SIMILAR PATTERNS OF AMINO ACIDS FOR 2WX2_A_TPFA1460

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.
1adv ADENOVIRUS
SINGLE-STRANDED
DNA-BINDING PROTEIN

(Human
mastadenovirus
C) 		PF02236
(Viral_DNA_bi)
PF03728
(Viral_DNA_Zn_bi) 		4 MET A 357
PHE A 359
ALA A 365
LEU A 390
 None
 0.95A 2wx2A-1advA:
undetectable		 2wx2A-1advA:
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.
1ggv DIENELACTONE
HYDROLASE

(Pseudomonas
putida) 		PF01738
(DLH) 		4 ALA A 216
ALA A 220
THR A 224
LEU A 164
 None
 0.91A 2wx2A-1ggvA:
undetectable		 2wx2A-1ggvA:
18.34
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.
1hl2 N-ACETYLNEURAMINATE
LYASE SUBUNIT

(Escherichia
coli) 		PF00701
(DHDPS) 		4 PHE A 100
TYR A  98
ALA A  78
THR A  14
 None
 0.61A 2wx2A-1hl2A:
undetectable		 2wx2A-1hl2A:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jwq N-ACETYLMURAMOYL-L-A
LANINE AMIDASE CWLV

(Paenibacillus
polymyxa) 		PF01520
(Amidase_3) 		4 ALA A 165
ALA A 169
THR A 173
LEU A  47
 None
 0.92A 2wx2A-1jwqA:
undetectable		 2wx2A-1jwqA:
17.16
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.
1lq2 BETA-D-GLUCAN
GLUCOHYDROLASE
ISOENZYME EXO1

(Hordeum vulgare) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C) 		4 MET A  73
PHE A  77
TYR A  92
ALA A  40
 None
 0.87A 2wx2A-1lq2A:
undetectable		 2wx2A-1lq2A:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n5x XANTHINE
DEHYDROGENASE

(Bos taurus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		4 PHE A 655
ALA A 811
ALA A 815
THR A 819
 None
 0.89A 2wx2A-1n5xA:
undetectable		 2wx2A-1n5xA:
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.
1nr6 CYTOCHROME P450 2C5

(Oryctolagus
cuniculus) 		PF00067
(p450) 		4 PHE A 114
ALA A 294
THR A 298
LEU A 359
 DIF  A 501 (-4.5A)
DIF  A 501 ( 3.3A)
HEM  A 500 ( 3.6A)
DIF  A 501 (-4.4A)
 0.86A 2wx2A-1nr6A:
32.1		 2wx2A-1nr6A:
26.09
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.
1oae CYTOCHROME C'

(Methylophilus
methylotrophus) 		PF09086
(DUF1924) 		4 TYR A  10
ALA A 110
ALA A 114
THR A 118
 None
 0.96A 2wx2A-1oaeA:
undetectable		 2wx2A-1oaeA:
12.96
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.
1s4o GLYCOLIPID
2-ALPHA-MANNOSYLTRAN
SFERASE

(Saccharomyces
cerevisiae) 		PF01793
(Glyco_transf_15) 		4 TYR A 319
ALA A 370
ALA A 368
LEU A 348
 None
 0.95A 2wx2A-1s4oA:
undetectable		 2wx2A-1s4oA:
20.66
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.
1soi MUTT/NUDIX FAMILY
PROTEIN

(Deinococcus
radiodurans) 		PF00293
(NUDIX) 		4 ALA A  62
ALA A  66
THR A  70
LEU A  28
 None
 0.88A 2wx2A-1soiA:
undetectable		 2wx2A-1soiA:
16.03
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.
1t34 ATRIAL NATRIURETIC
PEPTIDE RECEPTOR A

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		4 ALA A 111
ALA A 109
THR A 106
LEU A 104
 None
 0.90A 2wx2A-1t34A:
undetectable		 2wx2A-1t34A:
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.
1t3q QUINOLINE
2-OXIDOREDUCTASE
MEDIUM SUBUNIT

(Pseudomonas
putida) 		PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C) 		4 ALA C 240
ALA C 244
THR C 248
LEU C 213
 None
 0.57A 2wx2A-1t3qC:
undetectable		 2wx2A-1t3qC:
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.
1wyt GLYCINE
DEHYDROGENASE
(DECARBOXYLATING)
SUBUNIT 1
GLYCINE
DEHYDROGENASE
SUBUNIT 2
(P-PROTEIN)

(Thermus
thermophilus) 		PF02347
(GDC-P) 		4 PHE A 269
ALA A 327
ALA A 331
LEU B  42
 None
 0.79A 2wx2A-1wytA:
undetectable		 2wx2A-1wytA:
23.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1x8v CYTOCHROME P450 51

(Mycobacterium
tuberculosis) 		PF00067
(p450) 		5 MET A  79
PHE A  83
ALA A 256
THR A 260
LEU A 321
 ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
 0.95A 2wx2A-1x8vA:
37.9		 2wx2A-1x8vA:
32.11
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.
1z9d URIDYLATE KINASE

(Streptococcus
pyogenes) 		PF00696
(AA_kinase) 		4 MET A 219
ALA A  34
ALA A  36
LEU A  51
 None
 0.80A 2wx2A-1z9dA:
undetectable		 2wx2A-1z9dA:
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.
2bd0 SEPIAPTERIN
REDUCTASE

(Chlorobaculum
tepidum) 		PF00106
(adh_short) 		5 PHE A  32
ALA A  26
ALA A  58
THR A  60
LEU A  38
 None
 1.34A 2wx2A-2bd0A:
undetectable		 2wx2A-2bd0A:
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.
2c0h MANNAN
ENDO-1,4-BETA-MANNOS
IDASE

(Mytilus edulis) 		PF00150
(Cellulase) 		4 MET A 107
ALA A 162
ALA A 160
LEU A 125
 None
 0.91A 2wx2A-2c0hA:
undetectable		 2wx2A-2c0hA:
21.36
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.
2cfo GLUTAMYL-TRNA
SYNTHETASE

(Synechococcus
elongatus) 		PF00749
(tRNA-synt_1c) 		4 ALA A 268
ALA A 272
THR A 276
LEU A  28
 None
 0.87A 2wx2A-2cfoA:
undetectable		 2wx2A-2cfoA:
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.
2f5x BUGD

(Bordetella
pertussis) 		PF03401
(TctC) 		4 MET A 229
ALA A  23
ALA A  27
LEU A  34
 None
 0.94A 2wx2A-2f5xA:
undetectable		 2wx2A-2f5xA:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hpi DNA POLYMERASE III
ALPHA SUBUNIT

(Thermus
aquaticus) 		PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6) 		4 TYR A 331
ALA A 353
ALA A 355
LEU A 391
 None
 0.96A 2wx2A-2hpiA:
undetectable		 2wx2A-2hpiA:
17.28
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.
2iml HYPOTHETICAL PROTEIN

(Archaeoglobus
fulgidus) 		PF04289
(DUF447) 		4 ALA A  64
ALA A  17
THR A  52
LEU A  47
 None
None
FMN  A 200 (-3.7A)
FMN  A 200 (-4.5A)
 0.95A 2wx2A-2imlA:
undetectable		 2wx2A-2imlA:
18.28
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.
2ix2 DNA POLYMERASE
SLIDING CLAMP B

(Sulfolobus
solfataricus) 		PF00705
(PCNA_N) 		5 MET A 157
TYR A 177
ALA A 147
THR A 138
LEU A 181
 None
 1.44A 2wx2A-2ix2A:
undetectable		 2wx2A-2ix2A:
18.92
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.
2m5t HUMAN RHINOVIRUS 2A
PROTEINASE

(Rhinovirus C) 		PF00947
(Pico_P2A) 		4 ALA A  30
ALA A  33
THR A 120
LEU A  93
 None
 0.92A 2wx2A-2m5tA:
undetectable		 2wx2A-2m5tA:
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.
2mas INOSINE-URIDINE
NUCLEOSIDE
N-RIBOHYDROLASE

(Crithidia
fasciculata) 		PF01156
(IU_nuc_hydro) 		4 MET A 235
TYR A 229
ALA A 199
ALA A 197
 None
 0.91A 2wx2A-2masA:
undetectable		 2wx2A-2masA:
22.88
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.
2pth PEPTIDYL-TRNA
HYDROLASE

(Escherichia
coli) 		PF01195
(Pept_tRNA_hydro) 		4 ALA A 164
ALA A 168
THR A 172
LEU A  89
 None
 0.94A 2wx2A-2pthA:
undetectable		 2wx2A-2pthA:
16.77
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.
2pzi PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNG

(Mycobacterium
tuberculosis) 		PF00069
(Pkinase)
PF16918
(PknG_TPR)
PF16919
(PknG_rubred) 		4 ALA A 571
ALA A 575
THR A 579
LEU A 547
 None
 0.87A 2wx2A-2pziA:
undetectable		 2wx2A-2pziA:
21.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vpn PERIPLASMIC
SUBSTRATE BINDING
PROTEIN

(Halomonas
elongata) 		PF03480
(DctP) 		5 MET A 213
PHE A  18
TYR A   5
ALA A 238
ALA A 234
 None
 1.43A 2wx2A-2vpnA:
undetectable		 2wx2A-2vpnA:
21.29
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.
2w1p
AQUAPORIN PIP2-7 7

(Komagataella
pastoris) 		PF00230
(MIP) 		4 PHE A  56
ALA A 144
ALA A 148
THR A 152
 None
 0.65A 2wx2A-2w1pA:
undetectable		 2wx2A-2w1pA:
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.
2ymv ACG NITROREDUCTASE

(Mycolicibacterium
smegmatis) 		no annotation 4 ALA A  19
ALA A  15
THR A  11
LEU A   7
 None
 0.96A 2wx2A-2ymvA:
undetectable		 2wx2A-2ymvA:
22.29
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.
3god CAS1

(Pseudomonas
aeruginosa) 		PF01867
(Cas_Cas1) 		4 ALA A 233
ALA A 237
THR A 241
LEU A 313
 None
 0.75A 2wx2A-3godA:
undetectable		 2wx2A-3godA:
22.80
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.
3hbd CLASS IV CHITINASE
CHIA4-PA2

(Picea abies) 		PF00182
(Glyco_hydro_19) 		4 TYR A  77
ALA A  82
ALA A  84
LEU A 103
 None
 0.96A 2wx2A-3hbdA:
undetectable		 2wx2A-3hbdA:
19.00
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.
3kf3 INVERTASE

(Schwanniomyces
occidentalis) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		4 MET A  48
ALA A 311
ALA A 309
LEU A  54
 None
 0.96A 2wx2A-3kf3A:
undetectable		 2wx2A-3kf3A:
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.
3krv HYDROLASE

(Geobacillus
stearothermophilus) 		PF04199
(Cyclase) 		4 MET A  42
ALA A 194
ALA A 196
THR A   7
 None
 0.95A 2wx2A-3krvA:
undetectable		 2wx2A-3krvA:
20.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ksw STEROL 14-ALPHA
DEMETHYLASE

(Trypanosoma
cruzi) 		PF00067
(p450) 		5 MET A 106
PHE A 110
ALA A 287
ALA A 291
THR A 295
 VNF  A 490 ( 3.8A)
None
VNF  A 490 ( 3.9A)
VNF  A 490 ( 4.0A)
VNF  A 490 ( 4.0A)
 0.52A 2wx2A-3kswA:
43.3		 2wx2A-3kswA:
97.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ksw STEROL 14-ALPHA
DEMETHYLASE

(Trypanosoma
cruzi) 		PF00067
(p450) 		4 MET A 106
PHE A 110
TYR A 116
ALA A 287
 VNF  A 490 ( 3.8A)
None
VNF  A 490 (-4.6A)
VNF  A 490 ( 3.9A)
 0.71A 2wx2A-3kswA:
43.3		 2wx2A-3kswA:
97.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l4d STEROL 14-ALPHA
DEMETHYLASE

(Leishmania
infantum) 		PF00067
(p450) 		5 MET A 105
PHE A 109
TYR A 102
ALA A 290
THR A 294
 TPF  A 490 ( 4.0A)
TPF  A 490 (-4.5A)
HEM  A 481 (-4.7A)
TPF  A 490 ( 3.4A)
TPF  A 490 ( 3.5A)
 1.23A 2wx2A-3l4dA:
54.3		 2wx2A-3l4dA:
74.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l4d STEROL 14-ALPHA
DEMETHYLASE

(Leishmania
infantum) 		PF00067
(p450) 		7 MET A 105
PHE A 109
TYR A 115
ALA A 286
ALA A 290
THR A 294
LEU A 355
 TPF  A 490 ( 4.0A)
TPF  A 490 (-4.5A)
HEM  A 481 ( 4.9A)
TPF  A 490 (-3.4A)
TPF  A 490 ( 3.4A)
TPF  A 490 ( 3.5A)
TPF  A 490 (-4.4A)
 0.71A 2wx2A-3l4dA:
54.3		 2wx2A-3l4dA:
74.46
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.
3o4o INTERLEUKIN-1
RECEPTOR ACCESSORY
PROTEIN

(Homo sapiens) 		PF13927
(Ig_3) 		4 TYR B 101
ALA B  44
ALA B  41
LEU B  29
 NAG  B 340 (-4.0A)
None
None
None
 0.93A 2wx2A-3o4oB:
undetectable		 2wx2A-3o4oB:
21.56
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.
3oml PEROXISOMAL
MULTIFUNCTIONAL
ENZYME TYPE 2,
CG3415

(Drosophila
melanogaster) 		PF00106
(adh_short)
PF01575
(MaoC_dehydratas)
PF13452
(MaoC_dehydrat_N) 		4 TYR A 328
ALA A 334
THR A 483
LEU A 517
 None
 0.95A 2wx2A-3omlA:
undetectable		 2wx2A-3omlA:
23.97
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.
3oms PHNB PROTEIN

(Bacillus cereus) 		PF06983
(3-dmu-9_3-mt) 		4 PHE A  14
ALA A  18
THR A  26
LEU A  58
 None
 0.83A 2wx2A-3omsA:
undetectable		 2wx2A-3omsA:
15.33
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.
3p3l CYTOCHROME P450

(Streptomyces
thioluteus) 		PF00067
(p450) 		4 PHE A  89
ALA A 243
THR A 247
LEU A 290
 None
HEM  A 501 (-3.5A)
HEM  A 501 (-3.6A)
HEM  A 501 (-4.5A)
 0.87A 2wx2A-3p3lA:
29.8		 2wx2A-3p3lA:
24.03
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.
3p5m ENOYL-COA
HYDRATASE/ISOMERASE

(Mycobacterium
avium) 		PF00378
(ECH_1) 		4 ALA A 107
ALA A 109
THR A  85
LEU A 213
 None
 0.93A 2wx2A-3p5mA:
undetectable		 2wx2A-3p5mA:
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.
3pko GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE

(Lactobacillus
brevis) 		PF00348
(polyprenyl_synt) 		4 TYR A 167
ALA A 286
ALA A 290
THR A 294
 None
 0.92A 2wx2A-3pkoA:
undetectable		 2wx2A-3pkoA:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qi6 CYSTATHIONINE
GAMMA-SYNTHASE METB
(CGS)

(Mycobacterium
ulcerans) 		PF01053
(Cys_Met_Meta_PP) 		4 PHE A  83
ALA A  89
ALA A  93
LEU A 228
 None
 0.81A 2wx2A-3qi6A:
undetectable		 2wx2A-3qi6A:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qta CHEMOTAXIS PROTEIN
CHEC

(Haloarcula
marismortui) 		PF13690
(CheX) 		4 PHE A  79
ALA A  84
ALA A  88
THR A  92
 None
 0.70A 2wx2A-3qtaA:
undetectable		 2wx2A-3qtaA:
18.79
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.
3rkr SHORT CHAIN
OXIDOREDUCTASE

(uncultured
bacterium Bio5) 		PF00106
(adh_short) 		4 ALA A 213
ALA A 217
THR A 221
LEU A   4
 None
 0.74A 2wx2A-3rkrA:
undetectable		 2wx2A-3rkrA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3uon HUMAN M2 MUSCARINIC
ACETYLCHOLINE,
RECEPTOR T4 LYSOZYME
FUSION PROTEIN

(Escherichia
virus T4;
Homo sapiens) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		4 TYR A 440
ALA A 391
ALA A 395
THR A 399
 None
 0.90A 2wx2A-3uonA:
undetectable		 2wx2A-3uonA:
22.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wiw GLYCOSYL HYDROLASE
FAMILY 88

(Pedobacter
heparinus) 		PF07470
(Glyco_hydro_88) 		5 MET A 284
PHE A 294
ALA A 245
ALA A 249
LEU A 316
 None
 1.35A 2wx2A-3wiwA:
undetectable		 2wx2A-3wiwA:
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.
3zny CTX-M-12A ENZYME

(Klebsiella
pneumoniae) 		PF13354
(Beta-lactamase2) 		4 ALA A 150
ALA A 152
THR A 189
LEU A 193
 None
 0.83A 2wx2A-3znyA:
undetectable		 2wx2A-3znyA:
20.21
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.
4cgr PUTATIVE TETR-FAMILY
TRANSCRIPTIONAL
REGULATOR

(Streptomyces
coelicolor) 		PF00440
(TetR_N) 		5 TYR A  84
ALA A  38
ALA A  41
THR A  53
LEU A  50
 None
 1.15A 2wx2A-4cgrA:
undetectable		 2wx2A-4cgrA:
18.39
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.
4f92 U5 SMALL NUCLEAR
RIBONUCLEOPROTEIN
200 KDA HELICASE

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		4 MET B2109
TYR B2107
ALA B1939
ALA B1941
 None
 0.92A 2wx2A-4f92B:
undetectable		 2wx2A-4f92B:
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.
4fha DIHYDRODIPICOLINATE
SYNTHASE

(Streptococcus
pneumoniae) 		PF00701
(DHDPS) 		4 PHE A 104
ALA A  81
ALA A  48
THR A  17
 None
 0.94A 2wx2A-4fhaA:
undetectable		 2wx2A-4fhaA:
22.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4g3j STEROL
14-ALPHA-DEMETHYLASE

(Trypanosoma
brucei) 		PF00067
(p450) 		6 MET A 106
PHE A 110
TYR A 103
ALA A 287
ALA A 291
THR A 295
 VNT  A 502 ( 3.9A)
VNT  A 502 (-4.4A)
VNT  A 502 ( 4.8A)
VNT  A 502 ( 3.9A)
HEM  A 501 ( 3.5A)
VNT  A 502 ( 3.2A)
 0.94A 2wx2A-4g3jA:
55.0		 2wx2A-4g3jA:
82.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4g3j STEROL
14-ALPHA-DEMETHYLASE

(Trypanosoma
brucei) 		PF00067
(p450) 		7 MET A 106
PHE A 110
TYR A 116
ALA A 287
ALA A 291
THR A 295
LEU A 356
 VNT  A 502 ( 3.9A)
VNT  A 502 (-4.4A)
HEM  A 501 ( 4.5A)
VNT  A 502 ( 3.9A)
HEM  A 501 ( 3.5A)
VNT  A 502 ( 3.2A)
VNT  A 502 ( 4.5A)
 0.74A 2wx2A-4g3jA:
55.0		 2wx2A-4g3jA:
82.47
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.
4hnl MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Enterococcus
gallinarum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 TYR A 181
ALA A 215
ALA A 219
THR A 251
LEU A 227
 None
 1.37A 2wx2A-4hnlA:
undetectable		 2wx2A-4hnlA:
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.
4hz4 GLUTATHIONE-S-TRANSF
ERASE

(Actinobacillus
pleuropneumoniae) 		PF00043
(GST_C)
PF02798
(GST_N) 		4 ALA A 193
ALA A 197
THR A 201
LEU A  30
 None
 0.66A 2wx2A-4hz4A:
undetectable		 2wx2A-4hz4A:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4izd ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN

(Ruegeria
pomeroyi) 		PF00378
(ECH_1) 		5 MET A 159
ALA A 125
ALA A 121
THR A 148
LEU A 139
 None
 1.43A 2wx2A-4izdA:
undetectable		 2wx2A-4izdA:
21.14
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.
4j9u TRK SYSTEM POTASSIUM
UPTAKE PROTEIN TRKH

(Vibrio
parahaemolyticus) 		PF02386
(TrkH) 		4 ALA A 306
ALA A 310
THR A 314
LEU A 339
 None
 0.90A 2wx2A-4j9uA:
undetectable		 2wx2A-4j9uA:
20.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jp0 43.8 KDA
INSECTICIDAL CRYSTAL
PROTEIN

(Bacillus
thuringiensis) 		PF05431
(Toxin_10) 		4 MET A 257
PHE A 259
TYR A 283
THR A 179
 None
 0.90A 2wx2A-4jp0A:
undetectable		 2wx2A-4jp0A:
21.19
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.
4jso OLIGOPEPTIDE ABC
TRANSPORTER,
PERIPLASMIC
OLIGOPEPTIDE-BINDING
PROTEIN

(Thermotoga
maritima) 		PF00496
(SBP_bac_5) 		4 TYR A 298
ALA A 504
ALA A 305
LEU A 313
 None
 0.93A 2wx2A-4jsoA:
undetectable		 2wx2A-4jsoA:
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.
4l0c DEFORMYLASE

(Pseudomonas
putida) 		PF12697
(Abhydrolase_6) 		4 MET A   1
PHE A  18
ALA A  42
LEU A 166
 None
 0.94A 2wx2A-4l0cA:
undetectable		 2wx2A-4l0cA:
19.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l15 FIDGETIN-LIKE
PROTEIN 1

(Caenorhabditis
elegans) 		PF00004
(AAA)
PF09336
(Vps4_C) 		4 MET A 307
PHE A 378
ALA A 404
THR A 290
 None
 0.96A 2wx2A-4l15A:
undetectable		 2wx2A-4l15A:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mt1 DRUG EFFLUX PROTEIN

(Neisseria
gonorrhoeae) 		PF00873
(ACR_tran) 		4 PHE A 626
ALA A 639
ALA A 643
THR A 647
 None
 0.85A 2wx2A-4mt1A:
undetectable		 2wx2A-4mt1A:
18.61
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.
4mxw LYMPHOTOXIN-BETA

(Homo sapiens) 		no annotation 4 TYR Y 136
ALA Y  89
THR Y 117
LEU Y 125
 None
 0.95A 2wx2A-4mxwY:
undetectable		 2wx2A-4mxwY:
17.71
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.
4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE

(Legionella
pneumophila) 		PF00701
(DHDPS) 		4 TYR A  94
ALA A  74
ALA A  41
THR A  11
 None
 0.90A 2wx2A-4nq1A:
undetectable		 2wx2A-4nq1A:
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.
4r9p RE28239P

(Drosophila
melanogaster) 		PF03166
(MH2) 		4 PHE A  98
ALA A  70
ALA A  72
LEU A  79
 None
 0.96A 2wx2A-4r9pA:
undetectable		 2wx2A-4r9pA:
18.60
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.
4u14 MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,ENDOLYSIN,MUSCARI
NIC ACETYLCHOLINE
RECEPTOR M3

(Escherichia
virus T4;
Rattus
norvegicus) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		4 TYR A 543
ALA A 494
ALA A 498
THR A 502
 None
 0.91A 2wx2A-4u14A:
undetectable		 2wx2A-4u14A:
21.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4uhi STEROL 14-ALPHA
DEMETHYLASE

(Homo sapiens) 		PF00067
(p450) 		4 PHE A 139
TYR A 145
ALA A 311
THR A 315
 VFV  A 580 (-4.2A)
HEM  A 540 (-4.5A)
HEM  A 540 ( 3.4A)
HEM  A 540 (-3.6A)
 0.55A 2wx2A-4uhiA:
43.5		 2wx2A-4uhiA:
35.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4uym 14-ALPHA STEROL
DEMETHYLASE

(Aspergillus
fumigatus) 		PF00067
(p450) 		4 PHE A 130
TYR A 136
ALA A 303
ALA A 307
 VOR  A 590 (-4.6A)
HEM  A 580 (-4.6A)
VOR  A 590 ( 4.4A)
VOR  A 590 ( 4.0A)
 0.55A 2wx2A-4uymA:
40.0		 2wx2A-4uymA:
31.30
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.
4ysw XANTHINE
DEHYDROGENASE/OXIDAS
E

(Rattus
norvegicus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		4 PHE A 655
ALA A 811
ALA A 815
THR A 819
 None
 0.84A 2wx2A-4yswA:
undetectable		 2wx2A-4yswA:
15.65
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.
4zv9 UNCHARACTERIZED
PROTEIN

(Escherichia
coli) 		PF01738
(DLH) 		4 ALA A 278
ALA A 282
THR A 286
LEU A 226
 None
 0.91A 2wx2A-4zv9A:
undetectable		 2wx2A-4zv9A:
19.74
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.
5a08 PROBABLE
MANNOSYLTRANSFERASE
KTR4

(Saccharomyces
cerevisiae) 		PF01793
(Glyco_transf_15) 		4 TYR A 342
ALA A 393
ALA A 391
LEU A 371
 None
 0.90A 2wx2A-5a08A:
undetectable		 2wx2A-5a08A:
18.77
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.
5apm VP1
VP3

(Parechovirus A) 		no annotation 4 PHE A 206
ALA A 108
THR A 216
LEU B 130
 None
 0.95A 2wx2A-5apmA:
undetectable		 2wx2A-5apmA:
17.55
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.
5ax0 RHODOPSIN I

(Acetabularia
acetabulum) 		PF01036
(Bac_rhodopsin) 		4 MET A 122
ALA A 149
ALA A 152
LEU A 181
 RET  A 301 (-3.7A)
R16  A 308 ( 3.8A)
None
None
 0.95A 2wx2A-5ax0A:
undetectable		 2wx2A-5ax0A:
20.17
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.
5c0u ALKYLMERCURY LYASE

(Escherichia
coli) 		PF03243
(MerB)
PF12324
(HTH_15) 		4 PHE A 165
ALA A 171
ALA A 175
LEU A 181
 None
 0.86A 2wx2A-5c0uA:
undetectable		 2wx2A-5c0uA:
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.
5djq CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCON1
CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCOP1

(Pseudomonas
stutzeri) 		PF00115
(COX1)
PF13442
(Cytochrome_CBB3)
PF14715
(FixP_N) 		4 MET C   1
ALA C  10
THR C  13
LEU A 271
 None
 0.90A 2wx2A-5djqC:
undetectable		 2wx2A-5djqC:
20.82
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.
5f2o FATTY ACID
O-METHYLTRANSFERASE

(Mycobacterium
marinum) 		PF03492
(Methyltransf_7) 		4 PHE A 222
TYR A 224
ALA A 258
ALA A 154
 None
5UF  A 401 ( 4.3A)
None
5UF  A 401 ( 4.9A)
 0.86A 2wx2A-5f2oA:
undetectable		 2wx2A-5f2oA:
21.92
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.
5fcl CRISPR-ASSOCIATED
ENDONUCLEASE CAS1

(Pectobacterium
atrosepticum) 		PF01867
(Cas_Cas1) 		4 ALA A 234
ALA A 238
THR A 242
LEU A 314
 None
 0.79A 2wx2A-5fclA:
undetectable		 2wx2A-5fclA:
21.62
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.
5fof LEUCYL-TRNA
SYNTHETASE

(Plasmodium
knowlesi) 		no annotation 4 MET A 535
TYR A 540
ALA A 326
THR A 320
 None
 0.92A 2wx2A-5fofA:
undetectable		 2wx2A-5fofA:
21.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5fsa CYP51 VARIANT1

(Candida
albicans) 		PF00067
(p450) 		4 PHE A 126
TYR A 132
THR A 311
LEU A 376
 X2N  A 590 (-4.8A)
HEM  A 580 (-4.1A)
HEM  A 580 (-3.6A)
X2N  A 590 (-4.3A)
 0.86A 2wx2A-5fsaA:
37.8		 2wx2A-5fsaA:
32.50
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.
5hs1 LANOSTEROL 14-ALPHA
DEMETHYLASE

(Saccharomyces
cerevisiae) 		PF00067
(p450) 		4 PHE A 134
TYR A 140
THR A 318
LEU A 380
 VOR  A 602 (-4.7A)
HEM  A 601 (-4.3A)
HEM  A 601 (-3.4A)
VOR  A 602 (-4.0A)
 0.51A 2wx2A-5hs1A:
38.0		 2wx2A-5hs1A:
29.17
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.
5hss LINALOOL
DEHYDRATASE/ISOMERAS
E

(Castellaniella
defragrans) 		no annotation 5 MET A  34
PHE A  43
ALA A  95
ALA A  71
LEU A 348
 None
 1.41A 2wx2A-5hssA:
undetectable		 2wx2A-5hssA:
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.
5hx9 BETA-LACTAMASE

(Burkholderia
vietnamiensis) 		PF13354
(Beta-lactamase2) 		4 ALA A 150
ALA A 152
THR A 189
LEU A 193
 None
 0.75A 2wx2A-5hx9A:
undetectable		 2wx2A-5hx9A:
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.
5hxw L-AMINO ACID
DEAMINASE

(Proteus
vulgaris) 		PF01266
(DAO) 		4 PHE A 201
ALA A 100
THR A 436
LEU A  65
 None
None
FAD  A 501 (-4.0A)
FAD  A 501 (-3.7A)
 0.93A 2wx2A-5hxwA:
undetectable		 2wx2A-5hxwA:
22.26
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.
5i39 L-AMINO ACID
DEAMINASE

(Proteus
vulgaris) 		PF01266
(DAO) 		4 PHE A 201
ALA A 100
THR A 436
LEU A  65
 None
None
FAD  A 501 (-3.9A)
FAD  A 501 (-3.8A)
 0.87A 2wx2A-5i39A:
undetectable		 2wx2A-5i39A:
21.40
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.
5i6c URIC ACID-XANTHINE
PERMEASE

(Aspergillus
nidulans) 		PF00860
(Xan_ur_permease) 		4 PHE A 165
ALA A 188
THR A 399
LEU A 115
 None
 0.92A 2wx2A-5i6cA:
undetectable		 2wx2A-5i6cA:
21.36
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.
5jkp UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		PF08238
(Sel1) 		4 TYR A  47
ALA A  52
ALA A  54
LEU A  87
 None
 0.91A 2wx2A-5jkpA:
undetectable		 2wx2A-5jkpA:
20.72
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.
5jlc LANOSTEROL 14-ALPHA
DEMETHYLASE

([Candida]
glabrata) 		PF00067
(p450) 		4 PHE A 135
TYR A 141
THR A 319
LEU A 381
 1YN  A 602 ( 4.6A)
HEM  A 601 (-4.2A)
HEM  A 601 ( 3.5A)
1YN  A 602 ( 4.7A)
 0.44A 2wx2A-5jlcA:
37.4		 2wx2A-5jlcA:
29.55
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.
5jm0 ALPHA-MANNOSIDASE,AL
PHA-MANNOSIDASE,ALPH
A-MANNOSIDASE

(Saccharomyces
cerevisiae) 		PF01074
(Glyco_hydro_38)
PF07748
(Glyco_hydro_38C)
PF09261
(Alpha-mann_mid) 		4 PHE A 395
ALA A 338
THR A 301
LEU A 622
 None
 0.90A 2wx2A-5jm0A:
undetectable		 2wx2A-5jm0A:
17.31
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.
5k3h ACYL-COENZYME A
OXIDASE

(Caenorhabditis
elegans) 		PF01756
(ACOX)
PF02770
(Acyl-CoA_dh_M)
PF14749
(Acyl-CoA_ox_N) 		4 ALA A 353
ALA A 357
THR A 361
LEU A 386
 None
 0.74A 2wx2A-5k3hA:
undetectable		 2wx2A-5k3hA:
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.
5lp4 PENICILLIN-BINDING
PROTEIN 2 (PBP2)

(Helicobacter
pylori) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		4 PHE A 302
ALA A 267
ALA A 159
LEU A 275
 None
 0.96A 2wx2A-5lp4A:
undetectable		 2wx2A-5lp4A:
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.
5mvd DIHYDROOROTATE
DEHYDROGENASE
(QUINONE),
MITOCHONDRIAL

(Homo sapiens) 		PF01180
(DHO_dh) 		4 MET A  43
ALA A  55
ALA A  59
THR A  63
 U91  A 403 (-4.1A)
U91  A 403 (-3.6A)
U91  A 403 (-3.3A)
U91  A 403 ( 4.9A)
 0.85A 2wx2A-5mvdA:
undetectable		 2wx2A-5mvdA:
23.45
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.
5nii THIOREDOXIN
REDUCTASE

(Desulfovibrio
vulgaris) 		no annotation 4 ALA A  14
ALA A  18
THR A  22
LEU A   6
 FAD  A 401 (-3.3A)
None
None
None
 0.95A 2wx2A-5niiA:
undetectable		 2wx2A-5niiA:
10.11
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.
5suh MSM0271 PROTEIN

(Mycolicibacterium
smegmatis) 		no annotation 4 PHE A  26
TYR A  29
ALA A 166
ALA A 162
 None
 0.82A 2wx2A-5suhA:
undetectable		 2wx2A-5suhA:
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.
5t0z LIPOPROTEIN,
PUTATIVE

(Geobacter
metallireducens) 		no annotation 4 ALA A  51
ALA A  55
THR A  59
LEU A 133
 None
 0.94A 2wx2A-5t0zA:
undetectable		 2wx2A-5t0zA:
16.88
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.
5v0i TRYPTOPHAN--TRNA
LIGASE

(Escherichia
coli) 		PF00579
(tRNA-synt_1b) 		5 PHE A  80
ALA A 313
ALA A 317
THR A 320
LEU A  91
 None
 1.38A 2wx2A-5v0iA:
undetectable		 2wx2A-5v0iA:
21.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6ay4 CYP51, STEROL
14ALPHA-DEMETHYLASE

(Naegleria
fowleri) 		no annotation 7 MET A 110
PHE A 114
TYR A 120
ALA A 289
ALA A 293
THR A 297
LEU A 358
 TPF  A 506 (-4.6A)
TPF  A 506 (-4.4A)
None
TPF  A 506 (-3.5A)
TPF  A 506 ( 3.2A)
HEM  A 501 (-3.4A)
TPF  A 506 ( 4.4A)
 0.66A 2wx2A-6ay4A:
44.6		 2wx2A-6ay4A:
36.59
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.
6bu3 BETA-LACTAMASE

(Escherichia
coli) 		no annotation 4 ALA A 150
ALA A 152
THR A 189
LEU A 193
 None
 0.85A 2wx2A-6bu3A:
undetectable		 2wx2A-6bu3A:
10.87
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.
6d47 BETA SLIDING CLAMP

(Mycobacterium
marinum) 		no annotation 5 MET A 299
PHE A 301
ALA A 273
ALA A 275
LEU A 344
 None
 1.49A 2wx2A-6d47A:
undetectable		 2wx2A-6d47A:
11.04
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.
6g3u -

(-) 		no annotation 4 TYR A   9
ALA A 609
THR A 637
LEU A 663
 None
 0.95A 2wx2A-6g3uA:
undetectable		 2wx2A-6g3uA:
undetectable