SIMILAR PATTERNS OF AMINO ACIDS FOR 4WG0_E_CHDE104

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.
1aei ANNEXIN XII

(Hydra vulgaris) 		PF00191
(Annexin) 		5 LEU A  63
LYS A  68
LEU A  67
LEU A  80
ARG A  84
 None
 0.98A 4wg0C-1aeiA:
undetectable
4wg0D-1aeiA:
undetectable
4wg0E-1aeiA:
undetectable		 4wg0C-1aeiA:
4.26
4wg0D-1aeiA:
4.26
4wg0E-1aeiA:
4.26
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.
1ctt CYTIDINE DEAMINASE

(Escherichia
coli) 		PF00383
(dCMP_cyt_deam_1)
PF08211
(dCMP_cyt_deam_2) 		5 LEU A  16
GLU A  21
LEU A  20
LEU A  59
LEU A  56
 None
 1.01A 4wg0C-1cttA:
undetectable
4wg0D-1cttA:
undetectable
4wg0E-1cttA:
undetectable		 4wg0C-1cttA:
6.47
4wg0D-1cttA:
6.47
4wg0E-1cttA:
6.47
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.
1evj GLUCOSE-FRUCTOSE
OXIDOREDUCTASE

(Zymomonas
mobilis) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 ALA A  75
TYR A  77
LEU A  39
LEU A  44
LEU A  48
 None
 0.94A 4wg0C-1evjA:
undetectable
4wg0D-1evjA:
undetectable
4wg0E-1evjA:
undetectable		 4wg0C-1evjA:
4.56
4wg0D-1evjA:
4.56
4wg0E-1evjA:
4.56
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.
1f51 SPORULATION
INITIATION
PHOSPHOTRANSFERASE B

(Bacillus
subtilis) 		PF14682
(SPOB_ab)
PF14689
(SPOB_a) 		5 ALA A 111
LEU A 110
LEU A 137
LEU A  71
LEU A 103
 None
 0.96A 4wg0C-1f51A:
undetectable
4wg0D-1f51A:
undetectable
4wg0E-1f51A:
undetectable		 4wg0C-1f51A:
5.45
4wg0D-1f51A:
5.45
4wg0E-1f51A:
5.45
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.
1f51 SPORULATION
INITIATION
PHOSPHOTRANSFERASE B

(Bacillus
subtilis) 		PF14682
(SPOB_ab)
PF14689
(SPOB_a) 		5 LEU A 137
LEU A 110
LEU A 191
ARG A 144
LEU A 146
 None
 0.99A 4wg0C-1f51A:
undetectable
4wg0D-1f51A:
undetectable
4wg0E-1f51A:
undetectable		 4wg0C-1f51A:
5.45
4wg0D-1f51A:
5.45
4wg0E-1f51A:
5.45
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.
1g59 GLUTAMYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00749
(tRNA-synt_1c) 		5 ALA A 452
LEU A 451
LEU A 401
LEU A 415
LEU A 416
 None
 0.94A 4wg0C-1g59A:
undetectable
4wg0D-1g59A:
undetectable
4wg0E-1g59A:
undetectable		 4wg0C-1g59A:
2.18
4wg0D-1g59A:
2.18
4wg0E-1g59A:
2.18
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.
1h6d PRECURSOR FORM OF
GLUCOSE-FRUCTOSE
OXIDOREDUCTASE

(Zymomonas
mobilis) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 ALA A 127
TYR A 129
LEU A  91
LEU A  96
LEU A 100
 None
None
NDP  A 500 (-3.8A)
None
None
 0.91A 4wg0C-1h6dA:
undetectable
4wg0D-1h6dA:
undetectable
4wg0E-1h6dA:
undetectable		 4wg0C-1h6dA:
3.49
4wg0D-1h6dA:
3.49
4wg0E-1h6dA:
3.49
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.
1jft PURINE NUCLEOTIDE
SYNTHESIS REPRESSOR

(Escherichia
coli) 		PF00356
(LacI)
PF13377
(Peripla_BP_3) 		5 LEU A 134
TYR A 137
GLU A 128
LEU A 130
LEU A 108
 None
 0.95A 4wg0C-1jftA:
undetectable
4wg0D-1jftA:
undetectable
4wg0E-1jftA:
undetectable		 4wg0C-1jftA:
3.90
4wg0D-1jftA:
3.90
4wg0E-1jftA:
3.90
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.
1m9i ANNEXIN VI

(Homo sapiens) 		PF00191
(Annexin) 		5 LEU A 444
GLU A 460
LEU A 462
LEU A 501
LEU A 489
 None
 0.89A 4wg0C-1m9iA:
undetectable
4wg0D-1m9iA:
undetectable
4wg0E-1m9iA:
undetectable		 4wg0C-1m9iA:
1.98
4wg0D-1m9iA:
1.98
4wg0E-1m9iA:
1.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1m9s INTERNALIN B

(Listeria
monocytogenes) 		PF08191
(LRR_adjacent)
PF09479
(Flg_new)
PF12354
(Internalin_N)
PF12799
(LRR_4)
PF13457
(SH3_8) 		5 LEU A 235
LEU A 237
ASN A 261
LEU A 223
LEU A 226
 None
 0.80A 4wg0C-1m9sA:
undetectable
4wg0D-1m9sA:
undetectable
4wg0E-1m9sA:
undetectable		 4wg0C-1m9sA:
2.49
4wg0D-1m9sA:
2.49
4wg0E-1m9sA:
2.49
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.
1mdm C-ETS-1 PROTEIN

(Mus musculus) 		PF00178
(Ets) 		6 GLU B 343
ALA B 325
LEU B 326
TYR B 329
LEU B 422
LEU B 421
 None
 1.50A 4wg0C-1mdmB:
undetectable
4wg0D-1mdmB:
undetectable
4wg0E-1mdmB:
undetectable		 4wg0C-1mdmB:
7.05
4wg0D-1mdmB:
7.05
4wg0E-1mdmB:
7.05
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.
1nne DNA MISMATCH REPAIR
PROTEIN MUTS

(Thermus
aquaticus) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		5 ALA A 351
LEU A 352
LEU A 517
LEU A 375
LEU A 378
 None
 0.98A 4wg0C-1nneA:
undetectable
4wg0D-1nneA:
undetectable
4wg0E-1nneA:
undetectable		 4wg0C-1nneA:
3.44
4wg0D-1nneA:
3.44
4wg0E-1nneA:
3.44
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.
1sif UBIQUITIN

(Homo sapiens) 		PF00240
(ubiquitin) 		5 LEU A  56
GLU A  24
LEU A  26
LEU A  43
LEU A  67
 None
 0.97A 4wg0C-1sifA:
undetectable
4wg0D-1sifA:
undetectable
4wg0E-1sifA:
undetectable		 4wg0C-1sifA:
12.24
4wg0D-1sifA:
12.24
4wg0E-1sifA:
12.24
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.
1tx4 P50-RHOGAP

(Homo sapiens) 		PF00620
(RhoGAP) 		5 LEU A 171
TYR A 168
LEU A 226
LEU A 233
LEU A 160
 None
 0.95A 4wg0C-1tx4A:
undetectable
4wg0D-1tx4A:
undetectable
4wg0E-1tx4A:
undetectable		 4wg0C-1tx4A:
6.94
4wg0D-1tx4A:
6.94
4wg0E-1tx4A:
6.94
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.
1uel UV EXCISION REPAIR
PROTEIN RAD23
HOMOLOG B

(Homo sapiens) 		PF00240
(ubiquitin) 		6 LEU A  59
TYR A  62
GLU A  28
LYS A  27
LEU A  26
LEU A  46
 None
 1.34A 4wg0C-1uelA:
undetectable
4wg0D-1uelA:
undetectable
4wg0E-1uelA:
undetectable		 4wg0C-1uelA:
8.42
4wg0D-1uelA:
8.42
4wg0E-1uelA:
8.42
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.
1ur4 GALACTANASE

(Bacillus
licheniformis) 		PF07745
(Glyco_hydro_53) 		5 ALA A 138
LEU A 139
TYR A 142
GLU A 173
LEU A 170
 None
 0.95A 4wg0C-1ur4A:
undetectable
4wg0D-1ur4A:
undetectable
4wg0E-1ur4A:
undetectable		 4wg0C-1ur4A:
3.64
4wg0D-1ur4A:
3.64
4wg0E-1ur4A:
3.64
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.
1v9c PRECORRIN-8X METHYL
MUTASE

(Thermus
thermophilus) 		PF02570
(CbiC) 		5 ALA A 154
LEU A 155
LEU A 157
LEU A 197
LEU A 200
 None
 1.00A 4wg0C-1v9cA:
undetectable
4wg0D-1v9cA:
undetectable
4wg0E-1v9cA:
undetectable		 4wg0C-1v9cA:
5.80
4wg0D-1v9cA:
5.80
4wg0E-1v9cA:
5.80
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.
2au3 DNA PRIMASE

(Aquifex
aeolicus) 		PF01807
(zf-CHC2)
PF08275
(Toprim_N)
PF13155
(Toprim_2) 		5 LEU A 152
GLU A 158
LYS A 157
LEU A 156
LEU A 171
 None
 0.90A 4wg0C-2au3A:
undetectable
4wg0D-2au3A:
undetectable
4wg0E-2au3A:
undetectable		 4wg0C-2au3A:
2.46
4wg0D-2au3A:
2.46
4wg0E-2au3A:
2.46
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.
2bex RIBONUCLEASE
INHIBITOR

(Homo sapiens) 		PF13516
(LRR_6) 		6 ALA A 202
LEU A 203
GLU A 149
LEU A 205
LEU A 233
LEU A 218
 None
 1.29A 4wg0C-2bexA:
undetectable
4wg0D-2bexA:
undetectable
4wg0E-2bexA:
undetectable		 4wg0C-2bexA:
2.65
4wg0D-2bexA:
2.65
4wg0E-2bexA:
2.65
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.
2c1u DI-HAEM CYTOCHROME C
PEROXIDASE

(Paracoccus
pantotrophus) 		PF00034
(Cytochrom_C)
PF03150
(CCP_MauG) 		5 GLU A 199
LYS A 200
LEU A 203
ASN A   7
LEU A  10
 None
 0.62A 4wg0C-2c1uA:
undetectable
4wg0D-2c1uA:
undetectable
4wg0E-2c1uA:
undetectable		 4wg0C-2c1uA:
3.59
4wg0D-2c1uA:
3.59
4wg0E-2c1uA:
3.59
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.
2een HYPOTHETICAL PROTEIN
PH1819

(Pyrococcus
horikoshii) 		PF01928
(CYTH) 		5 ALA A  48
LEU A  49
GLU A  82
LEU A  64
LEU A  96
 None
 0.92A 4wg0C-2eenA:
undetectable
4wg0D-2eenA:
undetectable
4wg0E-2eenA:
undetectable		 4wg0C-2eenA:
7.59
4wg0D-2eenA:
7.59
4wg0E-2eenA:
7.59
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.
2epk N-ACETYL-BETA-D-GLUC
OSAMINIDASE

(Streptococcus
gordonii) 		PF00728
(Glyco_hydro_20) 		5 GLU X 109
ALA X 112
LEU X 111
LEU X 387
LEU X 390
 None
 0.87A 4wg0C-2epkX:
undetectable
4wg0D-2epkX:
undetectable
4wg0E-2epkX:
undetectable		 4wg0C-2epkX:
2.80
4wg0D-2epkX:
2.80
4wg0E-2epkX:
2.80
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.
2f9t PANTOTHENATE KINASE

(Pseudomonas
aeruginosa) 		PF03309
(Pan_kinase) 		5 ALA A  66
LEU A  68
LEU A   5
LEU A  35
LEU A  39
 None
 0.95A 4wg0C-2f9tA:
undetectable
4wg0D-2f9tA:
undetectable
4wg0E-2f9tA:
undetectable		 4wg0C-2f9tA:
3.85
4wg0D-2f9tA:
3.85
4wg0E-2f9tA:
3.85
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.
2hiy HYPOTHETICAL PROTEIN

(Streptococcus
pneumoniae) 		PF08002
(DUF1697) 		5 ALA A   5
LEU A   6
LEU A  24
ARG A  25
LEU A  28
 None
 0.88A 4wg0C-2hiyA:
undetectable
4wg0D-2hiyA:
undetectable
4wg0E-2hiyA:
undetectable		 4wg0C-2hiyA:
5.62
4wg0D-2hiyA:
5.62
4wg0E-2hiyA:
5.62
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.
2iel HYPOTHETICAL PROTEIN
TT0030

(Thermus
thermophilus) 		no annotation 5 LEU A  17
GLU A  23
LYS A  22
LEU A  21
LEU A  67
 None
 0.82A 4wg0C-2ielA:
undetectable
4wg0D-2ielA:
undetectable
4wg0E-2ielA:
undetectable		 4wg0C-2ielA:
20.69
4wg0D-2ielA:
20.69
4wg0E-2ielA:
20.69
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.
2in3 HYPOTHETICAL PROTEIN

(Nitrosomonas
europaea) 		PF01323
(DSBA) 		6 LEU A   8
TYR A  33
LEU A 178
LEU A 199
ARG A 200
LEU A 203
 None
 1.21A 4wg0C-2in3A:
undetectable
4wg0D-2in3A:
undetectable
4wg0E-2in3A:
undetectable		 4wg0C-2in3A:
4.78
4wg0D-2in3A:
4.78
4wg0E-2in3A:
4.78
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.
2ixf ANTIGEN PEPTIDE
TRANSPORTER 1

(Rattus
norvegicus) 		PF00005
(ABC_tran) 		6 ALA A 631
LEU A 630
LEU A 643
LEU A 641
ARG A 671
LEU A 662
 None
 1.45A 4wg0C-2ixfA:
undetectable
4wg0D-2ixfA:
undetectable
4wg0E-2ixfA:
undetectable		 4wg0C-2ixfA:
4.18
4wg0D-2ixfA:
4.18
4wg0E-2ixfA:
4.18
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.
2jh3 RIBOSOMAL PROTEIN
S2-RELATED PROTEIN

(Deinococcus
radiodurans) 		PF01903
(CbiX) 		5 ALA A 229
LEU A 226
LEU A 222
LEU A 146
LEU A 207
 None
 0.99A 4wg0C-2jh3A:
undetectable
4wg0D-2jh3A:
undetectable
4wg0E-2jh3A:
undetectable		 4wg0C-2jh3A:
2.49
4wg0D-2jh3A:
2.49
4wg0E-2jh3A:
2.49
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.
2jqd ACIDIC LEUCINE-RICH
NUCLEAR
PHOSPHOPROTEIN 32
FAMILY MEMBER A

(Mus musculus) 		PF14580
(LRR_9) 		5 LEU A  60
LEU A  69
ASN A  89
LEU A  90
LEU A  83
 None
 0.99A 4wg0C-2jqdA:
undetectable
4wg0D-2jqdA:
undetectable
4wg0E-2jqdA:
undetectable		 4wg0C-2jqdA:
6.37
4wg0D-2jqdA:
6.37
4wg0E-2jqdA:
6.37
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.
2jzk CYANOVIRIN-N HOMOLOG

(Tuber borchii) 		PF08881
(CVNH) 		5 LEU A  12
GLU A  34
LEU A  19
LEU A  37
LEU A  71
 None
 0.99A 4wg0C-2jzkA:
undetectable
4wg0D-2jzkA:
undetectable
4wg0E-2jzkA:
undetectable		 4wg0C-2jzkA:
19.05
4wg0D-2jzkA:
19.05
4wg0E-2jzkA:
19.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2kjz ATC0852

(Agrobacterium
fabrum) 		PF00903
(Glyoxalase) 		6 ALA A  69
LEU A  68
LEU A  47
ASN A  43
LEU A  41
LEU A  25
 None
 1.25A 4wg0C-2kjzA:
undetectable
4wg0D-2kjzA:
undetectable
4wg0E-2kjzA:
undetectable		 4wg0C-2kjzA:
7.46
4wg0D-2kjzA:
7.46
4wg0E-2kjzA:
7.46
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.
2l10 TALIN-1

(Mus musculus) 		PF08913
(VBS) 		5 ALA A1245
LEU A1242
GLU A1287
LEU A1305
LEU A1349
 None
 1.00A 4wg0C-2l10A:
undetectable
4wg0D-2l10A:
undetectable
4wg0E-2l10A:
undetectable		 4wg0C-2l10A:
7.09
4wg0D-2l10A:
7.09
4wg0E-2l10A:
7.09
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.
2lak AHSA1-LIKE PROTEIN
RHE_CH02687

(Rhizobium etli) 		PF08327
(AHSA1) 		5 ALA A  18
LEU A  17
GLU A 136
LEU A 134
LEU A  27
 None
 0.92A 4wg0C-2lakA:
undetectable
4wg0D-2lakA:
undetectable
4wg0E-2lakA:
undetectable		 4wg0C-2lakA:
8.16
4wg0D-2lakA:
8.16
4wg0E-2lakA:
8.16
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.
2ngr PROTEIN (GTPASE
ACTIVATING PROTEIN
(RHG))

(Homo sapiens) 		PF00620
(RhoGAP) 		5 LEU B 391
TYR B 388
LEU B 446
LEU B 453
LEU B 380
 None
 0.91A 4wg0C-2ngrB:
undetectable
4wg0D-2ngrB:
undetectable
4wg0E-2ngrB:
undetectable		 4wg0C-2ngrB:
5.97
4wg0D-2ngrB:
5.97
4wg0E-2ngrB:
5.97
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.
2omv INTERNALIN-A

(Listeria
monocytogenes) 		PF08191
(LRR_adjacent)
PF12354
(Internalin_N)
PF12799
(LRR_4) 		5 LEU A 410
LEU A 412
ASN A 436
LEU A 398
LEU A 401
 None
 0.91A 4wg0C-2omvA:
undetectable
4wg0D-2omvA:
undetectable
4wg0E-2omvA:
undetectable		 4wg0C-2omvA:
4.76
4wg0D-2omvA:
4.76
4wg0E-2omvA:
4.76
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.
2p0t UPF0307 PROTEIN
PSPTO_4464

(Pseudomonas
syringae group
genomosp. 3) 		PF04751
(DUF615) 		6 ALA A  56
LEU A  53
GLU A  30
LEU A  32
LEU A  35
LEU A  40
 None
 1.23A 4wg0C-2p0tA:
undetectable
4wg0D-2p0tA:
undetectable
4wg0E-2p0tA:
undetectable		 4wg0C-2p0tA:
6.47
4wg0D-2p0tA:
6.47
4wg0E-2p0tA:
6.47
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.
2pqq PUTATIVE
TRANSCRIPTIONAL
REGULATOR

(Streptomyces
coelicolor) 		PF00027
(cNMP_binding) 		5 GLU A  98
ALA A  32
LEU A  31
GLU A  52
LEU A 101
 None
 0.93A 4wg0C-2pqqA:
undetectable
4wg0D-2pqqA:
undetectable
4wg0E-2pqqA:
undetectable		 4wg0C-2pqqA:
7.19
4wg0D-2pqqA:
7.19
4wg0E-2pqqA:
7.19
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.
2q01 URONATE ISOMERASE

(Caulobacter
vibrioides) 		PF02614
(UxaC) 		5 GLU A 280
LYS A 281
LEU A 284
LEU A 268
LEU A 260
 None
 0.99A 4wg0C-2q01A:
undetectable
4wg0D-2q01A:
undetectable
4wg0E-2q01A:
undetectable		 4wg0C-2q01A:
2.11
4wg0D-2q01A:
2.11
4wg0E-2q01A:
2.11
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.
2qzj TWO-COMPONENT
RESPONSE REGULATOR

(Clostridioides
difficile) 		PF00072
(Response_reg) 		5 GLU A  25
LEU A  24
LEU A  20
LEU A 108
LEU A 111
 None
 0.99A 4wg0C-2qzjA:
undetectable
4wg0D-2qzjA:
undetectable
4wg0E-2qzjA:
undetectable		 4wg0C-2qzjA:
5.88
4wg0D-2qzjA:
5.88
4wg0E-2qzjA:
5.88
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.
2wb1 DNA-DIRECTED RNA
POLYMERASERPO3
SUBUNIT

(Sulfolobus
shibatae) 		PF01000
(RNA_pol_A_bac)
PF01193
(RNA_pol_L) 		5 LEU D 230
GLU D 239
LEU D 242
LEU D  15
LEU D 228
 None
 0.95A 4wg0C-2wb1D:
undetectable
4wg0D-2wb1D:
undetectable
4wg0E-2wb1D:
undetectable		 4wg0C-2wb1D:
3.85
4wg0D-2wb1D:
3.85
4wg0E-2wb1D:
3.85
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.
2wqw INTERNALIN B

(Listeria
monocytogenes) 		PF08191
(LRR_adjacent)
PF12354
(Internalin_N)
PF12799
(LRR_4) 		6 ALA A 307
LEU A 235
LEU A 237
ASN A 261
LEU A 223
LEU A 226
 None
 1.18A 4wg0C-2wqwA:
undetectable
4wg0D-2wqwA:
undetectable
4wg0E-2wqwA:
undetectable		 4wg0C-2wqwA:
9.00
4wg0D-2wqwA:
9.00
4wg0E-2wqwA:
9.00
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.
2xzo REGULATOR OF
NONSENSE TRANSCRIPTS
1

(Homo sapiens) 		PF04851
(ResIII)
PF13086
(AAA_11)
PF13087
(AAA_12) 		5 LEU A 659
GLU A 686
LEU A 688
ARG A 485
LEU A 487
 None
 0.99A 4wg0C-2xzoA:
undetectable
4wg0D-2xzoA:
undetectable
4wg0E-2xzoA:
undetectable		 4wg0C-2xzoA:
2.39
4wg0D-2xzoA:
2.39
4wg0E-2xzoA:
2.39
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.
2y5q INTERNALIN B

(Listeria
monocytogenes) 		PF08191
(LRR_adjacent)
PF12354
(Internalin_N)
PF12799
(LRR_4) 		6 ALA A 307
LEU A 235
LEU A 237
ASN A 261
LEU A 223
LEU A 226
 None
 1.23A 4wg0C-2y5qA:
undetectable
4wg0D-2y5qA:
undetectable
4wg0E-2y5qA:
undetectable		 4wg0C-2y5qA:
8.57
4wg0D-2y5qA:
8.57
4wg0E-2y5qA:
8.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yu1 JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION
PROTEIN 1A

(Homo sapiens) 		PF02373
(JmjC) 		5 LEU A 453
GLU A 459
LEU A 461
LEU A 496
LEU A 495
 None
 1.00A 4wg0C-2yu1A:
undetectable
4wg0D-2yu1A:
undetectable
4wg0E-2yu1A:
undetectable		 4wg0C-2yu1A:
2.86
4wg0D-2yu1A:
2.86
4wg0E-2yu1A:
2.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yv7 CG10997-PA

(Drosophila
melanogaster) 		no annotation 5 ALA A 203
LEU A 204
TYR A 207
LEU A 151
LEU A 182
 None
 0.96A 4wg0C-2yv7A:
undetectable
4wg0D-2yv7A:
undetectable
4wg0E-2yv7A:
undetectable		 4wg0C-2yv7A:
4.65
4wg0D-2yv7A:
4.65
4wg0E-2yv7A:
4.65
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.
3gf9 INTERSECTIN 2

(Homo sapiens) 		PF00621
(RhoGEF) 		5 LEU A1189
LEU A1263
ASN A1236
LEU A1239
LEU A1243
 None
 0.86A 4wg0C-3gf9A:
undetectable
4wg0D-3gf9A:
undetectable
4wg0E-3gf9A:
undetectable		 4wg0C-3gf9A:
3.73
4wg0D-3gf9A:
3.73
4wg0E-3gf9A:
3.73
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.
3jv3 INTERSECTIN-1

(Mus musculus) 		PF00621
(RhoGEF)
PF14604
(SH3_9) 		5 LEU A1238
LEU A1312
ASN A1285
LEU A1288
LEU A1292
 None
 1.01A 4wg0C-3jv3A:
undetectable
4wg0D-3jv3A:
undetectable
4wg0E-3jv3A:
undetectable		 4wg0C-3jv3A:
4.33
4wg0D-3jv3A:
4.33
4wg0E-3jv3A:
4.33
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.
3ker D-DOPACHROME
DECARBOXYLASE

(Mus musculus) 		PF01187
(MIF) 		5 GLU A  19
LEU A  22
LEU A   5
LEU A  88
LEU A  84
 None
 1.00A 4wg0C-3kerA:
undetectable
4wg0D-3kerA:
undetectable
4wg0E-3kerA:
undetectable		 4wg0C-3kerA:
10.64
4wg0D-3kerA:
10.64
4wg0E-3kerA:
10.64
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.
3kqf ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN

(Bacillus
anthracis) 		PF00378
(ECH_1) 		5 GLU A 116
ALA A 120
LEU A 117
LEU A  30
LEU A  35
 None
 0.99A 4wg0C-3kqfA:
undetectable
4wg0D-3kqfA:
undetectable
4wg0E-3kqfA:
undetectable		 4wg0C-3kqfA:
4.86
4wg0D-3kqfA:
4.86
4wg0E-3kqfA:
4.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mzv DECAPRENYL
DIPHOSPHATE SYNTHASE

(Rhodobacter
capsulatus) 		PF00348
(polyprenyl_synt) 		5 ALA A 211
LEU A 212
LEU A  60
LEU A 321
LEU A 324
 None
 1.00A 4wg0C-3mzvA:
undetectable
4wg0D-3mzvA:
undetectable
4wg0E-3mzvA:
undetectable		 4wg0C-3mzvA:
5.02
4wg0D-3mzvA:
5.02
4wg0E-3mzvA:
5.02
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.
3oc7 ENOYL-COA HYDRATASE

(Mycobacterium
avium) 		PF00378
(ECH_1) 		5 ALA A  68
LEU A  31
GLU A  92
LEU A  96
LEU A 122
 None
 0.92A 4wg0C-3oc7A:
undetectable
4wg0D-3oc7A:
undetectable
4wg0E-3oc7A:
undetectable		 4wg0C-3oc7A:
4.74
4wg0D-3oc7A:
4.74
4wg0E-3oc7A:
4.74
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.
3pf0 IMELYSIN-LIKE
PROTEIN

(Psychrobacter
arcticus) 		PF09375
(Peptidase_M75) 		5 GLU A 181
ALA A 184
LEU A 183
LEU A 178
LEU A 171
 None
 0.98A 4wg0C-3pf0A:
undetectable
4wg0D-3pf0A:
undetectable
4wg0E-3pf0A:
undetectable		 4wg0C-3pf0A:
5.91
4wg0D-3pf0A:
5.91
4wg0E-3pf0A:
5.91
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.
3pih UVRABC SYSTEM
PROTEIN A

(Thermotoga
maritima) 		PF00005
(ABC_tran) 		6 GLU A 819
ALA A 817
LEU A 816
LEU A 832
LEU A 851
LEU A 847
 None
 1.29A 4wg0C-3pihA:
undetectable
4wg0D-3pihA:
undetectable
4wg0E-3pihA:
undetectable		 4wg0C-3pihA:
1.64
4wg0D-3pihA:
1.64
4wg0E-3pihA:
1.64
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.
3pko GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE

(Lactobacillus
brevis) 		PF00348
(polyprenyl_synt) 		5 ALA A 290
LEU A 289
LEU A 164
LEU A 245
LEU A 246
 None
 1.00A 4wg0C-3pkoA:
undetectable
4wg0D-3pkoA:
undetectable
4wg0E-3pkoA:
undetectable		 4wg0C-3pkoA:
2.99
4wg0D-3pkoA:
2.99
4wg0E-3pkoA:
2.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pwz SHIKIMATE
DEHYDROGENASE 3

(Pseudomonas
putida) 		PF01488
(Shikimate_DH)
PF08501
(Shikimate_dh_N) 		6 GLU A 175
ALA A 176
LEU A 177
LEU A 200
LEU A 126
LEU A 124
 None
 1.41A 4wg0C-3pwzA:
undetectable
4wg0D-3pwzA:
undetectable
4wg0E-3pwzA:
undetectable		 4wg0C-3pwzA:
4.62
4wg0D-3pwzA:
4.62
4wg0E-3pwzA:
4.62
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.
3q9v DNA-BINDING RESPONSE
REGULATOR

(Deinococcus
radiodurans) 		PF00486
(Trans_reg_C) 		5 ALA A 218
LEU A 219
LEU A 157
LEU A 196
LEU A 200
 None
 0.85A 4wg0C-3q9vA:
undetectable
4wg0D-3q9vA:
undetectable
4wg0E-3q9vA:
undetectable		 4wg0C-3q9vA:
8.55
4wg0D-3q9vA:
8.55
4wg0E-3q9vA:
8.55
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.
3s6k ACETYLGLUTAMATE
KINASE

(Xanthomonas
campestris) 		PF00696
(AA_kinase)
PF04768
(NAT) 		6 ALA A 132
GLU A 125
LYS A 122
LEU A 123
LEU A  57
LEU A  60
 None
 1.38A 4wg0C-3s6kA:
undetectable
4wg0D-3s6kA:
undetectable
4wg0E-3s6kA:
undetectable		 4wg0C-3s6kA:
3.33
4wg0D-3s6kA:
3.33
4wg0E-3s6kA:
3.33
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.
3tma METHYLTRANSFERASE

(Thermus
thermophilus) 		PF01170
(UPF0020)
PF02926
(THUMP) 		5 ALA A 295
LEU A 296
LEU A 304
LEU A 308
LEU A 281
 None
 0.94A 4wg0C-3tmaA:
undetectable
4wg0D-3tmaA:
undetectable
4wg0E-3tmaA:
undetectable		 4wg0C-3tmaA:
4.20
4wg0D-3tmaA:
4.20
4wg0E-3tmaA:
4.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wkh CELLOBIOSE
2-EPIMERASE

(Rhodothermus
marinus) 		PF07221
(GlcNAc_2-epim) 		5 TYR A 153
GLU A 203
LEU A 221
ARG A 220
LEU A 217
 None
 0.92A 4wg0C-3wkhA:
undetectable
4wg0D-3wkhA:
undetectable
4wg0E-3wkhA:
undetectable		 4wg0C-3wkhA:
2.19
4wg0D-3wkhA:
2.19
4wg0E-3wkhA:
2.19
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.
4a2p RETINOIC ACID
INDUCIBLE PROTEIN I

(Anas
platyrhynchos) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		5 ALA A 622
LEU A 619
GLU A 614
LEU A 615
LEU A 633
 None
 0.94A 4wg0C-4a2pA:
undetectable
4wg0D-4a2pA:
undetectable
4wg0E-4a2pA:
undetectable		 4wg0C-4a2pA:
2.34
4wg0D-4a2pA:
2.34
4wg0E-4a2pA:
2.34
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.
4a2q RETINOIC ACID
INDUCIBLE PROTEIN I

(Anas
platyrhynchos) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF16739
(CARD_2) 		5 GLU A   5
LYS A   6
LEU A   9
LEU A  61
LEU A  57
 None
 0.96A 4wg0C-4a2qA:
undetectable
4wg0D-4a2qA:
undetectable
4wg0E-4a2qA:
undetectable		 4wg0C-4a2qA:
1.63
4wg0D-4a2qA:
1.63
4wg0E-4a2qA:
1.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4atq 4-AMINOBUTYRATE
TRANSAMINASE

(Paenarthrobacter
aurescens) 		PF00202
(Aminotran_3) 		6 GLU A 446
ALA A 449
LEU A 445
LEU A 441
LEU A  69
LEU A 430
 None
 1.35A 4wg0C-4atqA:
undetectable
4wg0D-4atqA:
undetectable
4wg0E-4atqA:
undetectable		 4wg0C-4atqA:
2.51
4wg0D-4atqA:
2.51
4wg0E-4atqA:
2.51
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.
4bvu PROTEIN KINASE OSPG

(Shigella
flexneri) 		no annotation 5 LEU A 125
TYR A 122
GLU A 131
LEU A 129
LEU A 139
 None
 0.85A 4wg0C-4bvuA:
undetectable
4wg0D-4bvuA:
undetectable
4wg0E-4bvuA:
undetectable		 4wg0C-4bvuA:
5.94
4wg0D-4bvuA:
5.94
4wg0E-4bvuA:
5.94
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.
4bx9 VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 33A

(Homo sapiens) 		PF00995
(Sec1) 		6 ALA A 500
LEU A 499
GLU A 557
LEU A 472
ARG A 471
LEU A 470
 None
 1.49A 4wg0C-4bx9A:
undetectable
4wg0D-4bx9A:
undetectable
4wg0E-4bx9A:
undetectable		 4wg0C-4bx9A:
4.64
4wg0D-4bx9A:
4.64
4wg0E-4bx9A:
4.64
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.
4dx2 TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 4

(Homo sapiens) 		PF00023
(Ank) 		5 ALA A 198
LEU A 195
LEU A 214
LEU A 256
LEU A 257
 None
 0.98A 4wg0C-4dx2A:
undetectable
4wg0D-4dx2A:
undetectable
4wg0E-4dx2A:
undetectable		 4wg0C-4dx2A:
8.40
4wg0D-4dx2A:
8.40
4wg0E-4dx2A:
8.40
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.
4fl3 TYROSINE-PROTEIN
KINASE SYK

(Homo sapiens) 		PF00017
(SH2)
PF07714
(Pkinase_Tyr) 		5 ALA A 204
LEU A 205
TYR A 216
LEU A 255
LEU A 251
 None
 1.00A 4wg0C-4fl3A:
undetectable
4wg0D-4fl3A:
undetectable
4wg0E-4fl3A:
undetectable		 4wg0C-4fl3A:
2.77
4wg0D-4fl3A:
2.77
4wg0E-4fl3A:
2.77
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.
4he8 NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 8

(Thermus
thermophilus) 		no annotation 5 GLU H 163
LEU H 125
LEU H 258
LEU H 262
LEU H 182
 None
 0.97A 4wg0C-4he8H:
undetectable
4wg0D-4he8H:
undetectable
4wg0E-4he8H:
undetectable		 4wg0C-4he8H:
3.06
4wg0D-4he8H:
3.06
4wg0E-4he8H:
3.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i66 UNCHARACTERIZED
PROTEIN HOCH_4089

(Haliangium
ochraceum) 		PF13709
(DUF4159) 		6 GLU A 101
ALA A 104
LEU A 105
LEU A 135
LEU A  88
LEU A 115
 None
 1.43A 4wg0C-4i66A:
undetectable
4wg0D-4i66A:
undetectable
4wg0E-4i66A:
undetectable		 4wg0C-4i66A:
5.39
4wg0D-4i66A:
5.39
4wg0E-4i66A:
5.39
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.
4i96 RYANODINE RECEPTOR 1

(Oryctolagus
cuniculus) 		PF01365
(RYDR_ITPR)
PF02815
(MIR) 		5 GLU A 263
LEU A 262
LEU A 220
ARG A 221
LEU A 222
 None
 1.01A 4wg0C-4i96A:
undetectable
4wg0D-4i96A:
undetectable
4wg0E-4i96A:
undetectable		 4wg0C-4i96A:
4.74
4wg0D-4i96A:
4.74
4wg0E-4i96A:
4.74
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.
4jci PROLINE RACEMASE

(Chromohalobacter
salexigens) 		PF05544
(Pro_racemase) 		5 ALA A 181
LEU A 182
TYR A 185
GLU A 175
LEU A 174
 None
 0.96A 4wg0C-4jciA:
undetectable
4wg0D-4jciA:
undetectable
4wg0E-4jciA:
undetectable		 4wg0C-4jciA:
4.71
4wg0D-4jciA:
4.71
4wg0E-4jciA:
4.71
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.
4k51 EUKARYOTIC
TRANSLATION
INITIATION FACTOR 3
SUBUNIT A

(Saccharomyces
cerevisiae) 		PF01399
(PCI) 		5 LEU A 424
GLU A 392
LEU A 387
LEU A 404
LEU A 408
 None
 0.99A 4wg0C-4k51A:
undetectable
4wg0D-4k51A:
undetectable
4wg0E-4k51A:
undetectable		 4wg0C-4k51A:
4.91
4wg0D-4k51A:
4.91
4wg0E-4k51A:
4.91
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.
4lls GERANYLTRANSTRANSFER
ASE

(Roseobacter
denitrificans) 		PF00348
(polyprenyl_synt) 		5 ALA A 207
LEU A 208
LEU A  47
LEU A 277
ARG A 278
 None
 0.81A 4wg0C-4llsA:
undetectable
4wg0D-4llsA:
undetectable
4wg0E-4llsA:
undetectable		 4wg0C-4llsA:
4.65
4wg0D-4llsA:
4.65
4wg0E-4llsA:
4.65
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.
4lry PTS-DEPENDENT
DIHYDROXYACETONE
KINASE,
DIHYDROXYACETONE-BIN
DING SUBUNIT DHAK

(Escherichia
coli) 		PF02733
(Dak1) 		5 ALA A 351
LEU A 352
GLU A 157
ASN A 283
LEU A 281
 None
 0.95A 4wg0C-4lryA:
undetectable
4wg0D-4lryA:
undetectable
4wg0E-4lryA:
undetectable		 4wg0C-4lryA:
7.80
4wg0D-4lryA:
7.80
4wg0E-4lryA:
7.80
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.
4myo VIRGINIAMYCIN A
ACETYLTRANSFERASE

(Staphylococcus
aureus) 		PF00132
(Hexapep) 		5 GLU A 180
ALA A 183
LEU A 184
GLU A 207
LEU A 209
 None
 0.92A 4wg0C-4myoA:
undetectable
4wg0D-4myoA:
undetectable
4wg0E-4myoA:
undetectable		 4wg0C-4myoA:
5.12
4wg0D-4myoA:
5.12
4wg0E-4myoA:
5.12
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.
4o8s PUTATIVE

(Helicobacter
pylori) 		PF08843
(AbiEii) 		5 ALA A 167
LEU A 166
TYR A 170
ASN A  50
LEU A  49
 None
 0.91A 4wg0C-4o8sA:
undetectable
4wg0D-4o8sA:
undetectable
4wg0E-4o8sA:
undetectable		 4wg0C-4o8sA:
7.43
4wg0D-4o8sA:
7.43
4wg0E-4o8sA:
7.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ok0 PUTATIVE

(Helicobacter
pylori) 		PF08843
(AbiEii) 		5 ALA A 167
LEU A 166
TYR A 170
ASN A  50
LEU A  49
 None
 0.94A 4wg0C-4ok0A:
undetectable
4wg0D-4ok0A:
undetectable
4wg0E-4ok0A:
undetectable		 4wg0C-4ok0A:
6.34
4wg0D-4ok0A:
6.34
4wg0E-4ok0A:
6.34
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.
4oo0 MAF-LIKE PROTEIN
BCAL2394

(Burkholderia
cenocepacia) 		PF02545
(Maf) 		5 LEU A 199
GLU A  29
LEU A  31
LEU A  20
LEU A  91
 None
 0.95A 4wg0C-4oo0A:
undetectable
4wg0D-4oo0A:
undetectable
4wg0E-4oo0A:
undetectable		 4wg0C-4oo0A:
3.86
4wg0D-4oo0A:
3.86
4wg0E-4oo0A:
3.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q5h PROTEIN KINASE OSPG

(Shigella sonnei) 		no annotation 5 LEU A 125
TYR A 122
GLU A 131
LEU A 129
LEU A 139
 None
 0.84A 4wg0C-4q5hA:
undetectable
4wg0D-4q5hA:
undetectable
4wg0E-4q5hA:
undetectable		 4wg0C-4q5hA:
7.88
4wg0D-4q5hA:
7.88
4wg0E-4q5hA:
7.88
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.
4qmi CYTOSKELETON-ASSOCIA
TED PROTEIN 5

(Homo sapiens) 		PF12348
(CLASP_N) 		5 LEU A 901
LYS A 906
LEU A 905
ASN A 941
LEU A 942
 None
 0.87A 4wg0C-4qmiA:
undetectable
4wg0D-4qmiA:
undetectable
4wg0E-4qmiA:
undetectable		 4wg0C-4qmiA:
5.29
4wg0D-4qmiA:
5.29
4wg0E-4qmiA:
5.29
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.
4wyu PROTEIN SCRIBBLE
HOMOLOG

(Homo sapiens) 		PF00595
(PDZ) 		5 LEU A  95
GLU A  14
LEU A  97
LEU A  62
LEU A  26
 None
 0.98A 4wg0C-4wyuA:
undetectable
4wg0D-4wyuA:
undetectable
4wg0E-4wyuA:
undetectable		 4wg0C-4wyuA:
8.70
4wg0D-4wyuA:
8.70
4wg0E-4wyuA:
8.70
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.
4ynq THREE-PRIME REPAIR
EXONUCLEASE 1

(Mus musculus) 		no annotation 6 ALA A 105
LEU A 108
GLU A 137
LEU A  34
LEU A  69
LEU A  67
 None
 1.45A 4wg0C-4ynqA:
undetectable
4wg0D-4ynqA:
undetectable
4wg0E-4ynqA:
undetectable		 4wg0C-4ynqA:
6.70
4wg0D-4ynqA:
6.70
4wg0E-4ynqA:
6.70
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.
5a0k LABDANE-RELATED
DITERPENE SYNTHASE

(Streptomyces
sp.) 		no annotation 5 LEU A 151
TYR A 148
LEU A 155
LEU A 116
LEU A 136
 None
 0.97A 4wg0C-5a0kA:
undetectable
4wg0D-5a0kA:
undetectable
4wg0E-5a0kA:
undetectable		 4wg0C-5a0kA:
3.62
4wg0D-5a0kA:
3.62
4wg0E-5a0kA:
3.62
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.
5ey0 GTP-SENSING
TRANSCRIPTIONAL
PLEIOTROPIC
REPRESSOR CODY

(Staphylococcus
aureus) 		no annotation 5 ALA B 227
LEU B 224
GLU B 183
LYS B 184
LEU B 253
 None
 0.92A 4wg0C-5ey0B:
undetectable
4wg0D-5ey0B:
undetectable
4wg0E-5ey0B:
undetectable		 4wg0C-5ey0B:
4.01
4wg0D-5ey0B:
4.01
4wg0E-5ey0B:
4.01
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.
5f0l VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 26A

(Homo sapiens) 		PF03643
(Vps26) 		5 LEU B 149
TYR B  40
GLU B 146
LEU B 132
LEU B  18
 None
GOL  B 406 (-4.1A)
None
None
None
 0.72A 4wg0C-5f0lB:
undetectable
4wg0D-5f0lB:
undetectable
4wg0E-5f0lB:
undetectable		 4wg0C-5f0lB:
6.32
4wg0D-5f0lB:
6.32
4wg0E-5f0lB:
6.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ghs SSDNA-SPECIFIC
EXONUCLEASE

(Thermococcus
kodakarensis) 		PF02272
(DHHA1) 		5 ALA A 235
LEU A 233
LEU A 211
LEU A 259
LEU A 255
 None
 0.87A 4wg0C-5ghsA:
undetectable
4wg0D-5ghsA:
undetectable
4wg0E-5ghsA:
undetectable		 4wg0C-5ghsA:
3.00
4wg0D-5ghsA:
3.00
4wg0E-5ghsA:
3.00
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.
5h68 CHROMOSOME PARTITION
PROTEIN SMC

(Geobacillus
stearothermophilus) 		PF02463
(SMC_N) 		6 GLU A1120
ALA A1132
LEU A1135
TYR A1134
LEU A1116
LEU A1102
 None
 1.42A 4wg0C-5h68A:
undetectable
4wg0D-5h68A:
undetectable
4wg0E-5h68A:
undetectable		 4wg0C-5h68A:
3.26
4wg0D-5h68A:
3.26
4wg0E-5h68A:
3.26
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.
5hb1 NUCLEOPORIN NUP170

(Chaetomium
thermophilum) 		PF03177
(Nucleoporin_C) 		6 ALA A 614
LEU A 615
LEU A 676
ASN A 727
LEU A 724
LEU A 720
 None
 1.37A 4wg0C-5hb1A:
undetectable
4wg0D-5hb1A:
undetectable
4wg0E-5hb1A:
undetectable		 4wg0C-5hb1A:
1.33
4wg0D-5hb1A:
1.33
4wg0E-5hb1A:
1.33
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.
5hzk INTERSECTIN-1,NPH1-1
,INTERSECTIN-1

(Avena sativa;
Homo sapiens) 		PF00621
(RhoGEF)
PF13426
(PAS_9)
PF16652
(PH_13) 		5 LEU B1245
LEU B1462
ASN B1292
LEU B1295
LEU B1299
 None
 0.90A 4wg0C-5hzkB:
undetectable
4wg0D-5hzkB:
undetectable
4wg0E-5hzkB:
undetectable		 4wg0C-5hzkB:
2.91
4wg0D-5hzkB:
2.91
4wg0E-5hzkB:
2.91
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.
5lox PEPTIDASE

(Pseudomonas
aeruginosa) 		no annotation 5 TYR A 214
LEU A 192
LEU A 169
ARG A 170
LEU A 173
 None
 1.01A 4wg0C-5loxA:
undetectable
4wg0D-5loxA:
undetectable
4wg0E-5loxA:
undetectable		 4wg0C-5loxA:
3.93
4wg0D-5loxA:
3.93
4wg0E-5loxA:
3.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5msw THIOESTER REDUCTASE
DOMAIN-CONTAINING
PROTEIN

(Segniliparus
rugosus) 		PF00501
(AMP-binding)
PF00550
(PP-binding) 		5 ALA A  71
LEU A  70
GLU A 101
LEU A 102
LEU A 326
 None
 0.94A 4wg0C-5mswA:
undetectable
4wg0D-5mswA:
undetectable
4wg0E-5mswA:
undetectable		 4wg0C-5mswA:
1.10
4wg0D-5mswA:
1.10
4wg0E-5mswA:
1.10
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.
5n94 CG9323, ISOFORM A

(Drosophila
melanogaster) 		no annotation 5 LEU A 259
GLU A 286
LEU A 290
LEU A 277
LEU A 275
 None
U  C   6 ( 4.9A)
None
None
None
 0.88A 4wg0C-5n94A:
undetectable
4wg0D-5n94A:
undetectable
4wg0E-5n94A:
undetectable		 4wg0C-5n94A:
undetectable
4wg0D-5n94A:
undetectable
4wg0E-5n94A:
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.
5ojs TRANSCRIPTION-ASSOCI
ATED PROTEIN 1

(Saccharomyces
cerevisiae) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT) 		5 ALA T3166
LEU T3167
LEU T3156
LEU T3140
LEU T3141
 None
 0.80A 4wg0C-5ojsT:
undetectable
4wg0D-5ojsT:
undetectable
4wg0E-5ojsT:
undetectable		 4wg0C-5ojsT:
0.35
4wg0D-5ojsT:
0.35
4wg0E-5ojsT:
0.35
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.
5op0 DNA POLYMERASE LIGD,
POLYMERASE DOMAIN

(Mycolicibacterium
smegmatis) 		no annotation 5 ALA B 202
LEU B 203
LEU B 185
LEU B 169
LEU B 164
 None
 1.00A 4wg0C-5op0B:
undetectable
4wg0D-5op0B:
undetectable
4wg0E-5op0B:
undetectable		 4wg0C-5op0B:
6.91
4wg0D-5op0B:
6.91
4wg0E-5op0B:
6.91
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.
5ovt BPH

(Thiobacillus
denitrificans) 		no annotation 5 ALA A  59
LEU A  58
TYR A  61
LEU A  88
LEU A  84
 None
 0.93A 4wg0C-5ovtA:
undetectable
4wg0D-5ovtA:
undetectable
4wg0E-5ovtA:
undetectable		 4wg0C-5ovtA:
undetectable
4wg0D-5ovtA:
undetectable
4wg0E-5ovtA:
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.
5xn7 PUTATIVE RTX-TOXIN

(Vibrio
vulnificus) 		PF11647
(MLD) 		5 ALA A2402
LEU A2403
TYR A2406
LEU A2450
LEU A2375
 None
 0.88A 4wg0C-5xn7A:
undetectable
4wg0D-5xn7A:
undetectable
4wg0E-5xn7A:
undetectable		 4wg0C-5xn7A:
2.12
4wg0D-5xn7A:
2.12
4wg0E-5xn7A:
2.12
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.
5zai -

(-) 		no annotation 5 GLU A 113
LEU A 114
LEU A  28
LEU A  33
LEU A  36
 None
 1.00A 4wg0C-5zaiA:
undetectable
4wg0D-5zaiA:
undetectable
4wg0E-5zaiA:
undetectable		 4wg0C-5zaiA:
undetectable
4wg0D-5zaiA:
undetectable
4wg0E-5zaiA:
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.
6elc VARIANT SURFACE
GLYCOPROTEIN

(Trypanosoma
brucei) 		no annotation 5 ALA A 289
LEU A 286
LEU A 281
LEU A  45
LEU A 179
 None
 0.98A 4wg0C-6elcA:
undetectable
4wg0D-6elcA:
undetectable
4wg0E-6elcA:
undetectable		 4wg0C-6elcA:
undetectable
4wg0D-6elcA:
undetectable
4wg0E-6elcA:
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.
6ems TRNA
(GUANINE(9)-/ADENINE
(9)-N1)-METHYLTRANSF
ERASE

(Thermococcus
kodakarensis) 		no annotation 5 GLU A  14
LYS A  13
LEU A  12
LEU A  61
LEU A  34
 None
 1.01A 4wg0C-6emsA:
undetectable
4wg0D-6emsA:
undetectable
4wg0E-6emsA:
undetectable		 4wg0C-6emsA:
undetectable
4wg0D-6emsA:
undetectable
4wg0E-6emsA:
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.
6en3 ENDO-BETA-N-ACETYLGL
UCOSAMINIDASE
F2,MULTIFUNCTIONAL-A
UTOPROCESSING
REPEATS-IN-TOXIN

(Vibrio
cholerae;
Streptococcus
pyogenes) 		no annotation 5 ALA A 147
LEU A 146
LEU A 109
ARG A 274
LEU A 275
 None
 0.92A 4wg0C-6en3A:
undetectable
4wg0D-6en3A:
undetectable
4wg0E-6en3A:
undetectable		 4wg0C-6en3A:
undetectable
4wg0D-6en3A:
undetectable
4wg0E-6en3A:
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.
6en4 SPLICING FACTOR 3B
SUBUNIT 1

(Homo sapiens) 		no annotation 5 TYR C 979
LEU C1038
LEU C1020
ARG C1019
LEU C1016
 None
 0.99A 4wg0C-6en4C:
undetectable
4wg0D-6en4C:
undetectable
4wg0E-6en4C:
undetectable		 4wg0C-6en4C:
undetectable
4wg0D-6en4C:
undetectable
4wg0E-6en4C:
undetectable