98
None
1.11A 4g3rA-3mndA:
undetectable
4g3rA-3mndA:
16.54
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.
3myu HIGH AFFINITY
TRANSPORT SYSTEM
PROTEIN P37


(Mycoplasma
genitalium)
PF06646
(Mycoplasma_p37)
4 PHE A  36
LEU A  59
VAL A 312
ASP A  90
None
1.14A 4g3rA-3myuA:
undetectable
4g3rA-3myuA:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 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)
0.98A 4g3rA-3pvlA:
undetectable
4g3rA-3pvlA:
20.39
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.
3sqz PUTATIVE
HYDROXYMETHYLGLUTARY
L-COA SYNTHASE


(Streptococcus
mutans)
PF00195
(Chal_sti_synt_N)
PF08540
(HMG_CoA_synt_C)
4 LEU A  95
VAL A  92
VAL A  82
ASP A  50
None
1.03A 4g3rA-3sqzA:
undetectable
4g3rA-3sqzA:
20.56
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.
3t6g SH2
DOMAIN-CONTAINING
PROTEIN 3C


(Homo sapiens)
PF00617
(RasGEF)
4 PHE A 586
LEU A 590
VAL A 444
ASP A 441
None
0.91A 4g3rA-3t6gA:
undetectable
4g3rA-3t6gA:
22.68
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.
3tov GLYCOSYL TRANSFERASE
FAMILY 9


(Veillonella
parvula)
PF01075
(Glyco_transf_9)
4 LEU A 249
VAL A  49
VAL A  61
ASP A  43
None
0.96A 4g3rA-3tovA:
undetectable
4g3rA-3tovA:
22.15
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.
3tr9 DIHYDROPTEROATE
SYNTHASE


(Coxiella
burnetii)
PF00809
(Pterin_bind)
4 PHE A 202
LEU A 172
VAL A 175
VAL A 231
None
0.91A 4g3rA-3tr9A:
undetectable
4g3rA-3tr9A:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 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)
1.01A 4g3rA-3ubcA:
undetectable
4g3rA-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
0.84A 4g3rA-3umfA:
undetectable
4g3rA-3umfA:
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.
4arc LEUCINE--TRNA LIGASE

(Escherichia
coli)
PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1)
PF13603
(tRNA-synt_1_2)
4 PHE A 253
LEU A 259
VAL A 245
VAL A 408
None
1.12A 4g3rA-4arcA:
undetectable
4g3rA-4arcA:
18.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
1.09A 4g3rA-4b8jA:
undetectable
4g3rA-4b8jA:
21.86
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.
4bgq CYCLIN-DEPENDENT
KINASE-LIKE 5


(Homo sapiens)
PF00069
(Pkinase)
4 PHE A 297
LEU A 277
VAL A 197
VAL A 112
None
1.07A 4g3rA-4bgqA:
undetectable
4g3rA-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
1.14A 4g3rA-4booA:
undetectable
4g3rA-4booA:
19.41
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.
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
1.07A 4g3rA-4bplA:
undetectable
4g3rA-4bplA:
22.91
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.
4bru ATP-DEPENDENT RNA
HELICASE DHH1


(Saccharomyces
cerevisiae)
PF00270
(DEAD)
PF00271
(Helicase_C)
4 PHE A 100
VAL A 134
VAL A 121
ASP A 195
None
1.08A 4g3rA-4bruA:
undetectable
4g3rA-4bruA:
20.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4c9m CYTOCHROME P450

(Novosphingobium
aromaticivorans)
PF00067
(p450)
4 TYR A  98
LEU A 252
VAL A 303
ASP A 305
None
HEM  A1418 (-4.0A)
GOL  A1419 (-3.9A)
HEM  A1418 (-2.7A)
0.60A 4g3rA-4c9mA:
58.2
4g3rA-4c9mA:
44.92
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.
4ehc PE-PGRS FAMILY
PROTEIN


(Mycobacterium
tuberculosis)
no annotation 4 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.93A 4g3rA-4ehcA:
undetectable
4g3rA-4ehcA:
18.75
Potential target for repurposing, i.e. matched protein structure has less than 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
1.11A 4g3rA-4eutA:
undetectable
4g3rA-4eutA:
20.56
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.
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
1.10A 4g3rA-4euuA:
undetectable
4g3rA-4euuA:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
1.10A 4g3rA-4g1pA:
undetectable
4g3rA-4g1pA:
22.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hdt 3-HYDROXYISOBUTYRYL-
COA HYDROLASE


(Mycolicibacterium
thermoresistibile)
PF16113
(ECH_2)
4 PHE A 172
LEU A 153
VAL A 118
VAL A 129
None
1.11A 4g3rA-4hdtA:
undetectable
4g3rA-4hdtA:
19.86
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.
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
1.15A 4g3rA-4jlcA:
undetectable
4g3rA-4jlcA:
20.36
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.
4lqz UNCHARACTERIZED
PROTEIN


(Staphylococcus
aureus)
PF16253
(DUF4909)
4 PHE A  79
TYR A 100
VAL A  72
ASP A  70
None
1.14A 4g3rA-4lqzA:
undetectable
4g3rA-4lqzA:
14.98
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.
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 4g3rA-4n0rA:
undetectable
4g3rA-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.
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
1.11A 4g3rA-4ol9A:
undetectable
4g3rA-4ol9A:
20.48
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.
4oqf PROTEIN RECA

(Mycobacterium
tuberculosis)
PF00154
(RecA)
4 LEU A  78
VAL A  81
VAL A 117
ASP A  95
None
1.13A 4g3rA-4oqfA:
undetectable
4g3rA-4oqfA:
21.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p3m SERINE
HYDROXYMETHYLTRANSFE
RASE


(Psychromonas
ingrahamii)
PF00464
(SHMT)
4 PHE A 302
LEU A  32
VAL A 344
VAL A 389
None
1.12A 4g3rA-4p3mA:
undetectable
4g3rA-4p3mA:
23.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pav GLYOXALASE FAMILY
PROTEIN


(Staphylococcus
aureus)
PF00903
(Glyoxalase)
4 PHE A 120
LEU A  50
VAL A  48
VAL A  71
None
1.09A 4g3rA-4pavA:
undetectable
4g3rA-4pavA:
14.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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)
1.03A 4g3rA-4stdA:
undetectable
4g3rA-4stdA:
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.
4wgk NEUTRAL CERAMIDASE

(Homo sapiens)
PF04734
(Ceramidase_alk)
PF17048
(Ceramidse_alk_C)
4 PHE A 341
VAL A 283
VAL A 287
ASP A 293
None
1.05A 4g3rA-4wgkA:
undetectable
4g3rA-4wgkA:
20.68
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.
4wy8 ESTERASE

(Rhizomucor
miehei)
PF07859
(Abhydrolase_3)
4 PHE A 128
TYR A 225
LEU A 169
VAL A 172
None
1.06A 4g3rA-4wy8A:
undetectable
4g3rA-4wy8A:
22.38
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.
4y96 TRIOSEPHOSPHATE
ISOMERASE


(Gemmata
obscuriglobus)
PF00121
(TIM)
4 PHE A 163
TYR A 202
VAL A 151
VAL A 117
None
0.90A 4g3rA-4y96A:
undetectable
4g3rA-4y96A:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ypv EST8

(Parvibaculum)
PF07859
(Abhydrolase_3)
4 PHE A 125
TYR A 220
LEU A 164
VAL A 167
None
1.07A 4g3rA-4ypvA:
undetectable
4g3rA-4ypvA:
23.20
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.
5a2r ANGIOTENSIN-CONVERTI
NG ENZYME


(Drosophila
melanogaster)
PF01401
(Peptidase_M2)
4 PHE A 363
LEU A 433
VAL A 283
ASP A 360
None
1.09A 4g3rA-5a2rA:
undetectable
4g3rA-5a2rA:
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.
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
1.06A 4g3rA-5cayG:
undetectable
4g3rA-5cayG:
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.
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
0.96A 4g3rA-5cayG:
undetectable
4g3rA-5cayG:
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.
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
1.14A 4g3rA-5ed1A:
undetectable
4g3rA-5ed1A:
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.
5en6 SMU-1

(Caenorhabditis
elegans)
no annotation 4 TYR A  78
LEU A  61
VAL A  64
ASP A 102
None
1.15A 4g3rA-5en6A:
undetectable
4g3rA-5en6A:
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.
5euf PROTEASE

(Helicobacter
pylori)
PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C)
4 TYR A 281
LEU A 359
VAL A 356
VAL A 277
None
1.11A 4g3rA-5eufA:
undetectable
4g3rA-5eufA:
23.48
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.
5f5v PRP38

(Chaetomium
thermophilum)
PF03371
(PRP38)
4 TYR A 105
LEU A 119
VAL A  65
VAL A  56
None
0.97A 4g3rA-5f5vA:
undetectable
4g3rA-5f5vA:
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.
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
1.10A 4g3rA-5f7sA:
undetectable
4g3rA-5f7sA:
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.
5gte LACHRYMATORY-FACTOR
SYNTHASE


(Allium cepa)
PF10604
(Polyketide_cyc2)
4 PHE A 104
TYR A 114
LEU A 152
VAL A  73
None
0.90A 4g3rA-5gteA:
undetectable
4g3rA-5gteA:
15.79
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.
5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER


(Shigella
flexneri)
PF02395
(Peptidase_S6)
4 PHE A 745
LEU A 758
VAL A 732
VAL A 705
None
1.12A 4g3rA-5j44A:
undetectable
4g3rA-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.
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 4g3rA-5k53A:
undetectable
4g3rA-5k53A:
21.78
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.
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
0.94A 4g3rA-5lddB:
undetectable
4g3rA-5lddB:
21.72
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.
5lmx DNA-DIRECTED RNA
POLYMERASES I AND
III SUBUNIT
RPAC1,DNA-DIRECTED
RNA POLYMERASES I
AND III SUBUNIT
RPAC1


(Saccharomyces
cerevisiae)
PF01000
(RNA_pol_A_bac)
PF01193
(RNA_pol_L)
4 PHE C 251
LEU C 280
VAL C 289
ASP C 273
PHE  C 251 ( 1.3A)
LEU  C 280 ( 0.5A)
VAL  C 289 ( 0.5A)
ASP  C 273 ( 0.6A)
1.02A 4g3rA-5lmxC:
undetectable
4g3rA-5lmxC:
22.79
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.
5nil MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB


(Escherichia
coli)
PF00005
(ABC_tran)
PF02687
(FtsX)
PF12704
(MacB_PCD)
4 LEU J 358
VAL J 365
VAL J 449
ASP J 405
None
1.00A 4g3rA-5nilJ:
undetectable
4g3rA-5nilJ:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ns8 -

(-)
no annotation 4 PHE A 152
LEU A  91
VAL A  83
ASP A 100
None
1.15A 4g3rA-5ns8A:
undetectable
4g3rA-5ns8A:
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.
5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1


(Homo sapiens)
PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9)
4 PHE A3619
LEU A3664
VAL A3648
ASP A3642
None
1.12A 4g3rA-5nugA:
undetectable
4g3rA-5nugA:
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.
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
1.05A 4g3rA-5sy7B:
undetectable
4g3rA-5sy7B:
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.
5tpj DENOVO NTF2

(synthetic
construct)
PF12680
(SnoaL_2)
4 PHE A  89
LEU A  17
VAL A  62
VAL A  76
None
1.12A 4g3rA-5tpjA:
undetectable
4g3rA-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.
5uco 2,4,6-TRIHYDROXYBENZ
OPHENONE SYNTHASE


(Hypericum
androsaemum)
no annotation 4 TYR A 304
LEU A 321
VAL A 317
VAL A 383
None
1.03A 4g3rA-5ucoA:
undetectable
4g3rA-5ucoA:
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
1.14A 4g3rA-5v1mA:
undetectable
4g3rA-5v1mA:
18.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vmb SERINE
HYDROXYMETHYLTRANSFE
RASE


(Acinetobacter
baumannii)
PF00464
(SHMT)
4 PHE A 301
LEU A  31
VAL A 343
VAL A 388
None
1.03A 4g3rA-5vmbA:
undetectable
4g3rA-5vmbA:
19.92
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.
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 4g3rA-5wtnA:
undetectable
4g3rA-5wtnA:
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.
5x2g CRISPR-ASSOCIATED
ENDONUCLEASE CAS9


(Campylobacter
jejuni)
no annotation 4 PHE A   7
LEU A 467
VAL A 473
VAL A 679
None
1.11A 4g3rA-5x2gA:
undetectable
4g3rA-5x2gA:
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.
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
1.09A 4g3rA-5yewB:
undetectable
4g3rA-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.
6co0 STYRYLPYRONE
SYNTHASE 1


(Piper
methysticum)
no annotation 4 PHE A 374
LEU A 311
VAL A 314
VAL A 370
None
1.14A 4g3rA-6co0A:
undetectable
4g3rA-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.
6cph TCR BETA CHAIN

(Homo sapiens)
no annotation 4 TYR E 167
LEU E 130
VAL E  12
ASP E 169
None
1.15A 4g3rA-6cphE:
undetectable
4g3rA-6cphE:
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.
6fml RUVB-LIKE HELICASE

(Chaetomium
thermophilum)
no annotation 4 PHE D 349
LEU D 303
VAL D 300
VAL D 323
None
1.05A 4g3rA-6fmlD:
undetectable
4g3rA-6fmlD:
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
1.12A 4g3rA-6guiA:
undetectable
4g3rA-6guiA:
undetectable