SIMILAR PATTERNS OF AMINO ACIDS FOR 4A97_H_ZPCH1318_1

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.
1air PECTATE LYASE C

(Dickeya
chrysanthemi)
PF00544
(Pec_lyase_C)
4 PHE A 103
VAL A  82
ILE A  33
GLU A  60
None
1.02A 4a97G-1airA:
undetectable
4a97G-1airA:
20.55
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.
1bf6 PHOSPHOTRIESTERASE
HOMOLOGY PROTEIN


(Escherichia
coli)
PF02126
(PTE)
4 PHE A   3
VAL A  78
ARG A 153
ILE A 122
None
1.04A 4a97G-1bf6A:
undetectable
4a97G-1bf6A:
20.62
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.
1f82 BOTULINUM NEUROTOXIN
TYPE B


(Clostridium
botulinum)
PF01742
(Peptidase_M27)
4 PHE A 154
VAL A 135
ARG A  27
ILE A 132
None
1.02A 4a97G-1f82A:
0.0
4a97G-1f82A:
20.81
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.
1kfu M-CALPAIN LARGE
SUBUNIT


(Homo sapiens)
PF00648
(Peptidase_C2)
PF01067
(Calpain_III)
PF13833
(EF-hand_8)
4 PHE L 475
VAL L 409
ILE L 499
GLU L 460
None
0.79A 4a97G-1kfuL:
0.0
4a97G-1kfuL:
17.76
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.
1nba N-CARBAMOYLSARCOSINE
AMIDOHYDROLASE


(Arthrobacter
sp.)
PF00857
(Isochorismatase)
4 VAL A  75
MET A  68
ILE A  71
GLU A 139
None
0.90A 4a97G-1nbaA:
0.0
4a97G-1nbaA:
19.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nbq JUNCTIONAL ADHESION
MOLECULE 1


(Homo sapiens)
PF07686
(V-set)
PF13927
(Ig_3)
4 PHE A  55
TYR A  52
VAL A  31
GLU A 113
None
1.09A 4a97G-1nbqA:
0.0
4a97G-1nbqA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nf2 PHOSPHATASE

(Thermotoga
maritima)
PF08282
(Hydrolase_3)
4 TYR A  36
VAL A  38
ILE A  63
GLU A 208
None
1.06A 4a97G-1nf2A:
undetectable
4a97G-1nf2A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nt2 FIBRILLARIN-LIKE
PRE-RRNA PROCESSING
PROTEIN


(Archaeoglobus
fulgidus)
PF01269
(Fibrillarin)
4 TYR A 208
VAL A 157
ILE A 130
GLU A 184
None
1.01A 4a97G-1nt2A:
0.0
4a97G-1nt2A:
21.26
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.
1qdl PROTEIN
(ANTHRANILATE
SYNTHASE
(TRPE-SUBUNIT))


(Sulfolobus
solfataricus)
PF00425
(Chorismate_bind)
PF04715
(Anth_synt_I_N)
4 TYR A  41
VAL A  43
ILE A 118
GLU A 371
None
1.00A 4a97G-1qdlA:
0.0
4a97G-1qdlA:
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.
1qjo DIHYDROLIPOAMIDE
ACETYLTRANSFERASE


(Escherichia
coli)
PF00364
(Biotin_lipoyl)
4 VAL A  65
MET A  72
ILE A  71
GLU A  38
None
0.93A 4a97G-1qjoA:
undetectable
4a97G-1qjoA:
15.61
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.
1rrh SEED LIPOXYGENASE-3

(Glycine max)
PF00305
(Lipoxygenase)
PF01477
(PLAT)
4 PHE A  53
VAL A  58
ILE A 117
ASN A 119
None
1.09A 4a97G-1rrhA:
undetectable
4a97G-1rrhA:
16.74
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.
1tp8 AGGLUTININ ALPHA
CHAIN


(Artocarpus
hirsutus)
PF01419
(Jacalin)
4 PHE A 104
TYR A  71
VAL A  81
ILE A  25
None
1.08A 4a97G-1tp8A:
undetectable
4a97G-1tp8A:
16.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1twd COPPER HOMEOSTASIS
PROTEIN CUTC


(Shigella
flexneri)
PF03932
(CutC)
4 VAL A 118
MET A 106
ILE A 109
GLU A   5
None
1.08A 4a97G-1twdA:
undetectable
4a97G-1twdA:
19.28
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.
1vpk DNA POLYMERASE III,
BETA SUBUNIT


(Thermotoga
maritima)
PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3)
4 PHE A  68
VAL A  70
MET A  78
ILE A  75
None
1.04A 4a97G-1vpkA:
undetectable
4a97G-1vpkA:
23.27
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.
1wu8 HYPOTHETICAL PROTEIN
PH0463


(Pyrococcus
horikoshii)
PF01887
(SAM_adeno_trans)
4 TYR A  85
VAL A  87
ILE A 109
GLU A 140
None
1.10A 4a97G-1wu8A:
undetectable
4a97G-1wu8A:
24.36
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.
1xew SMC PROTEIN

(Pyrococcus
furiosus)
PF02463
(SMC_N)
4 PHE X  12
TYR X  15
VAL X  82
ILE X  84
None
0.97A 4a97G-1xewX:
undetectable
4a97G-1xewX:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xl3 PROTEIN TYPE A

(Yersinia pestis)
PF09059
(TyeA)
4 PHE C  60
VAL C  16
MET C   9
ILE C  12
None
1.06A 4a97G-1xl3C:
undetectable
4a97G-1xl3C:
15.85
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.
1xmx HYPOTHETICAL PROTEIN
VC1899


(Vibrio cholerae)
PF09002
(DUF1887)
4 PHE A 106
TYR A 109
VAL A  87
ILE A   3
None
0.93A 4a97G-1xmxA:
undetectable
4a97G-1xmxA:
22.54
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.
1yal CHYMOPAPAIN

(Carica papaya)
PF00112
(Peptidase_C1)
4 VAL A 161
MET A 191
ILE A 177
ASN A 179
None
0.90A 4a97G-1yalA:
undetectable
4a97G-1yalA:
20.75
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.
2cv6 SEED STORAGE PROTEIN

(Vigna radiata)
PF00190
(Cupin_1)
4 PHE A  41
TYR A  54
VAL A  56
ILE A 128
None
0.94A 4a97G-2cv6A:
undetectable
4a97G-2cv6A:
22.54
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.
2eaa 7S GLOBULIN-3

(Vigna angularis)
PF00190
(Cupin_1)
4 PHE A  47
TYR A  60
VAL A  62
ILE A 134
None
0.89A 4a97G-2eaaA:
undetectable
4a97G-2eaaA:
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.
2f6h MYOSIN-2

(Saccharomyces
cerevisiae)
PF01843
(DIL)
4 PHE X 168
TYR X 129
VAL X 125
ILE X 175
None
1.05A 4a97G-2f6hX:
1.7
4a97G-2f6hX:
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.
2hnk SAM-DEPENDENT
O-METHYLTRANSFERASE


(Leptospira
interrogans)
PF01596
(Methyltransf_3)
4 PHE A 152
VAL A 225
ILE A 221
GLU A  66
None
None
None
SAH  A2001 ( 4.2A)
0.98A 4a97G-2hnkA:
undetectable
4a97G-2hnkA:
23.42
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.
2iuy GLYCOSYLTRANSFERASE

(Streptomyces
viridochromogenes)
PF00534
(Glycos_transf_1)
4 TYR A  39
VAL A 230
ILE A 227
GLU A 270
None
MES  A1353 (-3.4A)
None
None
1.04A 4a97G-2iuyA:
undetectable
4a97G-2iuyA:
22.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qc7 ENDOPLASMIC
RETICULUM PROTEIN
ERP29


(Homo sapiens)
PF07749
(ERp29)
PF07912
(ERp29_N)
4 PHE A  46
VAL A  91
ILE A  93
ASN A 101
None
0.96A 4a97G-2qc7A:
1.7
4a97G-2qc7A:
20.87
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.
2qn0 NEUROTOXIN

(Clostridium
botulinum)
PF01742
(Peptidase_M27)
4 TYR A 202
VAL A 379
ILE A 256
GLU A 360
None
0.92A 4a97G-2qn0A:
undetectable
4a97G-2qn0A:
22.07
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.
2r6f EXCINUCLEASE ABC
SUBUNIT A


(Geobacillus
stearothermophilus)
PF00005
(ABC_tran)
4 TYR A 315
VAL A 375
ILE A 376
ASN A 378
None
1.10A 4a97G-2r6fA:
undetectable
4a97G-2r6fA:
17.04
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.
2yqu 2-OXOGLUTARATE
DEHYDROGENASE E3
COMPONENT


(Thermus
thermophilus)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
4 TYR A 265
VAL A 303
ILE A 284
GLU A  31
FAD  A1601 (-4.8A)
None
None
FAD  A1601 (-2.7A)
0.87A 4a97G-2yquA:
undetectable
4a97G-2yquA:
20.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z3k LEUCYL/PHENYLALANYL-
TRNA-PROTEIN
TRANSFERASE


(Escherichia
coli)
PF03588
(Leu_Phe_trans)
4 TYR A  87
VAL A  89
MET A 144
ILE A 132
None
None
PHE  A 302 ( 3.6A)
None
0.80A 4a97G-2z3kA:
undetectable
4a97G-2z3kA:
20.75
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.
2zi8 PROBABLE
BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE BPHC


(Mycobacterium
tuberculosis)
PF00903
(Glyoxalase)
4 PHE A 136
VAL A 218
MET A 257
ILE A 265
None
0.90A 4a97G-2zi8A:
undetectable
4a97G-2zi8A:
21.26
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.
3al8 SEMAPHORIN-6A

(Mus musculus)
PF01403
(Sema)
PF01437
(PSI)
4 PHE A 291
TYR A 292
ILE A 295
ASN A 294
None
1.04A 4a97G-3al8A:
undetectable
4a97G-3al8A:
21.88
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.
3bm3 PSPGI RESTRICTION
ENDONUCLEASE


(Pyrococcus sp.
GI-H)
PF09019
(EcoRII-C)
4 PHE A 104
VAL A 159
ILE A 157
GLU A  60
None
1.04A 4a97G-3bm3A:
undetectable
4a97G-3bm3A:
23.82
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.
3doo SHIKIMATE
DEHYDROGENASE


(Staphylococcus
epidermidis)
PF01488
(Shikimate_DH)
PF08501
(Shikimate_dh_N)
4 TYR A  97
VAL A  84
ILE A  67
GLU A  76
None
1.00A 4a97G-3dooA:
undetectable
4a97G-3dooA:
23.42
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.
3ejg NON-STRUCTURAL
PROTEIN 3


(Human
coronavirus
229E)
PF01661
(Macro)
4 PHE A   6
TYR A  15
VAL A 150
ILE A 120
None
0.94A 4a97G-3ejgA:
undetectable
4a97G-3ejgA:
16.16
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.
3eo6 PROTEIN OF UNKNOWN
FUNCTION (DUF1255)


(Acidithiobacillus
ferrooxidans)
PF06865
(DUF1255)
4 VAL A  59
MET A  83
ILE A  57
GLU A  97
None
1.06A 4a97G-3eo6A:
undetectable
4a97G-3eo6A:
14.58
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.
3ewr NON-STRUCTURAL
PROTEIN 3


(Human
coronavirus
229E)
PF01661
(Macro)
4 PHE A   7
TYR A  16
VAL A 151
ILE A 121
None
None
APR  A 169 ( 4.6A)
None
0.90A 4a97G-3ewrA:
undetectable
4a97G-3ewrA:
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.
3eya PYRUVATE
DEHYDROGENASE
[CYTOCHROME]


(Escherichia
coli)
PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
4 TYR A 200
MET A 306
ILE A 289
GLU A 324
None
1.07A 4a97G-3eyaA:
undetectable
4a97G-3eyaA:
19.45
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.
3g0t PUTATIVE
AMINOTRANSFERASE


(Porphyromonas
gingivalis)
PF00155
(Aminotran_1_2)
4 TYR A 377
VAL A 375
MET A  48
ILE A 412
None
1.00A 4a97G-3g0tA:
undetectable
4a97G-3g0tA:
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.
3ib5 SEX PHEROMONE
PRECURSOR


(Lactobacillus
salivarius)
PF07537
(CamS)
4 TYR A 146
VAL A 147
MET A 227
ILE A 172
None
0.80A 4a97G-3ib5A:
undetectable
4a97G-3ib5A:
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.
3ihp UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 5


(Homo sapiens)
PF00443
(UCH)
PF00627
(UBA)
PF02148
(zf-UBP)
4 PHE A 461
TYR A 568
VAL A 570
ILE A 827
None
1.10A 4a97G-3ihpA:
undetectable
4a97G-3ihpA:
17.90
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.
3j82 C-TYPE LECTIN DOMAIN
FAMILY 9 MEMBER A


(Mus musculus)
PF00059
(Lectin_C)
4 TYR A 236
VAL A 198
MET A 181
ILE A 175
None
1.03A 4a97G-3j82A:
undetectable
4a97G-3j82A:
15.81
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.
3k2k PUTATIVE
CARBOXYPEPTIDASE


(Burkholderia
mallei)
PF00246
(Peptidase_M14)
4 PHE A  84
VAL A  86
MET A  55
ILE A  97
None
1.08A 4a97G-3k2kA:
undetectable
4a97G-3k2kA:
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.
3kq0 ALPHA-1-ACID
GLYCOPROTEIN 1


(Homo sapiens)
PF00061
(Lipocalin)
4 PHE A  32
TYR A  37
VAL A  41
ILE A  44
None
1.08A 4a97G-3kq0A:
undetectable
4a97G-3kq0A:
19.33
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.
3ltf PROTEIN SPITZ

(Drosophila
melanogaster)
no annotation 4 PHE D  23
VAL D  25
ILE D  27
GLU D  36
None
1.01A 4a97G-3ltfD:
undetectable
4a97G-3ltfD:
10.10
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.
3ml6 CHIMERIC COMPLEX
BETWEEN PROTEIN
DISHEVLLED2 HOMOLOG
DVL-2 AND CLATHRIN
ADAPTOR AP-2 COMPLEX
SUBUNIT MU


(Mus musculus;
Rattus
norvegicus)
PF00610
(DEP)
PF00928
(Adap_comp_sub)
4 PHE A 469
TYR A 463
VAL A 466
MET A 430
None
1.01A 4a97G-3ml6A:
undetectable
4a97G-3ml6A:
21.03
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.
3nua PHOSPHORIBOSYLAMINOI
MIDAZOLE-SUCCINOCARB
OXAMIDE SYNTHASE


(Clostridium
perfringens)
PF01259
(SAICAR_synt)
4 TYR A 226
VAL A 229
ILE A 172
GLU A 193
None
1.09A 4a97G-3nuaA:
undetectable
4a97G-3nuaA:
21.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p8s JACALIN

(Artocarpus
heterophyllus)
PF01419
(Jacalin)
4 PHE A 128
TYR A  95
VAL A 105
ILE A  49
None
1.04A 4a97G-3p8sA:
undetectable
4a97G-3p8sA:
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.
3pco PHENYLALANYL-TRNA
SYNTHETASE, BETA
CHAIN


(Escherichia
coli)
PF01588
(tRNA_bind)
PF03147
(FDX-ACB)
PF03483
(B3_4)
PF03484
(B5)
4 VAL B 250
ILE B 246
ASN B 254
GLU B 334
None
1.09A 4a97G-3pcoB:
undetectable
4a97G-3pcoB:
17.35
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.
3pg7 NEUROFIBROMIN

(Homo sapiens)
PF13716
(CRAL_TRIO_2)
4 PHE A1719
VAL A1736
ILE A1805
GLU A1794
None
1.06A 4a97G-3pg7A:
undetectable
4a97G-3pg7A:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pm0 CYTOCHROME P450 1B1

(Homo sapiens)
PF00067
(p450)
4 TYR A 214
VAL A 199
ARG A 213
ASN A 203
None
1.07A 4a97G-3pm0A:
undetectable
4a97G-3pm0A:
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.
3um6 BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE


(Plasmodium
falciparum)
PF00186
(DHFR_1)
PF00303
(Thymidylat_synt)
4 VAL A 140
MET A 104
ILE A 126
ASN A 124
None
1CY  A 609 ( 4.5A)
None
None
0.82A 4a97G-3um6A:
undetectable
4a97G-3um6A:
17.59
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.
3v9e LACCASE

(Botrytis aclada)
PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3)
4 PHE A 393
TYR A 397
VAL A 399
GLU A 390
None
1.02A 4a97G-3v9eA:
undetectable
4a97G-3v9eA:
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.
3vtz GLUCOSE
1-DEHYDROGENASE


(Thermoplasma
volcanium)
PF13561
(adh_short_C2)
4 TYR A 109
VAL A 105
ILE A 101
ASN A 106
None
0.87A 4a97G-3vtzA:
undetectable
4a97G-3vtzA:
22.35
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.
3wcy INTERFERON
ALPHA/BETA RECEPTOR
1


(Mus musculus)
PF01108
(Tissue_fac)
PF09294
(Interfer-bind)
4 TYR A 370
VAL A 372
MET A 352
ILE A 339
None
0.90A 4a97G-3wcyA:
undetectable
4a97G-3wcyA:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wiq KOJIBIOSE
PHOSPHORYLASE


(Caldicellulosiruptor
saccharolyticus)
PF03632
(Glyco_hydro_65m)
PF03633
(Glyco_hydro_65C)
PF03636
(Glyco_hydro_65N)
4 PHE A 655
VAL A 307
ILE A 311
ASN A 310
None
0.93A 4a97G-3wiqA:
1.6
4a97G-3wiqA:
16.58
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.
3wr7 SPERMIDINE
N1-ACETYLTRANSFERASE


(Escherichia
coli)
PF13302
(Acetyltransf_3)
4 TYR A  30
VAL A 122
ILE A 130
ASN A 126
COA  A 202 (-3.4A)
COA  A 202 ( 4.8A)
None
COA  A 202 ( 4.7A)
1.07A 4a97G-3wr7A:
undetectable
4a97G-3wr7A:
18.36
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.
4akd MANNOSE-SPECIFIC
LECTIN KM+


(Artocarpus
integer)
PF01419
(Jacalin)
4 PHE A 121
TYR A  83
VAL A  97
ILE A  38
None
1.07A 4a97G-4akdA:
undetectable
4a97G-4akdA:
19.22
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.
4b6z FAMILY M14
UNASSIGNED PEPTIDASE


(Burkholderia
cenocepacia)
PF00246
(Peptidase_M14)
4 PHE A  84
VAL A  86
MET A  55
ILE A  97
None
1.08A 4a97G-4b6zA:
0.6
4a97G-4b6zA:
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.
4bih UNCHARACTERIZED
LIPOPROTEIN
SAOUHSC_00053


(Staphylococcus
aureus)
PF04507
(DUF576)
4 TYR A 125
VAL A 127
ILE A 134
GLU A 122
None
1.06A 4a97G-4bihA:
undetectable
4a97G-4bihA:
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.
4bwf UBIQUITIN-CONJUGATIN
G ENZYME E2-21 KDA


(Saccharomyces
cerevisiae)
PF00179
(UQ_con)
4 ARG A 177
ILE A 102
ASN A 101
GLU A  62
None
1.08A 4a97G-4bwfA:
undetectable
4a97G-4bwfA:
19.22
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.
4c8q DNA TOPOISOMERASE
2-ASSOCIATED PROTEIN
PAT1


(Saccharomyces
cerevisiae)
PF09770
(PAT1)
4 PHE H 681
VAL H 727
ILE H 724
GLU H 701
None
None
None
CO  H1080 (-3.8A)
1.09A 4a97G-4c8qH:
undetectable
4a97G-4c8qH:
23.14
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.
4dpy MEVALONATE
DIPHOSPHATE
DECARBOXYLASE


(Staphylococcus
epidermidis)
PF00288
(GHMP_kinases_N)
4 TYR A 279
VAL A 290
ILE A 179
GLU A 269
None
0.92A 4a97G-4dpyA:
2.2
4a97G-4dpyA:
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.
4eg9 UNCHARACTERIZED
PROTEIN
SAOUHSC_02783


(Staphylococcus
aureus)
PF04507
(DUF576)
4 VAL A  95
ILE A  75
ASN A  77
GLU A 126
None
0.70A 4a97G-4eg9A:
undetectable
4a97G-4eg9A:
19.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fyc THIOL:DISULFIDE
INTERCHANGE PROTEIN
(DSBC)


(Helicobacter
pylori)
PF13098
(Thioredoxin_2)
4 PHE A  67
TYR A 116
VAL A  83
ILE A 158
None
0.96A 4a97G-4fycA:
undetectable
4a97G-4fycA:
19.23
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.
4jz7 CARBAMATE KINASE

(Giardia
intestinalis)
PF00696
(AA_kinase)
4 VAL A  49
MET A 233
ILE A   9
GLU A 106
None
1.05A 4a97G-4jz7A:
undetectable
4a97G-4jz7A:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p27 VENOM ALLERGEN-LIKE
(VAL) 4 PROTEIN


(Schistosoma
mansoni)
PF00188
(CAP)
4 PHE A  14
VAL A  18
ILE A  27
GLU A  85
None
1.00A 4a97G-4p27A:
undetectable
4a97G-4p27A:
18.57
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.
4p68 DIHYDROFOLATE
REDUCTASE


(Escherichia
coli)
PF00186
(DHFR_1)
4 VAL A  72
MET A  42
ILE A  61
ASN A  59
None
None
None
XCN  A  54 ( 3.0A)
0.85A 4a97G-4p68A:
undetectable
4a97G-4p68A:
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.
4q8k ALGINASE

(Pseudoalteromonas
sp. SM0524)
PF08787
(Alginate_lyase2)
4 PHE A 239
TYR A 395
VAL A 393
ILE A 175
None
1.03A 4a97G-4q8kA:
undetectable
4a97G-4q8kA:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q8l ALGINASE

(Pseudoalteromonas
sp. SM0524)
PF08787
(Alginate_lyase2)
4 PHE A  72
TYR A 228
VAL A 226
ILE A   8
None
1.02A 4a97G-4q8lA:
undetectable
4a97G-4q8lA:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qni UNCHARACTERIZED
PROTEIN


(Bacteroides
thetaiotaomicron)
PF14274
(DUF4361)
PF16343
(DUF4973)
4 TYR A 328
VAL A 330
ILE A 200
ASN A 202
None
None
EDO  A 403 ( 4.1A)
EDO  A 403 ( 4.9A)
1.02A 4a97G-4qniA:
undetectable
4a97G-4qniA:
20.45
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.
4rep GAMMA-CAROTENE
DESATURASE


(Nonlabens
dokdonensis)
PF01593
(Amino_oxidase)
4 VAL A 257
MET A 286
ILE A 250
GLU A 486
None
1.07A 4a97G-4repA:
undetectable
4a97G-4repA:
20.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4twf CYS-LOOP
LIGAND-GATED ION
CHANNEL


(Dickeya
chrysanthemi)
PF02931
(Neur_chan_LBD)
6 PHE A  19
TYR A  38
VAL A  40
ARG A  91
MET A  93
ILE A 101
None
0.54A 4a97G-4twfA:
33.8
4a97G-4twfA:
99.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4twf CYS-LOOP
LIGAND-GATED ION
CHANNEL


(Dickeya
chrysanthemi)
PF02931
(Neur_chan_LBD)
5 PHE A  19
VAL A  40
ARG A  91
MET A  93
ASN A 103
None
0.94A 4a97G-4twfA:
33.8
4a97G-4twfA:
99.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4yeu CYS-LOOP
LIGAND-GATED ION
CHANNEL,PROTON-GATED
ION CHANNEL


(Dickeya
chrysanthemi;
Gloeobacter
violaceus)
PF02931
(Neur_chan_LBD)
7 PHE A  19
TYR A  38
VAL A  40
ARG A  91
MET A  93
ILE A 101
ASN A 103
None
0.61A 4a97G-4yeuA:
29.4
4a97G-4yeuA:
71.88
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.
4yke MRE11

(Chaetomium
thermophilum)
PF00149
(Metallophos)
PF04152
(Mre11_DNA_bind)
4 PHE A 390
VAL A 404
ILE A 368
GLU A 385
None
1.07A 4a97G-4ykeA:
undetectable
4a97G-4ykeA:
21.01
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.
4z81 EGF FAMILY
DOMAIN-CONTAINING
PROTEIN


(Toxoplasma
gondii)
PF02430
(AMA-1)
PF07974
(EGF_2)
4 PHE A 367
TYR A 368
VAL A 370
ILE A 154
None
1.07A 4a97G-4z81A:
undetectable
4a97G-4z81A:
19.39
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.
5aee ALPHA-GLUCOSIDASE
YIHQ


(Escherichia
coli)
PF01055
(Glyco_hydro_31)
4 PHE A 530
VAL A 564
ARG A 560
ILE A 678
None
1.03A 4a97G-5aeeA:
undetectable
4a97G-5aeeA:
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.
5awf FES CLUSTER ASSEMBLY
PROTEIN SUFB


(Escherichia
coli)
PF01458
(UPF0051)
4 PHE A 471
VAL A 346
MET A 408
ILE A 377
None
1.06A 4a97G-5awfA:
undetectable
4a97G-5awfA:
19.64
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.
5c5u PROLYL 4-HYDROXYLASE

(Paramecium
bursaria
Chlorella virus
1)
PF13640
(2OG-FeII_Oxy_3)
4 PHE A 104
VAL A 140
ILE A 232
GLU A 108
None
1.08A 4a97G-5c5uA:
undetectable
4a97G-5c5uA:
18.33
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.
5cmn LATROPHILIN-3

(Homo sapiens)
PF02191
(OLF)
4 PHE E 314
VAL E 367
ILE E 364
ASN E 312
None
CA  E 401 (-4.8A)
None
CA  E 401 (-3.3A)
1.02A 4a97G-5cmnE:
undetectable
4a97G-5cmnE:
22.98
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.
5czz CRISPR-ASSOCIATED
ENDONUCLEASE CAS9


(Staphylococcus
aureus)
PF13395
(HNH_4)
PF16592
(Cas9_REC)
4 ARG A 980
ILE A 982
ASN A 995
GLU A1006
None
1.07A 4a97G-5czzA:
3.0
4a97G-5czzA:
13.78
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.
5dxv RETHREADED DHFR

(synthetic
construct)
PF00186
(DHFR_1)
4 VAL A  89
MET A  59
ILE A  78
ASN A  76
None
0.81A 4a97G-5dxvA:
undetectable
4a97G-5dxvA:
18.12
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.
5e9o CELLULASE, GLYCOSYL
HYDROLASE FAMILY 5,
TPS LINKER, DOMAIN X


(Spirochaeta
thermophila)
no annotation 4 TYR A 526
ILE A 517
ASN A 503
GLU A 461
None
0.89A 4a97G-5e9oA:
undetectable
4a97G-5e9oA:
14.19
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.
5flz SPINDLE POLE BODY
COMPONENT SPC98


(Saccharomyces
cerevisiae)
PF04130
(Spc97_Spc98)
4 TYR B 187
VAL B 188
ILE B 224
GLU B 182
None
0.97A 4a97G-5flzB:
1.3
4a97G-5flzB:
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.
5fno MANGANESE
LIPOXYGENASE


(Magnaporthe
oryzae)
PF00305
(Lipoxygenase)
4 VAL A 573
MET A 566
ILE A 569
GLU A 476
None
1.09A 4a97G-5fnoA:
undetectable
4a97G-5fnoA:
19.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ii5 MALTOSE-BINDING
PERIPLASMIC
PROTEIN,VITELLINE
ENVELOPE SPERM LYSIN
RECEPTOR


(Escherichia
coli;
Haliotis
rufescens)
PF11386
(VERL)
PF13416
(SBP_bac_8)
4 PHE A4106
VAL A4123
MET A4077
ILE A4070
None
0.81A 4a97G-5ii5A:
undetectable
4a97G-5ii5A:
19.79
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.
5l0l UNCHARACTERIZED
PROTEIN


(Legionella
pneumophila)
no annotation 4 TYR A 130
VAL A 132
MET A 224
ILE A 144
None
0.77A 4a97G-5l0lA:
undetectable
4a97G-5l0lA:
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.
5mpd 26S PROTEASOME
REGULATORY SUBUNIT
RPN6


(Saccharomyces
cerevisiae)
PF01399
(PCI)
4 VAL Q 302
MET Q 271
ILE Q 270
GLU Q 322
None
0.82A 4a97G-5mpdQ:
2.2
4a97G-5mpdQ:
21.00
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.
5n0l GTP-SENSING
TRANSCRIPTIONAL
PLEIOTROPIC
REPRESSOR CODY


(Clostridioides
difficile)
no annotation 4 PHE A  74
TYR A  78
VAL A  82
ILE A  85
ILE  A 201 ( 4.7A)
None
None
None
1.02A 4a97G-5n0lA:
undetectable
4a97G-5n0lA:
15.25
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.
5te1 ATP-CITRATE SYNTHASE

(Homo sapiens)
PF00549
(Ligase_CoA)
PF02629
(CoA_binding)
PF16114
(Citrate_bind)
4 PHE A 493
VAL A 568
ILE A 591
GLU A 683
None
1.07A 4a97G-5te1A:
undetectable
4a97G-5te1A:
16.50
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.
5tet ATP-CITRATE SYNTHASE

(Homo sapiens)
PF00549
(Ligase_CoA)
PF02629
(CoA_binding)
4 PHE B 493
VAL B 568
ILE B 591
GLU B 683
None
1.05A 4a97G-5tetB:
undetectable
4a97G-5tetB:
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.
5trv DENOVO NTF2

(synthetic
construct)
PF12680
(SnoaL_2)
5 PHE A  41
VAL A  36
MET A  88
ILE A 106
GLU A  46
PEG  A 201 (-4.3A)
None
None
None
None
1.34A 4a97G-5trvA:
undetectable
4a97G-5trvA:
17.49
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.
5u7x NOD FACTOR BINDING
LECTIN-NUCLEOTIDE
PHOSPHOHYDROLASE


(Vigna
unguiculata)
PF01150
(GDA1_CD39)
4 TYR F 209
VAL F 164
ILE F 157
GLU F 185
None
1.06A 4a97G-5u7xF:
undetectable
4a97G-5u7xF:
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.
5udy ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 7


(Homo sapiens)
PF01663
(Phosphodiest)
4 TYR A 194
VAL A  36
ILE A 243
GLU A 171
None
None
None
FUC  A 508 ( 4.3A)
1.00A 4a97G-5udyA:
undetectable
4a97G-5udyA:
20.81
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.
5uwb TOLUENE TOLERANCE
PROTEIN


(Pseudomonas
putida)
no annotation 4 TYR B 144
VAL B 164
ILE B 167
ASN B 165
PEF  B 302 (-4.0A)
PEF  B 302 ( 4.6A)
None
PEF  B 302 ( 4.1A)
0.95A 4a97G-5uwbB:
undetectable
4a97G-5uwbB:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vf3 MAJOR CAPSID PROTEIN

(Escherichia
virus T4)
PF07068
(Gp23)
4 PHE A 434
VAL A 382
ILE A 521
GLU A 360
None
1.08A 4a97G-5vf3A:
undetectable
4a97G-5vf3A:
22.07
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.
5xns CHROMOSOME PARTITION
PROTEIN SMC


(Pyrococcus
furiosus)
PF02463
(SMC_N)
4 PHE A  12
TYR A  15
VAL A  82
ILE A  84
None
1.01A 4a97G-5xnsA:
undetectable
4a97G-5xnsA:
22.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yfb DIPEPTIDYL PEPTIDASE
3


(Armillaria
tabescens)
no annotation 4 TYR A 313
VAL A 314
ILE A 164
GLU A 324
None
1.01A 4a97G-5yfbA:
undetectable
4a97G-5yfbA:
13.03
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.
6d46 BETA SLIDING CLAMP

(Rickettsia
typhi)
no annotation 4 PHE A 353
TYR A 352
VAL A 362
ILE A 376
None
0.98A 4a97G-6d46A:
undetectable
4a97G-6d46A:
17.62
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.
6f36 MITOCHONDRIAL ATP
SYNTHASE SUBUNIT
ASA6


(Polytomella sp.
Pringsheim
198.80)
no annotation 4 PHE N 129
TYR N 126
VAL N 125
ILE N 120
None
1.06A 4a97G-6f36N:
undetectable
4a97G-6f36N:
14.71