SIMILAR PATTERNS OF AMINO ACIDS FOR 3APV_A_TP0A190_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.
1dxj CLASS II CHITINASE

(Canavalia
ensiformis)
PF00182
(Glyco_hydro_19)
5 VAL A  88
PHE A  61
LEU A  62
ALA A  34
SER A 149
None
1.32A 3apvA-1dxjA:
undetectable
3apvA-1dxjA:
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.
1g6o CAG-ALPHA

(Helicobacter
pylori)
PF00437
(T2SSE)
5 TYR A 326
PHE A 257
LEU A 261
ALA A 280
SER A 277
None
1.36A 3apvA-1g6oA:
0.0
3apvA-1g6oA:
19.10
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.
1h4l CELL DIVISION
PROTEIN KINASE 5


(Homo sapiens)
PF00069
(Pkinase)
5 PHE A  80
LEU A  66
ALA A 148
SER A  47
TYR A  15
None
1.44A 3apvA-1h4lA:
0.0
3apvA-1h4lA:
21.21
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.
1hjv CHITINASE-3 LIKE
PROTEIN 1


(Homo sapiens)
PF00704
(Glyco_hydro_18)
5 TYR A  27
VAL A  25
ALA A 138
SER A  95
SER A 175
NAG  A  -1 (-3.8A)
None
NAG  A  -1 ( 3.9A)
None
None
1.42A 3apvA-1hjvA:
0.0
3apvA-1hjvA:
19.56
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.
1ixr HOLLIDAY JUNCTION
DNA HELICASE RUVA


(Thermus
thermophilus)
PF01330
(RuvA_N)
PF14520
(HHH_5)
5 PHE A  71
PHE A  62
LEU A  68
GLU A  72
ARG A   3
None
1.43A 3apvA-1ixrA:
0.0
3apvA-1ixrA:
19.07
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.
1j93 UROPORPHYRINOGEN
DECARBOXYLASE


(Nicotiana
tabacum)
PF01208
(URO-D)
5 TYR A 251
PHE A 343
LEU A 300
HIS A 329
SER A 271
SO4  A 584 (-4.5A)
None
None
SO4  A 584 (-4.0A)
None
1.23A 3apvA-1j93A:
undetectable
3apvA-1j93A:
20.51
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.
1j93 UROPORPHYRINOGEN
DECARBOXYLASE


(Nicotiana
tabacum)
PF01208
(URO-D)
5 TYR A 251
PHE A 343
LEU A 300
HIS A 329
SER A 271
SO4  A 584 (-4.5A)
None
None
SO4  A 584 (-4.0A)
None
1.31A 3apvA-1j93A:
undetectable
3apvA-1j93A:
20.51
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.
1miv TRNA CCA-ADDING
ENZYME


(Geobacillus
stearothermophilus)
PF01743
(PolyA_pol)
PF12627
(PolyA_pol_RNAbd)
PF13735
(tRNA_NucTran2_2)
5 PHE A 164
LEU A 168
GLU A 167
ARG A  36
ALA A  28
None
1.37A 3apvA-1mivA:
0.0
3apvA-1mivA:
18.09
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.
1ogk DEOXYURIDINE
TRIPHOSPHATASE


(Trypanosoma
cruzi)
PF08761
(dUTPase_2)
5 PHE A 114
LEU A 105
GLU A 141
ARG A 171
SER A  85
None
1.10A 3apvA-1ogkA:
undetectable
3apvA-1ogkA:
20.14
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.
1skx ORPHAN NUCLEAR
RECEPTOR PXR


(Homo sapiens)
PF00104
(Hormone_recep)
5 PHE A 369
LEU A 342
ALA A 157
SER A 262
TYR A 263
None
1.38A 3apvA-1skxA:
undetectable
3apvA-1skxA:
19.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t1u CHOLINE
O-ACETYLTRANSFERASE


(Rattus
norvegicus)
PF00755
(Carn_acyltransf)
5 VAL A 343
PHE A 403
LEU A 300
HIS A 334
SER A 550
None
1.24A 3apvA-1t1uA:
0.0
3apvA-1t1uA:
13.79
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.
1tqy ACTINORHODIN
POLYKETIDE PUTATIVE
BETA-KETOACYL
SYNTHASE 1


(Streptomyces
coelicolor)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
5 PHE A 235
PHE A 208
LEU A 237
ALA A 107
SER A 171
None
1.47A 3apvA-1tqyA:
0.0
3apvA-1tqyA:
14.85
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.
1tuf DIAMINOPIMELATE
DECARBOXYLASE


(Methanocaldococcus
jannaschii)
PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N)
5 PHE A  65
PHE A  76
LEU A 301
SER A 308
TYR A  61
None
None
None
LLP  A  83 ( 4.7A)
None
1.43A 3apvA-1tufA:
undetectable
3apvA-1tufA:
16.48
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.
1ufo HYPOTHETICAL PROTEIN
TT1662


(Thermus
thermophilus)
no annotation 5 VAL A 118
LEU A  13
GLU A  91
ARG A  65
HIS A  62
None
1.39A 3apvA-1ufoA:
undetectable
3apvA-1ufoA:
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.
1wou THIOREDOXIN -RELATED
PROTEIN, 14 KDA


(Homo sapiens)
PF06110
(DUF953)
5 PHE A 120
LEU A  57
GLU A   6
ARG A  54
ALA A  49
None
1.13A 3apvA-1wouA:
undetectable
3apvA-1wouA:
19.27
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.
1zel HYPOTHETICAL PROTEIN
RV2827C


(Mycobacterium
tuberculosis)
PF09407
(AbiEi_1)
PF13338
(AbiEi_4)
5 VAL A   1
PHE A  99
LEU A 175
ARG A  88
ALA A  92
None
1.38A 3apvA-1zelA:
undetectable
3apvA-1zelA:
20.54
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.
1zun SULFATE
ADENYLYLTRANSFERASE
SUBUNIT 2


(Pseudomonas
syringae)
PF01507
(PAPS_reduct)
5 TYR A 196
PHE A 131
PHE A  57
HIS A  44
SER A  15
None
1.45A 3apvA-1zunA:
undetectable
3apvA-1zunA:
19.69
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.
2aex COPROPORPHYRINOGEN
III OXIDASE,
MITOCHONDRIAL


(Homo sapiens)
PF01218
(Coprogen_oxidas)
5 PHE A 339
PHE A 353
HIS A 297
SER A 364
TYR A 261
None
0.94A 3apvA-2aexA:
undetectable
3apvA-2aexA:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2j04 HYPOTHETICAL PROTEIN
YPL007C


(Saccharomyces
cerevisiae)
PF12660
(zf-TFIIIC)
5 VAL A 552
PHE A 454
LEU A 455
SER A 548
SER A 578
None
1.47A 3apvA-2j04A:
undetectable
3apvA-2j04A:
14.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x63 ALPHA-2,3-/2,8-SIALY
LTRANSFERASE


(Campylobacter
jejuni)
PF06002
(CST-I)
5 PHE A 178
LEU A 171
ALA A  51
SER A  79
SER A 132
None
None
None
None
C  A1261 (-2.8A)
1.43A 3apvA-2x63A:
undetectable
3apvA-2x63A:
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.
2yfn ALPHA-GALACTOSIDASE-
SUCROSE KINASE AGASK


([Ruminococcus]
gnavus)
PF02065
(Melibiase)
PF16874
(Glyco_hydro_36C)
PF16875
(Glyco_hydro_36N)
5 PHE A 556
PHE A 195
LEU A 193
ARG A 207
TYR A 552
None
1.50A 3apvA-2yfnA:
undetectable
3apvA-2yfnA:
13.88
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.
2zqp PREPROTEIN
TRANSLOCASE SECY
SUBUNIT


(Thermus
thermophilus)
PF00344
(SecY)
5 VAL Y 157
PHE Y  67
PHE Y  56
LEU Y  48
ALA Y 133
None
1.25A 3apvA-2zqpY:
undetectable
3apvA-2zqpY:
15.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3apu ALPHA-1-ACID
GLYCOPROTEIN 2


(Homo sapiens)
PF00061
(Lipocalin)
6 TYR A  37
GLU A  64
ARG A  90
HIS A  97
SER A  30
TYR A  27
None
PG4  A 190 (-4.1A)
PG4  A 190 (-4.3A)
None
None
PG4  A 190 ( 3.8A)
1.37A 3apvA-3apuA:
32.7
3apvA-3apuA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3apu ALPHA-1-ACID
GLYCOPROTEIN 2


(Homo sapiens)
PF00061
(Lipocalin)
6 TYR A  37
PHE A  49
LEU A  62
HIS A  97
ALA A  99
SER A 114
None
PG4  A 190 ( 4.1A)
None
None
PG4  A 190 ( 4.2A)
None
1.48A 3apvA-3apuA:
32.7
3apvA-3apuA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3apu ALPHA-1-ACID
GLYCOPROTEIN 2


(Homo sapiens)
PF00061
(Lipocalin)
12 TYR A  37
VAL A  41
PHE A  49
PHE A  51
LEU A  62
GLU A  64
ARG A  90
HIS A  97
ALA A  99
SER A 114
SER A 125
TYR A 127
None
PG4  A 190 (-4.9A)
PG4  A 190 ( 4.1A)
None
None
PG4  A 190 (-4.1A)
PG4  A 190 (-4.3A)
None
PG4  A 190 ( 4.2A)
None
PG4  A 190 ( 3.7A)
None
0.61A 3apvA-3apuA:
32.7
3apvA-3apuA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3att PUTATIVE
UNCHARACTERIZED
PROTEIN


(Mycobacterium
tuberculosis)
PF01636
(APH)
5 VAL A 244
LEU A 326
GLU A 277
ALA A 250
TYR A 315
None
1.24A 3apvA-3attA:
undetectable
3apvA-3attA:
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.
3fa5 PROTEIN OF UNKNOWN
FUNCTION (DUF849)


(Paracoccus
denitrificans)
PF05853
(BKACE)
5 VAL A 175
LEU A  19
SER A 110
SER A 112
TYR A 123
None
1.48A 3apvA-3fa5A:
undetectable
3apvA-3fa5A:
19.01
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.
3gnr OS03G0212800 PROTEIN

(Oryza sativa)
PF00232
(Glyco_hydro_1)
5 PHE A 301
LEU A 223
GLU A 305
ARG A 149
TYR A 286
PHE  A 301 ( 1.3A)
LEU  A 223 ( 0.5A)
GLU  A 305 ( 0.6A)
ARG  A 149 ( 0.6A)
TYR  A 286 ( 1.3A)
1.44A 3apvA-3gnrA:
undetectable
3apvA-3gnrA:
16.87
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.
3ho8 PYRUVATE CARBOXYLASE

(Staphylococcus
aureus)
PF00289
(Biotin_carb_N)
PF00682
(HMGL-like)
PF02436
(PYC_OADA)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
5 PHE A 598
LEU A 604
HIS A 771
ALA A 573
SER A 806
None
None
MN  A2002 (-3.5A)
None
None
1.40A 3apvA-3ho8A:
undetectable
3apvA-3ho8A:
10.09
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.
3kao TAGATOSE
1,6-DIPHOSPHATE
ALDOLASE


(Staphylococcus
aureus)
PF01791
(DeoC)
5 VAL A 203
PHE A 257
LEU A 261
ALA A  23
SER A  66
None
1.46A 3apvA-3kaoA:
undetectable
3apvA-3kaoA:
17.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kq0 ALPHA-1-ACID
GLYCOPROTEIN 1


(Homo sapiens)
PF00061
(Lipocalin)
8 PHE A  49
PHE A  51
LEU A  62
GLU A  64
ARG A  90
ALA A  99
SER A 125
TYR A 127
JIM  A 193 (-3.8A)
None
None
None
JIM  A 193 (-4.3A)
JIM  A 193 ( 4.0A)
None
None
0.80A 3apvA-3kq0A:
27.8
3apvA-3kq0A:
86.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kq0 ALPHA-1-ACID
GLYCOPROTEIN 1


(Homo sapiens)
PF00061
(Lipocalin)
5 PHE A  51
HIS A  97
ALA A  99
SER A 125
TYR A 127
None
None
JIM  A 193 ( 4.0A)
None
None
0.76A 3apvA-3kq0A:
27.8
3apvA-3kq0A:
86.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kq0 ALPHA-1-ACID
GLYCOPROTEIN 1


(Homo sapiens)
PF00061
(Lipocalin)
5 PHE A  51
LEU A  62
ARG A  90
ALA A  99
TYR A 110
None
None
JIM  A 193 (-4.3A)
JIM  A 193 ( 4.0A)
None
1.46A 3apvA-3kq0A:
27.8
3apvA-3kq0A:
86.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kq0 ALPHA-1-ACID
GLYCOPROTEIN 1


(Homo sapiens)
PF00061
(Lipocalin)
5 PHE A  51
LEU A  79
HIS A  97
SER A 125
TYR A 127
None
1.34A 3apvA-3kq0A:
27.8
3apvA-3kq0A:
86.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kq0 ALPHA-1-ACID
GLYCOPROTEIN 1


(Homo sapiens)
PF00061
(Lipocalin)
8 VAL A  41
PHE A  49
PHE A  51
LEU A  62
ARG A  90
ALA A  99
SER A 125
TYR A 127
None
JIM  A 193 (-3.8A)
None
None
JIM  A 193 (-4.3A)
JIM  A 193 ( 4.0A)
None
None
0.70A 3apvA-3kq0A:
27.8
3apvA-3kq0A:
86.24
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.
3mq3 PYRUVATE
DEHYDROGENASE
PHOSPHATASE 1


(Bos taurus)
PF00481
(PP2C)
5 VAL A 285
LEU A 136
GLU A 179
ARG A  87
ALA A  79
None
1.42A 3apvA-3mq3A:
undetectable
3apvA-3mq3A:
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.
3oee ATP SYNTHASE SUBUNIT
ALPHA


(Saccharomyces
cerevisiae)
PF00006
(ATP-synt_ab)
PF00306
(ATP-synt_ab_C)
PF02874
(ATP-synt_ab_N)
5 VAL A  97
LEU A 303
ARG A 306
ALA A 253
SER A 254
None
1.04A 3apvA-3oeeA:
undetectable
3apvA-3oeeA:
16.47
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.
3pao ADENOSINE DEAMINASE

(Pseudomonas
aeruginosa)
PF00962
(A_deaminase)
5 PHE A  59
PHE A 282
LEU A 251
SER A 138
TYR A  63
None
None
None
None
ADE  A 328 (-4.0A)
1.33A 3apvA-3paoA:
undetectable
3apvA-3paoA:
22.49
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.
3ps9 TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC


(Escherichia
coli)
PF01266
(DAO)
PF05430
(Methyltransf_30)
5 TYR A 521
PHE A 326
LEU A 322
ALA A 569
SER A 617
None
1.10A 3apvA-3ps9A:
undetectable
3apvA-3ps9A:
12.71
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.
3psf TRANSCRIPTION
ELONGATION FACTOR
SPT6


(Saccharomyces
cerevisiae)
PF14635
(HHH_7)
PF14639
(YqgF)
PF14641
(HTH_44)
PF14878
(DLD)
5 GLU A 450
HIS A 535
ALA A 521
SER A 520
TYR A 472
None
1.37A 3apvA-3psfA:
undetectable
3apvA-3psfA:
10.44
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.
3u7j RIBOSE-5-PHOSPHATE
ISOMERASE A


(Burkholderia
thailandensis)
PF06026
(Rib_5-P_isom_A)
5 PHE A 121
PHE A 211
ALA A 107
SER A  61
TYR A  87
None
None
K  A 238 (-4.2A)
None
None
1.43A 3apvA-3u7jA:
undetectable
3apvA-3u7jA:
23.79
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.
3uwq OROTIDINE
5'-PHOSPHATE
DECARBOXYLASE


(Vibrio cholerae)
PF00215
(OMPdecase)
5 LEU A 165
GLU A 161
HIS A 139
ALA A  89
SER A  90
None
1.49A 3apvA-3uwqA:
undetectable
3apvA-3uwqA:
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.
3w3e COTYLEDONEOUS
YIELDIN-LIKE PROTEIN


(Vigna
unguiculata)
PF00182
(Glyco_hydro_19)
5 VAL A  88
PHE A  61
LEU A  62
ALA A  34
SER A 149
None
1.34A 3apvA-3w3eA:
undetectable
3apvA-3w3eA:
21.05
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.
4eog PUTATIVE
UNCHARACTERIZED
PROTEIN


(Pyrococcus
furiosus)
PF09455
(Cas_DxTHG)
5 TYR A 459
PHE A 341
LEU A 351
ALA A 258
SER A 259
None
1.49A 3apvA-4eogA:
undetectable
3apvA-4eogA:
18.14
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.
4f7a PUTATIVE
UNCHARACTERIZED
PROTEIN


(Bacteroides
vulgatus)
PF12741
(SusD-like)
5 TYR A 181
LEU A 358
GLU A 149
ARG A 232
ALA A 234
None
1.46A 3apvA-4f7aA:
undetectable
3apvA-4f7aA:
15.82
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.
4fk8 FERREDOXIN--NADP
REDUCTASE


(Burkholderia
thailandensis)
PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6)
5 PHE A  82
LEU A  34
GLU A 164
ALA A 268
SER A 129
None
1.34A 3apvA-4fk8A:
undetectable
3apvA-4fk8A:
22.11
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.
4fs3 ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADPH] FABI


(Staphylococcus
aureus)
PF13561
(adh_short_C2)
5 VAL A 154
PHE A 204
LEU A 208
ALA A 190
SER A 189
None
None
None
0WD  A 301 (-3.5A)
None
1.41A 3apvA-4fs3A:
undetectable
3apvA-4fs3A:
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.
4goj PROTEIN UNC-119
HOMOLOG A


(Homo sapiens)
PF05351
(GMP_PDE_delta)
5 PHE C 159
PHE C 149
HIS C 192
SER C 218
TYR C 220
None
1.45A 3apvA-4gojC:
undetectable
3apvA-4gojC:
18.44
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.
4j9t DESIGNED UNNATURAL
AMINO ACID DEPENDENT
METALLOPROTEIN


(Micromonospora
viridifaciens)
PF13088
(BNR_2)
5 TYR A 370
LEU A 170
HIS A  69
ALA A 205
SER A 259
None
1.43A 3apvA-4j9tA:
undetectable
3apvA-4j9tA:
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.
4k0r CRYPTOCHROME-1

(Mus musculus)
PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7)
5 LEU A 385
ARG A 358
HIS A 354
ALA A 246
SER A 247
None
1.19A 3apvA-4k0rA:
undetectable
3apvA-4k0rA:
14.59
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.
4rqo L-SERINE DEHYDRATASE

(Legionella
pneumophila)
PF03313
(SDH_alpha)
PF03315
(SDH_beta)
5 TYR A 330
VAL A 428
LEU A 180
ALA A 356
SER A 352
None
1.44A 3apvA-4rqoA:
undetectable
3apvA-4rqoA:
16.01
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.
4tm3 KTZI

(Kutzneria sp.
744)
PF13434
(K_oxygenase)
5 TYR A 346
LEU A  56
GLU A 212
ARG A 104
HIS A  51
FAD  A 501 ( 4.3A)
None
None
FAD  A 501 ( 4.2A)
FAD  A 501 (-3.7A)
1.39A 3apvA-4tm3A:
undetectable
3apvA-4tm3A:
15.96
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.
4tx7 CLASS I CHITINASE

(Vigna
unguiculata)
PF00182
(Glyco_hydro_19)
5 VAL A 132
PHE A 105
LEU A 106
ALA A  78
SER A 194
None
1.34A 3apvA-4tx7A:
undetectable
3apvA-4tx7A:
20.16
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.
4um8 INTEGRIN ALPHA-V
INTEGRIN BETA-6


(Homo sapiens)
PF00362
(Integrin_beta)
PF01839
(FG-GAP)
PF08441
(Integrin_alpha2)
PF17205
(PSI_integrin)
5 PHE A 427
GLU B 291
ARG A 339
ALA A 343
SER A 279
None
None
SO4  A1597 ( 4.8A)
None
None
1.44A 3apvA-4um8A:
undetectable
3apvA-4um8A:
15.27
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.
4woy MITOCHONDRIAL
DYNAMICS PROTEIN
MID49


(Mus musculus)
PF03281
(Mab-21)
5 PHE A 173
LEU A 171
GLU A 170
ALA A 261
SER A 265
None
1.47A 3apvA-4woyA:
undetectable
3apvA-4woyA:
18.67
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.
4y9v PARTICLE-ASSOCIATED
LYASE


(Acinetobacter
virus AP22)
no annotation 5 VAL A 176
PHE A 216
PHE A 208
LEU A 318
HIS A 180
EDO  A 808 ( 3.6A)
None
None
None
EDO  A 805 (-4.6A)
1.37A 3apvA-4y9vA:
undetectable
3apvA-4y9vA:
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.
5ejj UFM1-SPECIFIC
PROTEASE


(Caenorhabditis
elegans)
PF07910
(Peptidase_C78)
5 VAL A 133
PHE A 128
PHE A 104
LEU A 106
HIS A  59
None
1.27A 3apvA-5ejjA:
undetectable
3apvA-5ejjA:
15.01
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.
5eov 16S/23S RRNA
(CYTIDINE-2'-O)-METH
YLTRANSFERASE TLYA


(Mycobacterium
tuberculosis)
PF01728
(FtsJ)
5 PHE A 240
LEU A 180
GLU A 238
ALA A  67
SER A  64
None
1.42A 3apvA-5eovA:
undetectable
3apvA-5eovA:
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.
5g5u BETA-HEXOSAMINIDASE

(Pseudomonas
aeruginosa)
PF00933
(Glyco_hydro_3)
5 TYR A 212
VAL A 215
LEU A 235
GLU A 234
SER A 223
None
1.29A 3apvA-5g5uA:
undetectable
3apvA-5g5uA:
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.
5gnm VITAMIN D(3)
25-HYDROXYLASE


(Pseudonocardia
autotrophica)
PF00067
(p450)
5 VAL A 308
PHE A  14
PHE A  18
LEU A  13
ALA A 314
None
1.42A 3apvA-5gnmA:
undetectable
3apvA-5gnmA:
18.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hjr NEUTRAL
ALPHA-GLUCOSIDASE AB


(Mus musculus)
PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
5 LEU A 304
GLU A 575
ARG A 300
ALA A 341
SER A 381
EDO  A1005 (-3.8A)
EDO  A1005 ( 4.9A)
EDO  A1005 (-4.1A)
None
None
1.22A 3apvA-5hjrA:
undetectable
3apvA-5hjrA:
12.22
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.
5jvf SITE-DETERMINING
PROTEIN


(Pseudomonas
aeruginosa)
PF10609
(ParA)
5 VAL A  79
PHE A 114
PHE A 266
LEU A 124
ALA A  47
None
1.28A 3apvA-5jvfA:
undetectable
3apvA-5jvfA:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jvf SITE-DETERMINING
PROTEIN


(Pseudomonas
aeruginosa)
PF10609
(ParA)
5 VAL A 146
PHE A 266
PHE A 114
LEU A 270
ALA A  47
None
1.47A 3apvA-5jvfA:
undetectable
3apvA-5jvfA:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l7v GLYCOSIDE HYDROLASE

(Bacteroides
vulgatus)
PF13320
(DUF4091)
5 VAL A 243
PHE A 282
PHE A 343
LEU A 347
SER A 385
None
1.42A 3apvA-5l7vA:
undetectable
3apvA-5l7vA:
15.45
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.
5n1q METHYL-COENZYME M
REDUCTASE III FROM
METHANOTHERMOCOCCUS
THERMOLITHOTROPHICUS
SUBUNIT BETA


(Methanothermococcus
thermolithotrophicus)
PF02241
(MCR_beta)
PF02783
(MCR_beta_N)
5 TYR B 127
PHE B 425
PHE B 214
SER B 177
TYR B 419
None
1.50A 3apvA-5n1qB:
undetectable
3apvA-5n1qB:
16.89
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.
5nnn CTATC

(Chaetomium
thermophilum)
PF00185
(OTCace)
PF02729
(OTCace_N)
5 PHE A1950
LEU A2247
HIS A2081
ALA A2085
SER A2118
None
1.31A 3apvA-5nnnA:
undetectable
3apvA-5nnnA:
21.79
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.
5nnn CTATC

(Chaetomium
thermophilum)
PF00185
(OTCace)
PF02729
(OTCace_N)
5 PHE A1950
LEU A2247
HIS A2081
ALA A2085
SER A2118
None
1.45A 3apvA-5nnnA:
undetectable
3apvA-5nnnA:
21.79
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.
5nno ALDEHYDE
DEHYDROGENASE


(Trypanosoma
brucei)
PF00171
(Aldedh)
5 PHE A 291
LEU A 292
GLU A 339
ARG A 283
ALA A 255
None
1.19A 3apvA-5nnoA:
undetectable
3apvA-5nnoA:
15.10
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.
5ocs PUTATIVE
NADH-DEPENTDENT
FLAVIN
OXIDOREDUCTASE


(Cupriavidus
metallidurans)
PF00724
(Oxidored_FMN)
5 VAL A  89
LEU A  13
GLU A 173
ALA A  50
SER A  48
None
0.94A 3apvA-5ocsA:
undetectable
3apvA-5ocsA:
19.26
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.
5u2l HEAT SHOCK PROTEIN
104


(Candida
albicans)
PF02861
(Clp_N)
5 VAL A  93
PHE A 128
PHE A  63
HIS A  31
ALA A  35
None
1.14A 3apvA-5u2lA:
undetectable
3apvA-5u2lA:
22.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xep CHITINASE-3-LIKE
PROTEIN 1


(Mus musculus)
no annotation 5 TYR A  27
VAL A  25
ALA A 139
SER A  96
SER A 176
None
1.47A 3apvA-5xepA:
undetectable
3apvA-5xepA:
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.
5xwb 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE


(Colwellia
psychrerythraea)
PF00275
(EPSP_synthase)
5 PHE A 414
LEU A  18
ALA A 253
SER A 393
TYR A 417
None
1.42A 3apvA-5xwbA:
undetectable
3apvA-5xwbA:
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.
5yq7 PRECURSOR FOR M
SUBUNITS OF
PHOTOSYNTHETIC
REACTION CENTER


(Roseiflexus
castenholzii)
no annotation 5 PHE M 481
LEU M 485
HIS M 500
SER M 389
SER M 448
None
1.49A 3apvA-5yq7M:
undetectable
3apvA-5yq7M:
14.52
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.
6b2y SOLUTE-BINDING
PERIPLASMIC PROTEIN
OF IRON/SIDEROPHORE
ABC TRANSPORTER


(Yersinia pestis)
no annotation 5 PHE A  28
PHE A  50
ALA A 257
SER A 339
TYR A  61
None
None
None
None
NA  A 401 (-4.3A)
1.19A 3apvA-6b2yA:
undetectable
3apvA-6b2yA:
19.04
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.
6cpy GRMZM2G135359
PSEUDOKINASE


(Zea mays)
no annotation 5 PHE A 357
LEU A 354
HIS A 284
ALA A 370
TYR A 405
None
1.41A 3apvA-6cpyA:
undetectable
3apvA-6cpyA:
16.97