SIMILAR PATTERNS OF AMINO ACIDS FOR 1KXH_A_ACRA598_2

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

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

(Homo sapiens) 		PF00018
(SH3_1) 		3 TRP A  44
TYR A  55
LEU A  27
 None
 1.01A 1kxhA-1awxA:
undetectable		 1kxhA-1awxA:
12.50
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.
1bev BOVINE ENTEROVIRUS
COAT PROTEINS VP1 TO
VP4

(Enterovirus E) 		PF00073
(Rhv) 		3 TRP 2  78
TYR 2  79
LEU 2 206
 None
 1.08A 1kxhA-1bev2:
undetectable		 1kxhA-1bev2:
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.
1ej6 LAMBDA1

(Reovirus sp.) 		no annotation 3 TRP B 951
TYR B 948
LEU B 362
 None
 1.04A 1kxhA-1ej6B:
undetectable		 1kxhA-1ej6B:
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.
1fbw ENDO-1,4-BETA-GLUCAN
ASE F

([Clostridium]
cellulolyticum) 		PF02011
(Glyco_hydro_48) 		3 TRP A 362
TYR A 393
LEU A 295
 None
 0.93A 1kxhA-1fbwA:
0.4		 1kxhA-1fbwA:
22.08
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.
1fgp FD GENE 3 PROTEIN

(Enterobacteria
phage fd) 		PF05357
(Phage_Coat_A) 		3 TRP A  56
TYR A  32
LEU A  36
 None
 0.98A 1kxhA-1fgpA:
undetectable		 1kxhA-1fgpA:
8.91
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.
1h39 SQUALENE--HOPENE
CYCLASE

(Alicyclobacillus
acidocaldarius) 		PF13243
(SQHop_cyclase_C)
PF13249
(SQHop_cyclase_N) 		3 TRP A  32
TYR A  31
LEU A 340
 None
 0.79A 1kxhA-1h39A:
undetectable		 1kxhA-1h39A:
19.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jae ALPHA-AMYLASE

(Tenebrio
molitor) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C) 		3 TRP A  57
TYR A  60
LEU A 153
 None
 0.23A 1kxhA-1jaeA:
52.3		 1kxhA-1jaeA:
43.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jxk ALPHA-AMYLASE,
SALIVARY

(Homo sapiens) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C) 		3 TRP A  59
TYR A  62
LEU A 165
 None
 0.24A 1kxhA-1jxkA:
50.1		 1kxhA-1jxkA:
46.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1m4x PBCV-1 VIRUS CAPSID

(Paramecium
bursaria
Chlorella virus
1) 		PF04451
(Capsid_NCLDV)
PF16903
(Capsid_N) 		3 TRP A 264
TYR A 417
LEU A 119
 None
 0.90A 1kxhA-1m4xA:
undetectable		 1kxhA-1m4xA:
22.47
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.
1nlf REGULATORY PROTEIN
REPA

(Escherichia
coli) 		PF13481
(AAA_25) 		3 TRP A 208
TYR A  22
LEU A  66
 None
 1.09A 1kxhA-1nlfA:
undetectable		 1kxhA-1nlfA:
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.
1oa3 ENDO-BETA-1-4-GLUCAN
ASE

(Trichoderma
citrinoviride) 		PF01670
(Glyco_hydro_12) 		3 TRP A 144
TYR A 178
LEU A 117
 None
 1.10A 1kxhA-1oa3A:
undetectable		 1kxhA-1oa3A:
20.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ose PORCINE
ALPHA-AMYLASE

(Sus scrofa) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C) 		3 TRP A  59
TYR A  62
LEU A 165
 AC1  A 990 ( 3.9A)
AC1  A 992 ( 3.6A)
AC1  A 990 ( 4.8A)
 0.23A 1kxhA-1oseA:
50.9		 1kxhA-1oseA:
47.90
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.
1s16 TOPOISOMERASE IV
SUBUNIT B

(Escherichia
coli) 		PF00204
(DNA_gyraseB)
PF02518
(HATPase_c) 		3 TRP A1255
TYR A1318
LEU A1223
 None
 0.86A 1kxhA-1s16A:
undetectable		 1kxhA-1s16A:
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.
1ul1 FLAP ENDONUCLEASE-1

(Homo sapiens) 		PF00752
(XPG_N)
PF00867
(XPG_I) 		3 TRP X 298
TYR X  83
LEU X 153
 None
 0.99A 1kxhA-1ul1X:
undetectable		 1kxhA-1ul1X:
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.
1vme FLAVOPROTEIN

(Thermotoga
maritima) 		PF00258
(Flavodoxin_1) 		3 TRP A  57
TYR A  43
LEU A  53
 None
 1.07A 1kxhA-1vmeA:
undetectable		 1kxhA-1vmeA:
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.
1wfi NUCLEAR DISTRIBUTION
GENE C HOMOLOG

(Mus musculus) 		PF04969
(CS) 		3 TRP A  91
TYR A  61
LEU A  19
 None
 0.98A 1kxhA-1wfiA:
undetectable		 1kxhA-1wfiA:
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.
1wl7 ARABINANASE-TS

(Geobacillus
thermodenitrificans) 		PF04616
(Glyco_hydro_43) 		3 TRP A 305
TYR A 312
LEU A 259
 None
 0.82A 1kxhA-1wl7A:
undetectable		 1kxhA-1wl7A:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yc9 MULTIDRUG RESISTANCE
PROTEIN

(Vibrio cholerae) 		PF02321
(OEP) 		3 TRP A  69
TYR A 193
LEU A 469
 None
 0.96A 1kxhA-1yc9A:
undetectable		 1kxhA-1yc9A:
24.25
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.
1yrw PROTEIN ARNA

(Escherichia
coli) 		PF00551
(Formyl_trans_N)
PF02911
(Formyl_trans_C) 		3 TRP A 210
TYR A 234
LEU A 296
 None
 1.10A 1kxhA-1yrwA:
undetectable		 1kxhA-1yrwA:
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.
2bw3 TRANSPOSASE

(Musca domestica) 		PF05699
(Dimer_Tnp_hAT)
PF10683
(DBD_Tnp_Hermes) 		3 TRP A 543
TYR A 436
LEU A 562
 None
 0.95A 1kxhA-2bw3A:
undetectable		 1kxhA-2bw3A:
20.50
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.
2ce9 TRANSDUCIN-LIKE
ENHANCER PROTEIN 1

(Homo sapiens) 		PF00400
(WD40) 		3 TRP A 671
TYR A 729
LEU A 694
 None
 1.11A 1kxhA-2ce9A:
undetectable		 1kxhA-2ce9A:
25.81
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.
2coc FYVE, RHOGEF AND PH
DOMAIN CONTAINING
PROTEIN 3

(Homo sapiens) 		no annotation 3 TRP A  75
TYR A  85
LEU A  16
 None
 0.88A 1kxhA-2cocA:
undetectable		 1kxhA-2cocA:
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.
2ddu REELIN

(Mus musculus) 		no annotation 3 TRP A1590
TYR A1485
LEU A1478
 None
 0.78A 1kxhA-2dduA:
undetectable		 1kxhA-2dduA:
22.36
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.
2ebe HYPOTHETICAL PROTEIN
TTHA0061

(Thermus
thermophilus) 		PF11482
(DUF3208) 		3 TRP A  12
TYR A  58
LEU A  60
 None
 0.98A 1kxhA-2ebeA:
undetectable		 1kxhA-2ebeA:
11.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fry CYTOPLASMIC PROTEIN
NCK2

(Homo sapiens) 		PF00018
(SH3_1) 		3 TRP A  40
TYR A  56
LEU A   8
 None
 1.07A 1kxhA-2fryA:
undetectable		 1kxhA-2fryA:
9.92
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.
2g8g CAPSID

(Adeno-associated
dependoparvovirus
A) 		PF00740
(Parvo_coat) 		3 TRP A 270
TYR A 272
LEU A 243
 None
 1.07A 1kxhA-2g8gA:
undetectable		 1kxhA-2g8gA:
22.18
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.
2gm8 TENA HOMOLOG/THI-4
THIAMINASE

(Pyrobaculum
aerophilum) 		PF03070
(TENA_THI-4) 		3 TRP A 160
TYR A 157
LEU A 149
 None
 0.94A 1kxhA-2gm8A:
undetectable		 1kxhA-2gm8A:
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.
2nn5 HYPOTHETICAL PROTEIN
EF_2215

(Enterococcus
faecalis) 		PF08327
(AHSA1) 		3 TRP A  28
TYR A  30
LEU A 100
 None
 1.02A 1kxhA-2nn5A:
undetectable		 1kxhA-2nn5A:
16.45
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.
2snv SINDBIS VIRUS COAT
PROTEIN

(Sindbis virus) 		PF00944
(Peptidase_S3) 		3 TRP A 247
TYR A 162
LEU A 231
 None
 1.06A 1kxhA-2snvA:
undetectable		 1kxhA-2snvA:
14.92
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.
2wjv REGULATOR OF
NONSENSE TRANSCRIPTS
1

(Homo sapiens) 		PF04851
(ResIII)
PF09416
(UPF1_Zn_bind)
PF13086
(AAA_11)
PF13087
(AAA_12) 		3 TRP A 739
TYR A 868
LEU A 708
 None
 1.11A 1kxhA-2wjvA:
undetectable		 1kxhA-2wjvA:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xzl ATP-DEPENDENT
HELICASE NAM7

(Saccharomyces
cerevisiae) 		PF09416
(UPF1_Zn_bind)
PF13086
(AAA_11)
PF13087
(AAA_12) 		3 TRP A 675
TYR A 804
LEU A 644
 1PE  A1863 ( 4.3A)
1PE  A1858 (-3.5A)
None
 1.10A 1kxhA-2xzlA:
undetectable		 1kxhA-2xzlA:
19.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xzo REGULATOR OF
NONSENSE TRANSCRIPTS
1

(Homo sapiens) 		PF04851
(ResIII)
PF13086
(AAA_11)
PF13087
(AAA_12) 		3 TRP A 739
TYR A 868
LEU A 708
 None
 1.03A 1kxhA-2xzoA:
undetectable		 1kxhA-2xzoA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2y3a PHOSPHATIDYLINOSITOL
-4,5-BISPHOSPHATE
3-KINASE CATALYTIC
SUBUNIT BETA ISOFORM

(Mus musculus) 		PF00454
(PI3_PI4_kinase)
PF00613
(PI3Ka)
PF00792
(PI3K_C2)
PF00794
(PI3K_rbd)
PF02192
(PI3K_p85B) 		3 TRP A 592
TYR A 616
LEU A 603
 None
 1.00A 1kxhA-2y3aA:
undetectable		 1kxhA-2y3aA:
17.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zj9 AMPC

(Escherichia
coli) 		PF00144
(Beta-lactamase) 		3 TRP A  93
TYR A  92
LEU A 109
 None
 1.10A 1kxhA-2zj9A:
undetectable		 1kxhA-2zj9A:
21.59
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.
3c0i PERIPHERAL PLASMA
MEMBRANE PROTEIN
CASK

(Homo sapiens) 		PF00069
(Pkinase) 		3 TRP A 275
TYR A 284
LEU A 288
 None
 1.04A 1kxhA-3c0iA:
undetectable		 1kxhA-3c0iA:
20.74
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.
3djl PROTEIN AIDB

(Escherichia
coli) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M) 		3 TRP A 279
TYR A 208
LEU A 210
 None
 0.92A 1kxhA-3djlA:
undetectable		 1kxhA-3djlA:
20.58
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.
3gyc PUTATIVE GLYCOSIDE
HYDROLASE

(Parabacteroides
distasonis) 		PF12876
(Cellulase-like) 		3 TRP A 193
TYR A 142
LEU A 144
 None
None
EDO  A   5 (-3.9A)
 0.81A 1kxhA-3gycA:
6.9		 1kxhA-3gycA:
20.25
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.
3gym PROSTASIN

(Homo sapiens) 		PF00089
(Trypsin) 		3 TRP A 207
TYR A 208
LEU A 134
 None
 1.00A 1kxhA-3gymA:
undetectable		 1kxhA-3gymA:
21.84
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.
3keh GLUCOCEREBROSIDASE

(Homo sapiens) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		3 TRP A 312
TYR A 313
LEU A 286
 None
 1.10A 1kxhA-3kehA:
1.6		 1kxhA-3kehA:
20.11
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.
3kie CAPSID PROTEIN VP1

(Adeno-associated
dependoparvovirus
A) 		PF00740
(Parvo_coat) 		3 TRP A 279
TYR A 281
LEU A 249
 None
 1.10A 1kxhA-3kieA:
undetectable		 1kxhA-3kieA:
21.22
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.
3l1w UNCHARACTERIZED
PROTEIN

(Enterococcus
faecalis) 		PF03372
(Exo_endo_phos) 		3 TRP A 114
TYR A  90
LEU A  61
 EDO  A 262 (-4.1A)
None
None
 1.08A 1kxhA-3l1wA:
undetectable		 1kxhA-3l1wA:
18.64
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.
3lqj MLL1 PHD3-BROMO

(Homo sapiens) 		PF00628
(PHD) 		3 TRP A1768
TYR A1607
LEU A1636
 None
 0.95A 1kxhA-3lqjA:
undetectable		 1kxhA-3lqjA:
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.
3ne9 PHOSPHOPANTETHEINE
PROTEIN TRANSFERASE,
PPT1P

(Corynebacterium
ammoniagenes) 		PF01648
(ACPS) 		3 TRP A  80
TYR A 151
LEU A 132
 None
 1.07A 1kxhA-3ne9A:
undetectable		 1kxhA-3ne9A:
15.74
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.
3oxh RV0577 PROTEIN

(Mycobacterium
tuberculosis) 		PF00903
(Glyoxalase) 		3 TRP A 205
TYR A  80
LEU A 144
 None
 1.06A 1kxhA-3oxhA:
undetectable		 1kxhA-3oxhA:
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.
3py7 MALTOSE-BINDING
PERIPLASMIC
PROTEIN,PAXILLIN
LD1,PROTEIN E6
CHIMERA

(Deltapapillomavirus
4;
Escherichia
coli;
Homo sapiens) 		PF00518
(E6)
PF01547
(SBP_bac_1) 		3 TRP A 405
TYR A 433
LEU A 410
 None
 1.10A 1kxhA-3py7A:
undetectable		 1kxhA-3py7A:
22.59
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.
3qlt GLUTAMATE RECEPTOR,
IONOTROPIC KAINATE 2

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		3 TRP A 265
TYR A 293
LEU A 251
 None
 1.10A 1kxhA-3qltA:
undetectable		 1kxhA-3qltA:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rha PUTRESCINE OXIDASE

(Paenarthrobacter
aurescens) 		PF01593
(Amino_oxidase) 		3 TRP A 386
TYR A 396
LEU A 292
 FDA  A 483 (-3.0A)
FDA  A 483 (-4.3A)
None
 1.09A 1kxhA-3rhaA:
undetectable		 1kxhA-3rhaA:
22.72
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.
3rms UNCHARACTERIZED
PROTEIN

(Saccharomonospora
viridis) 		PF16827
(zf-HC3) 		3 TRP A   6
TYR A  16
LEU A  32
 None
None
GOL  A 115 (-4.8A)
 1.00A 1kxhA-3rmsA:
undetectable		 1kxhA-3rmsA:
12.95
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.
3s98 INTERFERON
ALPHA/BETA RECEPTOR
1

(Homo sapiens) 		PF01108
(Tissue_fac)
PF09294
(Interfer-bind) 		3 TRP A 143
TYR A 171
LEU A 108
 NAG  A 307 (-4.1A)
None
None
 0.96A 1kxhA-3s98A:
undetectable		 1kxhA-3s98A:
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.
3ux1 CAPSID PROTEIN VP1

(Adeno-associated
dependoparvovirus
A) 		PF00740
(Parvo_coat) 		3 TRP A 281
TYR A 283
LEU A 249
 None
 1.10A 1kxhA-3ux1A:
undetectable		 1kxhA-3ux1A:
21.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vm5 ALPHA-AMYLASE

(Oryzias latipes) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C) 		3 TRP A  59
TYR A  62
LEU A 165
 None
 0.25A 1kxhA-3vm5A:
49.8		 1kxhA-3vm5A:
45.45
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.
3wcy INTERFERON
ALPHA/BETA RECEPTOR
1

(Mus musculus) 		PF01108
(Tissue_fac)
PF09294
(Interfer-bind) 		3 TRP A 144
TYR A 172
LEU A 109
 None
 0.89A 1kxhA-3wcyA:
undetectable		 1kxhA-3wcyA:
20.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zc7 ADENOSINE
MONOPHOSPHATE-PROTEI
N TRANSFERASE VBHT

(Bartonella
schoenbuchensis) 		PF02661
(Fic) 		3 TRP A  74
TYR A  20
LEU A  31
 None
 0.92A 1kxhA-3zc7A:
undetectable		 1kxhA-3zc7A:
21.27
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.
3zcb ADENOSINE
MONOPHOSPHATE-PROTEI
N TRANSFERASE VBHT

(Bartonella
schoenbuchensis) 		PF02661
(Fic) 		3 TRP A  74
TYR A  20
LEU A  31
 None
None
GOL  A1199 ( 4.9A)
 0.90A 1kxhA-3zcbA:
undetectable		 1kxhA-3zcbA:
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.
3zj0 ACETYLTRANSFERASE

(Oceanicola
granulosus) 		PF00583
(Acetyltransf_1) 		3 TRP A  88
TYR A  50
LEU A  18
 None
 1.07A 1kxhA-3zj0A:
undetectable		 1kxhA-3zj0A:
17.19
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.
4by6 GENERAL NEGATIVE
REGULATOR OF
TRANSCRIPTION
SUBUNIT 1
GENERAL NEGATIVE
REGULATOR OF
TRANSCRIPTION
SUBUNIT 2

(Saccharomyces
cerevisiae) 		PF04054
(Not1)
PF04153
(NOT2_3_5) 		3 TRP B  60
TYR A1806
LEU A1785
 None
 1.05A 1kxhA-4by6B:
undetectable		 1kxhA-4by6B:
17.33
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.
4el8 GLYCOSIDE HYDROLASE
FAMILY 48

(Caldicellulosiruptor
bescii) 		PF02011
(Glyco_hydro_48) 		3 TRP A 363
TYR A 394
LEU A 296
 None
SO4  A 702 (-3.7A)
None
 0.92A 1kxhA-4el8A:
undetectable		 1kxhA-4el8A:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fus RTX TOXINS AND
RELATED CA2+-BINDING
PROTEIN

(Hahella
chejuensis) 		PF02011
(Glyco_hydro_48) 		3 TRP A 396
TYR A 429
LEU A 327
 None
EDO  A 824 ( 3.6A)
EDO  A 814 (-4.5A)
 1.00A 1kxhA-4fusA:
undetectable		 1kxhA-4fusA:
22.44
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.
4g1p CYS-GLY
METALLODIPEPTIDASE
DUG1

(Saccharomyces
cerevisiae) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		3 TRP A 145
TYR A 100
LEU A  98
 None
 1.08A 1kxhA-4g1pA:
undetectable		 1kxhA-4g1pA:
21.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gl9 TYROSINE-PROTEIN
KINASE

(Mus musculus) 		PF07714
(Pkinase_Tyr) 		3 TRP A1038
TYR A1021
LEU A1078
 None
 0.85A 1kxhA-4gl9A:
undetectable		 1kxhA-4gl9A:
16.70
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.
4hvi TYROSINE-PROTEIN
KINASE JAK3

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		3 TRP A1011
TYR A 994
LEU A1050
 None
 0.88A 1kxhA-4hviA:
undetectable		 1kxhA-4hviA:
18.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hvq 3-HYDROXYANTHRANILAT
E 3,4-DIOXYGENASE

(Cupriavidus
metallidurans) 		PF06052
(3-HAO) 		3 TRP A 123
TYR A  50
LEU A 131
 None
 1.08A 1kxhA-4hvqA:
undetectable		 1kxhA-4hvqA:
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.
4jjj CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Thermobifida
fusca) 		PF02011
(Glyco_hydro_48) 		3 TRP A 365
TYR A 396
LEU A 296
 None
 0.91A 1kxhA-4jjjA:
undetectable		 1kxhA-4jjjA:
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.
4jp0 43.8 KDA
INSECTICIDAL CRYSTAL
PROTEIN

(Bacillus
thuringiensis) 		PF05431
(Toxin_10) 		3 TRP A  47
TYR A  18
LEU A  32
 None
 1.04A 1kxhA-4jp0A:
undetectable		 1kxhA-4jp0A:
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.
4krt AUTOLYTIC LYSOZYME

(Clostridium
phage phiSM101) 		PF01183
(Glyco_hydro_25)
PF08239
(SH3_3) 		3 TRP A 255
TYR A 256
LEU A 221
 None
ACT  A 404 ( 4.6A)
None
 1.03A 1kxhA-4krtA:
2.1		 1kxhA-4krtA:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lnv THIOESTER-CONTAINING
PROTEIN I

(Anopheles
gambiae) 		PF00207
(A2M)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl) 		3 TRP A1064
TYR A1063
LEU A1096
 None
 0.96A 1kxhA-4lnvA:
undetectable		 1kxhA-4lnvA:
16.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oet PUTATIVE PEPTIDE
ABC-TRANSPORT SYSTEM
PERIPLASMIC
PEPTIDE-BINDING
PROTEIN

(Campylobacter
jejuni) 		PF00496
(SBP_bac_5) 		3 TRP A 492
TYR A 490
LEU A  32
 None
 1.11A 1kxhA-4oetA:
undetectable		 1kxhA-4oetA:
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.
4oli NON-RECEPTOR
TYROSINE-PROTEIN
KINASE TYK2

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		3 TRP A1085
TYR A1068
LEU A1124
 None
 0.93A 1kxhA-4oliA:
undetectable		 1kxhA-4oliA:
20.35
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.
4pc4 30K LIPOPROTEIN

(Bombyx mori) 		PF03260
(Lipoprotein_11) 		3 TRP A 186
TYR A 156
LEU A 107
 None
 0.88A 1kxhA-4pc4A:
undetectable		 1kxhA-4pc4A:
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.
4pib INCLUSION BODY
PROTEIN

(Burkholderia
thailandensis) 		PF12306
(PixA) 		3 TRP A 183
TYR A 160
LEU A 105
 None
 1.00A 1kxhA-4pibA:
undetectable		 1kxhA-4pibA:
18.49
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.
4q88 UNCHARACTERIZED
PROTEIN

(Bacteroides
vulgatus) 		PF07470
(Glyco_hydro_88) 		3 TRP A 271
TYR A 270
LEU A 321
 None
 1.04A 1kxhA-4q88A:
undetectable		 1kxhA-4q88A:
21.41
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.
4qf1 INFERRED UNMUTATED
ANCESTOR (UA) OF
ANTI-HIV ANTIBODY
CH59

(Homo sapiens) 		no annotation 3 TRP L  35
TYR L  34
LEU L  28
 None
 1.07A 1kxhA-4qf1L:
undetectable		 1kxhA-4qf1L:
19.67
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.
4qx8 LYSINE-SPECIFIC
DEMETHYLASE 2A

(Mus musculus) 		PF02373
(JmjC) 		3 TRP A 221
TYR A 199
LEU A 201
 None
 1.08A 1kxhA-4qx8A:
undetectable		 1kxhA-4qx8A:
21.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uon CAPSID PROTEASE

(Aura virus) 		PF00944
(Peptidase_S3) 		3 TRP A 250
TYR A 165
LEU A 234
 None
 1.04A 1kxhA-4uonA:
undetectable		 1kxhA-4uonA:
17.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4x4y HUMAN VARIABLE HEAVY
CHAIN OF HERCEPTIN
HUMAN VARIABLE LIGHT
CHAIN OF HERCEPTIN

(Homo sapiens) 		PF07686
(V-set) 		3 TRP A  99
TYR A 105
LEU B  46
 None
 0.87A 1kxhA-4x4yA:
undetectable		 1kxhA-4x4yA:
18.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xwl EXOGLUCANASE S

(Clostridium
cellulovorans) 		PF02011
(Glyco_hydro_48) 		3 TRP A 354
TYR A 385
LEU A 287
 None
P33  A 705 (-3.9A)
None
 0.83A 1kxhA-4xwlA:
undetectable		 1kxhA-4xwlA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5b0s LIN0857 PROTEIN

(Listeria
innocua) 		PF04041
(Glyco_hydro_130) 		3 TRP A 260
TYR A 202
LEU A 204
 None
 1.09A 1kxhA-5b0sA:
undetectable		 1kxhA-5b0sA:
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.
5bv9 CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Bacillus
pumilus) 		PF02011
(Glyco_hydro_48) 		3 TRP A 362
TYR A 393
LEU A 292
 None
GOL  A 816 (-3.6A)
None
 0.98A 1kxhA-5bv9A:
undetectable		 1kxhA-5bv9A:
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.
5diz PROTEINACEOUS RNASE
P 2

(Arabidopsis
thaliana) 		PF16953
(PRORP)
PF17177
(PPR_long) 		3 TRP A 425
TYR A 424
LEU A 305
 None
 0.97A 1kxhA-5dizA:
undetectable		 1kxhA-5dizA:
21.38
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.
5dt9 ERYTHRONATE-4-PHOSPH
ATE DEHYDROGENASE

(Vibrio cholerae) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C)
PF11890
(DUF3410) 		3 TRP A 351
TYR A 265
LEU A 267
 None
 1.08A 1kxhA-5dt9A:
undetectable		 1kxhA-5dt9A:
21.74
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.
5eul AYC08

(Vicugna pacos) 		PF07686
(V-set) 		3 TRP V  36
TYR V  96
LEU V   4
 None
 1.00A 1kxhA-5eulV:
undetectable		 1kxhA-5eulV:
14.48
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.
5f1z NON-RECEPTOR
TYROSINE-PROTEIN
KINASE TYK2

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		3 TRP A1085
TYR A1068
LEU A1124
 None
 0.88A 1kxhA-5f1zA:
undetectable		 1kxhA-5f1zA:
18.22
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.
5gm3 ENDOGLUCANASE-1

(Aspergillus
aculeatus) 		PF01670
(Glyco_hydro_12) 		3 TRP A 146
TYR A 180
LEU A 119
 None
 1.11A 1kxhA-5gm3A:
undetectable		 1kxhA-5gm3A:
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.
5hp5 PROTEIN-ARGININE
DEIMINASE TYPE-1

(Homo sapiens) 		PF03068
(PAD)
PF08526
(PAD_N)
PF08527
(PAD_M) 		3 TRP A 467
TYR A 578
LEU A 574
 None
 0.77A 1kxhA-5hp5A:
undetectable		 1kxhA-5hp5A:
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.
5icl LIPOATE--PROTEIN
LIGASE

(Enterococcus
faecalis) 		PF03099
(BPL_LplA_LipB)
PF10437
(Lip_prot_lig_C) 		3 TRP A 228
TYR A  20
LEU A  33
 None
 1.06A 1kxhA-5iclA:
undetectable		 1kxhA-5iclA:
22.96
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.
5idq SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Burkholderia
vietnamiensis) 		PF00106
(adh_short) 		3 TRP A 176
TYR A 218
LEU A 223
 None
 1.00A 1kxhA-5idqA:
undetectable		 1kxhA-5idqA:
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.
5jpn COMPLEMENT C4-A

(Homo sapiens) 		PF00207
(A2M)
PF01821
(ANATO)
PF07678
(A2M_comp)
PF10569
(Thiol-ester_cl) 		3 TRP B1230
TYR B1229
LEU B1289
 None
 1.06A 1kxhA-5jpnB:
undetectable		 1kxhA-5jpnB:
20.52
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.
5m2d ENDOGLUCANASE-LIKE
PROTEIN

(Acremonium
chrysogenum) 		no annotation 3 TRP A 151
TYR A 185
LEU A 124
 None
 1.02A 1kxhA-5m2dA:
undetectable		 1kxhA-5m2dA:
18.71
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.
5mje NANOBODY 8

(Lama glama) 		PF07686
(V-set) 		3 TRP B  38
TYR B 102
LEU B   6
 None
 1.02A 1kxhA-5mjeB:
undetectable		 1kxhA-5mjeB:
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.
5noa FAMILY 88 GLYCOSYL
HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF07470
(Glyco_hydro_88) 		3 TRP A 274
TYR A 273
LEU A 324
 None
 1.00A 1kxhA-5noaA:
undetectable		 1kxhA-5noaA:
21.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u3p DH511.4 FAB HEAVY
CHAIN
DH511.4 FAB LIGHT
CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 TRP H  33
TYR H 100
LEU L  96
 None
 0.92A 1kxhA-5u3pH:
undetectable		 1kxhA-5u3pH:
20.26
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.
5uh0 MEMBRANE-BOUND LYTIC
MUREIN
TRANSGLYCOSYLASE F

(Yersinia pestis) 		PF00497
(SBP_bac_3) 		3 TRP A 230
TYR A 126
LEU A 257
 None
 1.08A 1kxhA-5uh0A:
undetectable		 1kxhA-5uh0A:
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.
5vl1 LYSINE--TRNA LIGASE

(Mycobacterium
ulcerans) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		3 TRP A 136
TYR A 116
LEU A  80
 None
 0.97A 1kxhA-5vl1A:
undetectable		 1kxhA-5vl1A:
21.67
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.
5wtf VP0
VP1

(Hepatovirus A) 		PF00073
(Rhv)
PF12944
(HAV_VP) 		3 TRP B 180
TYR B 165
LEU A 136
 None
 1.03A 1kxhA-5wtfB:
undetectable		 1kxhA-5wtfB:
19.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5x2b SULFOTRANSFERASE

(Mus musculus) 		no annotation 3 TRP D 252
TYR D 255
LEU D 145
 None
 0.91A 1kxhA-5x2bD:
undetectable		 1kxhA-5x2bD:
10.65
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.
5yj6 DOCKERIN TYPE I
REPEAT-CONTAINING
PROTEIN

(Ruminiclostridium
thermocellum) 		no annotation 3 TRP A 390
TYR A 421
LEU A 323
 None
 0.86A 1kxhA-5yj6A:
undetectable		 1kxhA-5yj6A:
10.46
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.
5ze4 DIHYDROXY-ACID
DEHYDRATASE,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		no annotation 3 TRP A 129
TYR A 130
LEU A 153
 None
 0.87A 1kxhA-5ze4A:
undetectable		 1kxhA-5ze4A:
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.
6c7y TYROSINE-PROTEIN
KINASE JAK1

(Homo sapiens) 		no annotation 3 TRP A1065
TYR A1048
LEU A1104
 None
 0.81A 1kxhA-6c7yA:
undetectable		 1kxhA-6c7yA:
10.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6fwf NITRIC-OXIDE
REDUCTASE

(Neisseria
meningitidis) 		no annotation 3 TRP A 215
TYR A 623
LEU A 627
 None
 0.76A 1kxhA-6fwfA:
undetectable		 1kxhA-6fwfA:
10.27