SIMILAR PATTERNS OF AMINO ACIDS FOR 4WG0_F_CHDF103_0

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.
1axn ANNEXIN III

(Homo sapiens) 		PF00191
(Annexin) 		5 LEU A 241
GLU A 200
LEU A 202
ALA A 186
LEU A 183
 None
 1.15A 4wg0F-1axnA:
undetectable
4wg0G-1axnA:
undetectable
4wg0H-1axnA:
undetectable		 4wg0F-1axnA:
4.02
4wg0G-1axnA:
4.02
4wg0H-1axnA:
4.02
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.
1ctt CYTIDINE DEAMINASE

(Escherichia
coli) 		PF00383
(dCMP_cyt_deam_1)
PF08211
(dCMP_cyt_deam_2) 		5 LEU A  52
LEU A  56
LYS A  42
LEU A  41
LEU A  33
 None
 0.96A 4wg0F-1cttA:
undetectable
4wg0G-1cttA:
undetectable
4wg0H-1cttA:
undetectable		 4wg0F-1cttA:
6.47
4wg0G-1cttA:
6.47
4wg0H-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.
1f51 SPORULATION
INITIATION
PHOSPHOTRANSFERASE B

(Bacillus
subtilis) 		PF14682
(SPOB_ab)
PF14689
(SPOB_a) 		5 LEU A  71
LEU A 103
LEU A 137
ALA A 111
LEU A 110
 None
 0.98A 4wg0F-1f51A:
undetectable
4wg0G-1f51A:
undetectable
4wg0H-1f51A:
undetectable		 4wg0F-1f51A:
5.45
4wg0G-1f51A:
5.45
4wg0H-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.
1hw2 FATTY ACID
METABOLISM REGULATOR
PROTEIN

(Escherichia
coli) 		PF00392
(GntR)
PF07840
(FadR_C) 		5 LEU A 152
GLU A 126
ALA A 129
LEU A 128
TYR A 193
 None
 0.96A 4wg0F-1hw2A:
undetectable
4wg0G-1hw2A:
undetectable
4wg0H-1hw2A:
undetectable		 4wg0F-1hw2A:
6.57
4wg0G-1hw2A:
6.57
4wg0H-1hw2A:
6.57
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.
1jft PURINE NUCLEOTIDE
SYNTHESIS REPRESSOR

(Escherichia
coli) 		PF00356
(LacI)
PF13377
(Peripla_BP_3) 		5 LEU A 108
GLU A 128
LEU A 130
LEU A 134
TYR A 137
 None
 0.96A 4wg0F-1jftA:
undetectable
4wg0G-1jftA:
undetectable
4wg0H-1jftA:
undetectable		 4wg0F-1jftA:
3.90
4wg0G-1jftA:
3.90
4wg0H-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.
1m9s INTERNALIN B

(Listeria
monocytogenes) 		PF08191
(LRR_adjacent)
PF09479
(Flg_new)
PF12354
(Internalin_N)
PF12799
(LRR_4)
PF13457
(SH3_8) 		5 ASN A 261
LEU A 223
LEU A 226
LEU A 237
LEU A 235
 None
 0.76A 4wg0F-1m9sA:
undetectable
4wg0G-1m9sA:
undetectable
4wg0H-1m9sA:
undetectable		 4wg0F-1m9sA:
2.49
4wg0G-1m9sA:
2.49
4wg0H-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.
1nne DNA MISMATCH REPAIR
PROTEIN MUTS

(Thermus
aquaticus) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		5 LEU A  92
GLU A  83
LEU A  85
ALA A  77
TYR A  40
 None
 1.15A 4wg0F-1nneA:
undetectable
4wg0G-1nneA:
undetectable
4wg0H-1nneA:
undetectable		 4wg0F-1nneA:
3.44
4wg0G-1nneA:
3.44
4wg0H-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.
1nne DNA MISMATCH REPAIR
PROTEIN MUTS

(Thermus
aquaticus) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		5 LEU A  92
LEU A  33
GLU A  83
LEU A  85
ALA A  77
 None
 1.03A 4wg0F-1nneA:
undetectable
4wg0G-1nneA:
undetectable
4wg0H-1nneA:
undetectable		 4wg0F-1nneA:
3.44
4wg0G-1nneA:
3.44
4wg0H-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.
1oro OROTATE
PHOSPHORIBOSYLTRANSF
ERASE

(Escherichia
coli) 		PF00156
(Pribosyltran) 		5 LEU A  67
LEU A  85
GLU A  55
ALA A  56
LEU A  57
 None
 1.02A 4wg0F-1oroA:
undetectable
4wg0G-1oroA:
undetectable
4wg0H-1oroA:
undetectable		 4wg0F-1oroA:
10.48
4wg0G-1oroA:
10.48
4wg0H-1oroA:
10.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sif UBIQUITIN

(Homo sapiens) 		PF00240
(ubiquitin) 		5 LEU A  43
LEU A  67
GLU A  24
LEU A  26
LEU A  56
 None
 0.97A 4wg0F-1sifA:
undetectable
4wg0G-1sifA:
undetectable
4wg0H-1sifA:
undetectable		 4wg0F-1sifA:
12.24
4wg0G-1sifA:
12.24
4wg0H-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 233
LEU A 160
LEU A 226
LEU A 171
TYR A 168
 None
 0.93A 4wg0F-1tx4A:
undetectable
4wg0G-1tx4A:
undetectable
4wg0H-1tx4A:
undetectable		 4wg0F-1tx4A:
6.94
4wg0G-1tx4A:
6.94
4wg0H-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.
1ujn DEHYDROQUINATE
SYNTHASE

(Thermus
thermophilus) 		PF01761
(DHQ_synthase) 		5 LEU A 192
LEU A 171
GLU A 200
ALA A 204
LEU A 203
 None
 1.03A 4wg0F-1ujnA:
undetectable
4wg0G-1ujnA:
undetectable
4wg0H-1ujnA:
undetectable		 4wg0F-1ujnA:
3.62
4wg0G-1ujnA:
3.62
4wg0H-1ujnA:
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.
1v9c PRECORRIN-8X METHYL
MUTASE

(Thermus
thermophilus) 		PF02570
(CbiC) 		5 LEU A 197
LEU A 200
LEU A 157
ALA A 154
LEU A 155
 None
 1.00A 4wg0F-1v9cA:
undetectable
4wg0G-1v9cA:
undetectable
4wg0H-1v9cA:
undetectable		 4wg0F-1v9cA:
5.80
4wg0G-1v9cA:
5.80
4wg0H-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.
1w36 EXODEOXYRIBONUCLEASE
V GAMMA CHAIN

(Escherichia
coli) 		PF04257
(Exonuc_V_gamma) 		5 LEU C 460
LEU C 457
LEU C 571
ALA C 472
LEU C 473
 None
 1.11A 4wg0F-1w36C:
undetectable
4wg0G-1w36C:
undetectable
4wg0H-1w36C:
undetectable		 4wg0F-1w36C:
1.29
4wg0G-1w36C:
1.29
4wg0H-1w36C:
1.29
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.
1wy9 ALLOGRAFT
INFLAMMATORY FACTOR
1

(Mus musculus) 		no annotation 5 LEU A 107
ARG A 108
LEU A 111
LEU A  43
TYR A  37
 None
 1.07A 4wg0F-1wy9A:
undetectable
4wg0G-1wy9A:
undetectable
4wg0H-1wy9A:
undetectable		 4wg0F-1wy9A:
6.09
4wg0G-1wy9A:
6.09
4wg0H-1wy9A:
6.09
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.
1ym5 HYPOTHETICAL 32.6
KDA PROTEIN IN
DAP2-SLT2 INTERGENIC
REGION

(Saccharomyces
cerevisiae) 		PF02567
(PhzC-PhzF) 		5 LEU A 166
GLU A 254
ALA A 233
LEU A 234
TYR A 237
 None
 1.03A 4wg0F-1ym5A:
undetectable
4wg0G-1ym5A:
undetectable
4wg0H-1ym5A:
undetectable		 4wg0F-1ym5A:
4.14
4wg0G-1ym5A:
4.14
4wg0H-1ym5A:
4.14
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.
2b3x IRON-RESPONSIVE
ELEMENT BINDING
PROTEIN 1

(Homo sapiens) 		PF00330
(Aconitase)
PF00694
(Aconitase_C) 		5 LEU A 827
LEU A 829
GLU A 817
ALA A 797
LEU A 796
 None
 1.02A 4wg0F-2b3xA:
undetectable
4wg0G-2b3xA:
undetectable
4wg0H-2b3xA:
undetectable		 4wg0F-2b3xA:
1.66
4wg0G-2b3xA:
1.66
4wg0H-2b3xA:
1.66
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.
2c1u DI-HAEM CYTOCHROME C
PEROXIDASE

(Paracoccus
pantotrophus) 		PF00034
(Cytochrom_C)
PF03150
(CCP_MauG) 		5 ASN A   7
LEU A  10
GLU A 199
LYS A 200
LEU A 203
 None
 0.68A 4wg0F-2c1uA:
undetectable
4wg0G-2c1uA:
undetectable
4wg0H-2c1uA:
undetectable		 4wg0F-2c1uA:
3.59
4wg0G-2c1uA:
3.59
4wg0H-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.
2few PTS SYSTEM
MANNITOL-SPECIFIC
EIICBA COMPONENT

(Escherichia
coli) 		PF00359
(PTS_EIIA_2) 		5 LEU A 122
LEU A 131
GLU A 142
ALA A 145
LEU A 144
 None
 0.89A 4wg0F-2fewA:
undetectable
4wg0G-2fewA:
undetectable
4wg0H-2fewA:
undetectable		 4wg0F-2fewA:
5.41
4wg0G-2fewA:
5.41
4wg0H-2fewA:
5.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gs9 HYPOTHETICAL PROTEIN
TT1324

(Thermus
thermophilus) 		PF08241
(Methyltransf_11) 		5 ARG A  29
LEU A 208
GLU A 135
ALA A 205
LEU A 206
 None
 1.01A 4wg0F-2gs9A:
undetectable
4wg0G-2gs9A:
undetectable
4wg0H-2gs9A:
undetectable		 4wg0F-2gs9A:
3.32
4wg0G-2gs9A:
3.32
4wg0H-2gs9A:
3.32
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.
2h8o GERANYLTRANSTRANSFER
ASE

(Agrobacterium
fabrum) 		PF00348
(polyprenyl_synt) 		5 LEU A 100
LEU A  99
LEU A 247
ALA A 314
LEU A 313
 None
 1.13A 4wg0F-2h8oA:
undetectable
4wg0G-2h8oA:
undetectable
4wg0H-2h8oA:
undetectable		 4wg0F-2h8oA:
3.90
4wg0G-2h8oA:
3.90
4wg0H-2h8oA:
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.
2iel HYPOTHETICAL PROTEIN
TT0030

(Thermus
thermophilus) 		no annotation 5 LEU A  67
GLU A  23
LYS A  22
LEU A  21
LEU A  17
 None
 0.85A 4wg0F-2ielA:
undetectable
4wg0G-2ielA:
undetectable
4wg0H-2ielA:
undetectable		 4wg0F-2ielA:
20.69
4wg0G-2ielA:
20.69
4wg0H-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) 		5 LEU A 199
LEU A 203
LEU A 178
LEU A   8
TYR A  33
 None
 1.17A 4wg0F-2in3A:
undetectable
4wg0G-2in3A:
undetectable
4wg0H-2in3A:
undetectable		 4wg0F-2in3A:
4.78
4wg0G-2in3A:
4.78
4wg0H-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.
2jh3 RIBOSOMAL PROTEIN
S2-RELATED PROTEIN

(Deinococcus
radiodurans) 		PF01903
(CbiX) 		5 LEU A 297
GLU A 367
LEU A 366
GLU A 375
LEU A 282
 None
 1.12A 4wg0F-2jh3A:
undetectable
4wg0G-2jh3A:
undetectable
4wg0H-2jh3A:
undetectable		 4wg0F-2jh3A:
2.49
4wg0G-2jh3A:
2.49
4wg0H-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.
2jzk CYANOVIRIN-N HOMOLOG

(Tuber borchii) 		PF08881
(CVNH) 		5 LEU A  37
LEU A  71
GLU A  34
LEU A  19
LEU A  12
 None
 0.96A 4wg0F-2jzkA:
undetectable
4wg0G-2jzkA:
undetectable
4wg0H-2jzkA:
undetectable		 4wg0F-2jzkA:
19.05
4wg0G-2jzkA:
19.05
4wg0H-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.
2l4q THIOREDOXIN

(Mycobacterium
tuberculosis) 		PF00085
(Thioredoxin) 		5 LEU A 108
LEU A  29
LEU A 104
GLU A  49
LEU A  47
 None
 1.18A 4wg0F-2l4qA:
undetectable
4wg0G-2l4qA:
undetectable
4wg0H-2l4qA:
undetectable		 4wg0F-2l4qA:
7.96
4wg0G-2l4qA:
7.96
4wg0H-2l4qA:
7.96
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.
2og7 ASPARAGINE OXYGENASE

(Streptomyces
coelicolor) 		PF02668
(TauD) 		5 LEU A  59
ARG A  60
LEU A  16
GLU A  25
ALA A  28
 None
 1.07A 4wg0F-2og7A:
undetectable
4wg0G-2og7A:
undetectable
4wg0H-2og7A:
undetectable		 4wg0F-2og7A:
4.20
4wg0G-2og7A:
4.20
4wg0H-2og7A:
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.
2pgg RNA-DIRECTED RNA
POLYMERASE

(Infectious
bursal disease
virus) 		PF04197
(Birna_RdRp) 		5 LEU A 130
LEU A 637
ALA A 625
LEU A 626
TYR A 623
 None
 1.18A 4wg0F-2pggA:
undetectable
4wg0G-2pggA:
undetectable
4wg0H-2pggA:
undetectable		 4wg0F-2pggA:
2.57
4wg0G-2pggA:
2.57
4wg0H-2pggA:
2.57
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.
2q01 URONATE ISOMERASE

(Caulobacter
vibrioides) 		PF02614
(UxaC) 		5 LEU A 268
LEU A 260
GLU A 280
LYS A 281
LEU A 284
 None
 1.04A 4wg0F-2q01A:
undetectable
4wg0G-2q01A:
undetectable
4wg0H-2q01A:
undetectable		 4wg0F-2q01A:
2.11
4wg0G-2q01A:
2.11
4wg0H-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 LEU A 108
LEU A 111
LEU A  20
GLU A  25
LEU A  24
 None
 1.00A 4wg0F-2qzjA:
undetectable
4wg0G-2qzjA:
undetectable
4wg0H-2qzjA:
undetectable		 4wg0F-2qzjA:
5.88
4wg0G-2qzjA:
5.88
4wg0H-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.
2vf8 EXCINUCLEASE ABC
SUBUNIT A

(Deinococcus
radiodurans) 		PF00005
(ABC_tran) 		5 LEU A 366
LEU A 390
GLU A 418
LEU A 420
LEU A 424
 None
 1.12A 4wg0F-2vf8A:
undetectable
4wg0G-2vf8A:
undetectable
4wg0H-2vf8A:
undetectable		 4wg0F-2vf8A:
2.38
4wg0G-2vf8A:
2.38
4wg0H-2vf8A:
2.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vmh FIBRONECTIN TYPE III
DOMAIN PROTEIN

(Clostridium
perfringens) 		PF08305
(NPCBM) 		5 LEU A 964
LEU A1026
LEU A1049
GLU A 912
LEU A 910
 None
 1.17A 4wg0F-2vmhA:
undetectable
4wg0G-2vmhA:
undetectable
4wg0H-2vmhA:
undetectable		 4wg0F-2vmhA:
7.46
4wg0G-2vmhA:
7.46
4wg0H-2vmhA:
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.
2vw8 PA1000

(Pseudomonas
aeruginosa) 		PF00753
(Lactamase_B) 		5 LEU A 248
LEU A 244
LEU A 290
GLU A 263
LEU A 265
 None
 0.99A 4wg0F-2vw8A:
undetectable
4wg0G-2vw8A:
undetectable
4wg0H-2vw8A:
undetectable		 4wg0F-2vw8A:
2.98
4wg0G-2vw8A:
2.98
4wg0H-2vw8A:
2.98
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.
2wcu PROTEIN FUCU HOMOLOG

(Mus musculus) 		PF05025
(RbsD_FucU) 		5 LEU A  30
LEU A  59
GLU A  27
LEU A 143
TYR A  98
 None
 1.12A 4wg0F-2wcuA:
undetectable
4wg0G-2wcuA:
undetectable
4wg0H-2wcuA:
undetectable		 4wg0F-2wcuA:
8.41
4wg0G-2wcuA:
8.41
4wg0H-2wcuA:
8.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wqw INTERNALIN B

(Listeria
monocytogenes) 		PF08191
(LRR_adjacent)
PF12354
(Internalin_N)
PF12799
(LRR_4) 		5 ASN A 261
LEU A 223
LEU A 226
LEU A 237
LEU A 235
 None
 0.84A 4wg0F-2wqwA:
undetectable
4wg0G-2wqwA:
undetectable
4wg0H-2wqwA:
undetectable		 4wg0F-2wqwA:
9.00
4wg0G-2wqwA:
9.00
4wg0H-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.
2y5q INTERNALIN B

(Listeria
monocytogenes) 		PF08191
(LRR_adjacent)
PF12354
(Internalin_N)
PF12799
(LRR_4) 		5 ASN A 261
LEU A 223
LEU A 226
LEU A 237
LEU A 235
 None
 0.89A 4wg0F-2y5qA:
undetectable
4wg0G-2y5qA:
undetectable
4wg0H-2y5qA:
undetectable		 4wg0F-2y5qA:
8.57
4wg0G-2y5qA:
8.57
4wg0H-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.
2y5q INTERNALIN B

(Listeria
monocytogenes) 		PF08191
(LRR_adjacent)
PF12354
(Internalin_N)
PF12799
(LRR_4) 		5 LEU A 223
LEU A 226
LEU A 237
ALA A 307
LEU A 235
 None
 1.06A 4wg0F-2y5qA:
undetectable
4wg0G-2y5qA:
undetectable
4wg0H-2y5qA:
undetectable		 4wg0F-2y5qA:
8.57
4wg0G-2y5qA:
8.57
4wg0H-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.
2yn1 LGPCA THIOREDOXIN

(synthetic
construct) 		PF00085
(Thioredoxin) 		5 LEU A 102
LEU A  23
LEU A  98
GLU A  43
LEU A  41
 None
 1.07A 4wg0F-2yn1A:
undetectable
4wg0G-2yn1A:
undetectable
4wg0H-2yn1A:
undetectable		 4wg0F-2yn1A:
7.55
4wg0G-2yn1A:
7.55
4wg0H-2yn1A:
7.55
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.
2zyj ALPHA-AMINODIPATE
AMINOTRANSFERASE

(Thermus
thermophilus) 		PF00155
(Aminotran_1_2) 		5 LEU A 168
LEU A 166
LEU A 188
ALA A 153
LEU A 154
 None
 1.09A 4wg0F-2zyjA:
undetectable
4wg0G-2zyjA:
undetectable
4wg0H-2zyjA:
undetectable		 4wg0F-2zyjA:
3.19
4wg0G-2zyjA:
3.19
4wg0H-2zyjA:
3.19
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.
3fmp ATP-DEPENDENT RNA
HELICASE DDX19B

(Homo sapiens) 		PF00270
(DEAD) 		5 LEU B  97
LEU B  99
LEU B 127
ALA B 146
LEU B 150
 None
None
None
ADP  B 480 (-3.4A)
None
 1.06A 4wg0F-3fmpB:
undetectable
4wg0G-3fmpB:
undetectable
4wg0H-3fmpB:
undetectable		 4wg0F-3fmpB:
2.88
4wg0G-3fmpB:
2.88
4wg0H-3fmpB:
2.88
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.
3gon PHOSPHOMEVALONATE
KINASE

(Streptococcus
pneumoniae) 		PF00288
(GHMP_kinases_N) 		5 LEU A 174
LEU A 179
GLU A  68
ALA A  71
LEU A  72
 None
 1.04A 4wg0F-3gonA:
undetectable
4wg0G-3gonA:
undetectable
4wg0H-3gonA:
undetectable		 4wg0F-3gonA:
6.90
4wg0G-3gonA:
6.90
4wg0H-3gonA:
6.90
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.
3isa PUTATIVE ENOYL-COA
HYDRATASE/ISOMERASE

(Bordetella
parapertussis) 		PF00378
(ECH_1) 		5 LEU A  36
LEU A  40
LEU A  23
ALA A 113
LEU A 117
 None
None
None
CL  A 257 (-3.8A)
None
 1.13A 4wg0F-3isaA:
undetectable
4wg0G-3isaA:
undetectable
4wg0H-3isaA:
undetectable		 4wg0F-3isaA:
6.47
4wg0G-3isaA:
6.47
4wg0H-3isaA:
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.
3k5z FEM-3 MRNA-BINDING
FACTOR 2

(Caenorhabditis
elegans) 		PF00806
(PUF) 		5 LEU A 535
LEU A 507
GLU A 560
ALA A 563
LEU A 562
 None
 0.97A 4wg0F-3k5zA:
undetectable
4wg0G-3k5zA:
undetectable
4wg0H-3k5zA:
undetectable		 4wg0F-3k5zA:
3.37
4wg0G-3k5zA:
3.37
4wg0H-3k5zA:
3.37
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.
3kci PROBABLE E3
UBIQUITIN-PROTEIN
LIGASE HERC2

(Homo sapiens) 		PF00415
(RCC1) 		5 ASN A3960
LEU A3997
LEU A4314
ALA A3981
LEU A3982
 None
 1.13A 4wg0F-3kciA:
undetectable
4wg0G-3kciA:
undetectable
4wg0H-3kciA:
undetectable		 4wg0F-3kciA:
3.86
4wg0G-3kciA:
3.86
4wg0H-3kciA:
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.
3mzv DECAPRENYL
DIPHOSPHATE SYNTHASE

(Rhodobacter
capsulatus) 		PF00348
(polyprenyl_synt) 		5 LEU A 321
LEU A 324
LEU A  60
ALA A 211
LEU A 212
 None
 1.00A 4wg0F-3mzvA:
undetectable
4wg0G-3mzvA:
undetectable
4wg0H-3mzvA:
undetectable		 4wg0F-3mzvA:
5.02
4wg0G-3mzvA:
5.02
4wg0H-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.
3pih UVRABC SYSTEM
PROTEIN A

(Thermotoga
maritima) 		PF00005
(ABC_tran) 		5 LEU A 851
LEU A 847
LEU A 832
GLU A 819
LEU A 816
 None
 1.12A 4wg0F-3pihA:
undetectable
4wg0G-3pihA:
undetectable
4wg0H-3pihA:
undetectable		 4wg0F-3pihA:
1.64
4wg0G-3pihA:
1.64
4wg0H-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.
3pju CYCLIC DIMERIC GMP
BINDING PROTEIN

(Pseudomonas
fluorescens) 		PF00563
(EAL) 		5 ASN A 512
LEU A 511
LEU A 546
GLU A 552
LEU A 550
 None
 1.10A 4wg0F-3pjuA:
undetectable
4wg0G-3pjuA:
undetectable
4wg0H-3pjuA:
undetectable		 4wg0F-3pjuA:
4.69
4wg0G-3pjuA:
4.69
4wg0H-3pjuA:
4.69
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.
3pko GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE

(Lactobacillus
brevis) 		PF00348
(polyprenyl_synt) 		5 LEU A 245
LEU A 246
LEU A 164
ALA A 290
LEU A 289
 None
 1.01A 4wg0F-3pkoA:
undetectable
4wg0G-3pkoA:
undetectable
4wg0H-3pkoA:
undetectable		 4wg0F-3pkoA:
2.99
4wg0G-3pkoA:
2.99
4wg0H-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.
3pls MACROPHAGE-STIMULATI
NG PROTEIN RECEPTOR

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		5 LEU A1074
LEU A1151
GLU A1069
LEU A1129
LEU A1062
 None
 1.19A 4wg0F-3plsA:
undetectable
4wg0G-3plsA:
undetectable
4wg0H-3plsA:
undetectable		 4wg0F-3plsA:
5.69
4wg0G-3plsA:
5.69
4wg0H-3plsA:
5.69
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.
3rnl SULFOTRANSFERASE

(Alicyclobacillus
acidocaldarius) 		PF13469
(Sulfotransfer_3) 		5 LEU A 272
ARG A 273
LEU A 276
LEU A 141
GLU A 133
 None
 1.11A 4wg0F-3rnlA:
undetectable
4wg0G-3rnlA:
undetectable
4wg0H-3rnlA:
undetectable		 4wg0F-3rnlA:
5.08
4wg0G-3rnlA:
5.08
4wg0H-3rnlA:
5.08
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.
3s6f HYPOTHETICAL
ACETYLTRANSFERASE

(Deinococcus
radiodurans) 		PF13673
(Acetyltransf_10) 		5 LEU A  39
LEU A  23
LEU A  43
ALA A  52
LEU A  51
 LEU  A  39 ( 0.5A)
LEU  A  23 ( 0.6A)
LEU  A  43 ( 0.6A)
ALA  A  52 ( 0.0A)
LEU  A  51 ( 0.5A)
 1.11A 4wg0F-3s6fA:
undetectable
4wg0G-3s6fA:
undetectable
4wg0H-3s6fA:
undetectable		 4wg0F-3s6fA:
8.62
4wg0G-3s6fA:
8.62
4wg0H-3s6fA:
8.62
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.
3tma METHYLTRANSFERASE

(Thermus
thermophilus) 		PF01170
(UPF0020)
PF02926
(THUMP) 		5 LEU A 308
LEU A 281
LEU A 304
ALA A 295
LEU A 296
 None
 0.96A 4wg0F-3tmaA:
undetectable
4wg0G-3tmaA:
undetectable
4wg0H-3tmaA:
undetectable		 4wg0F-3tmaA:
4.20
4wg0G-3tmaA:
4.20
4wg0H-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.
3w1h L-SERYL-TRNA(SEC)
SELENIUM TRANSFERASE

(Aquifex
aeolicus) 		PF03841
(SelA) 		5 LEU A 130
ARG A 269
LEU A 253
LEU A 328
GLU A 124
 None
 1.18A 4wg0F-3w1hA:
undetectable
4wg0G-3w1hA:
undetectable
4wg0H-3w1hA:
undetectable		 4wg0F-3w1hA:
3.45
4wg0G-3w1hA:
3.45
4wg0H-3w1hA:
3.45
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.
3wvo CRISPR-ASSOCIATED
PROTEIN, CSE1 FAMILY

(Thermobifida
fusca) 		PF09481
(CRISPR_Cse1) 		5 ASN A 216
LEU A 213
LEU A 209
LEU A  58
LEU A  43
 None
 1.13A 4wg0F-3wvoA:
undetectable
4wg0G-3wvoA:
undetectable
4wg0H-3wvoA:
undetectable		 4wg0F-3wvoA:
12.99
4wg0G-3wvoA:
12.99
4wg0H-3wvoA:
12.99
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.
4a2p RETINOIC ACID
INDUCIBLE PROTEIN I

(Anas
platyrhynchos) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		5 LEU A 633
GLU A 614
LEU A 615
ALA A 622
LEU A 619
 None
 0.95A 4wg0F-4a2pA:
undetectable
4wg0G-4a2pA:
undetectable
4wg0H-4a2pA:
undetectable		 4wg0F-4a2pA:
2.34
4wg0G-4a2pA:
2.34
4wg0H-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.
4avy PROBABLE SHORT-CHAIN
DEHYDROGENASE

(Pseudomonas
aeruginosa) 		PF13561
(adh_short_C2) 		5 LEU A  60
LEU A  40
LEU A  68
GLU A  73
ALA A  74
 None
 1.11A 4wg0F-4avyA:
undetectable
4wg0G-4avyA:
undetectable
4wg0H-4avyA:
undetectable		 4wg0F-4avyA:
5.49
4wg0G-4avyA:
5.49
4wg0H-4avyA:
5.49
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.
4dvy CYTOTOXICITY-ASSOCIA
TED IMMUNODOMINANT
ANTIGEN

(Helicobacter
pylori) 		no annotation 5 LEU P 418
LEU P 415
GLU P 406
ALA P 409
LEU P 408
 None
 1.06A 4wg0F-4dvyP:
undetectable
4wg0G-4dvyP:
undetectable
4wg0H-4dvyP:
undetectable		 4wg0F-4dvyP:
2.23
4wg0G-4dvyP:
2.23
4wg0H-4dvyP:
2.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dvz CYTOTOXICITY-ASSOCIA
TED IMMUNODOMINANT
ANTIGEN

(Helicobacter
pylori) 		no annotation 5 LEU A 418
LEU A 415
GLU A 406
ALA A 409
LEU A 408
 None
 1.00A 4wg0F-4dvzA:
undetectable
4wg0G-4dvzA:
undetectable
4wg0H-4dvzA:
undetectable		 4wg0F-4dvzA:
2.73
4wg0G-4dvzA:
2.73
4wg0H-4dvzA:
2.73
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.
4g2a HYPOTHETICAL PROTEIN

(Legionella
pneumophila) 		PF13308
(YARHG)
PF14415
(DUF4424) 		5 LEU A 341
LYS A 284
LEU A 285
GLU A 292
LEU A 296
 None
SO4  A 413 (-4.1A)
None
None
None
 1.05A 4wg0F-4g2aA:
undetectable
4wg0G-4g2aA:
undetectable
4wg0H-4g2aA:
undetectable		 4wg0F-4g2aA:
3.50
4wg0G-4g2aA:
3.50
4wg0H-4g2aA:
3.50
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.
4gr4 NON-RIBOSOMAL
PEPTIDE SYNTHETASE

(Streptomyces
lydicus) 		PF00501
(AMP-binding)
PF03621
(MbtH) 		5 LEU A 273
LEU A 140
ALA A 102
LEU A 103
TYR A 100
 None
 1.16A 4wg0F-4gr4A:
undetectable
4wg0G-4gr4A:
undetectable
4wg0H-4gr4A:
undetectable		 4wg0F-4gr4A:
2.24
4wg0G-4gr4A:
2.24
4wg0H-4gr4A:
2.24
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.
4gr5 NON-RIBOSOMAL
PEPTIDE SYNTHETASE

(Streptomyces
lydicus) 		PF00501
(AMP-binding)
PF03621
(MbtH) 		5 LEU A 273
LEU A 140
ALA A 102
LEU A 103
TYR A 100
 None
 1.13A 4wg0F-4gr5A:
undetectable
4wg0G-4gr5A:
undetectable
4wg0H-4gr5A:
undetectable		 4wg0F-4gr5A:
2.24
4wg0G-4gr5A:
2.24
4wg0H-4gr5A:
2.24
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.
4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN

(Rhodopseudomonas
palustris;
Paraburkholderia
xenovorans) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 LEU A   9
LEU A 219
LEU A  71
LEU A  34
TYR A  31
 None
None
None
None
MLY  A  18 ( 4.7A)
 1.19A 4wg0F-4gxrA:
undetectable
4wg0G-4gxrA:
undetectable
4wg0H-4gxrA:
undetectable		 4wg0F-4gxrA:
2.49
4wg0G-4gxrA:
2.49
4wg0H-4gxrA:
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.
4ha6 PYRIDOXINE 4-OXIDASE

(Mesorhizobium
loti) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 LEU A 483
ARG A 482
LEU A 489
LEU A 276
LEU A 265
 None
 1.11A 4wg0F-4ha6A:
undetectable
4wg0G-4ha6A:
undetectable
4wg0H-4ha6A:
undetectable		 4wg0F-4ha6A:
2.63
4wg0G-4ha6A:
2.63
4wg0H-4ha6A:
2.63
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.
4k0e HEAVY METAL CATION
TRICOMPONENT EFFLUX
PUMP ZNEA(CZCA-LIKE)

(Cupriavidus
metallidurans) 		PF00873
(ACR_tran) 		5 LEU A 814
LEU A 667
LEU A 819
GLU A 824
LEU A 823
 None
 0.76A 4wg0F-4k0eA:
undetectable
4wg0G-4k0eA:
undetectable
4wg0H-4k0eA:
undetectable		 4wg0F-4k0eA:
2.06
4wg0G-4k0eA:
2.06
4wg0H-4k0eA:
2.06
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.
4l4x AMPHI

(Streptomyces
nodosus) 		PF08659
(KR) 		5 LEU A  80
LEU A 101
LEU A 238
ALA A 230
LEU A 234
 None
 1.17A 4wg0F-4l4xA:
undetectable
4wg0G-4l4xA:
undetectable
4wg0H-4l4xA:
undetectable		 4wg0F-4l4xA:
2.14
4wg0G-4l4xA:
2.14
4wg0H-4l4xA:
2.14
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.
4lan URACIL-5-CARBOXYLATE
DECARBOXYLASE

(Cordyceps
militaris) 		PF04909
(Amidohydro_2) 		5 LEU A 169
LEU A 139
LEU A 178
GLU A 183
ALA A 184
 None
 1.14A 4wg0F-4lanA:
undetectable
4wg0G-4lanA:
undetectable
4wg0H-4lanA:
undetectable		 4wg0F-4lanA:
2.93
4wg0G-4lanA:
2.93
4wg0H-4lanA:
2.93
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.
4lls GERANYLTRANSTRANSFER
ASE

(Roseobacter
denitrificans) 		PF00348
(polyprenyl_synt) 		5 LEU A 277
ARG A 278
LEU A  47
ALA A 207
LEU A 208
 None
 0.93A 4wg0F-4llsA:
undetectable
4wg0G-4llsA:
undetectable
4wg0H-4llsA:
undetectable		 4wg0F-4llsA:
4.65
4wg0G-4llsA:
4.65
4wg0H-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.
4ndw NUCLEOID-ASSOCIATED
PROTEIN ESPR

(Mycobacterium
tuberculosis) 		no annotation 5 LEU A  48
LEU A  45
LEU A   9
ALA A  63
LEU A  64
 None
 1.19A 4wg0F-4ndwA:
undetectable
4wg0G-4ndwA:
undetectable
4wg0H-4ndwA:
undetectable		 4wg0F-4ndwA:
5.88
4wg0G-4ndwA:
5.88
4wg0H-4ndwA:
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.
4oah MITOCHONDRIAL
DYNAMIC PROTEIN
MID51

(Mus musculus) 		PF03281
(Mab-21) 		5 LEU A 377
LEU A 380
LEU A 450
ALA A 411
LEU A 415
 None
 1.03A 4wg0F-4oahA:
undetectable
4wg0G-4oahA:
undetectable
4wg0H-4oahA:
undetectable		 4wg0F-4oahA:
6.74
4wg0G-4oahA:
6.74
4wg0H-4oahA:
6.74
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.
4p0j INTERLEUKIN-36
RECEPTOR
ANTAGONIST/INTERLEUK
IN-36 GAMMA CHIMERA
PROTEIN

(Homo sapiens) 		PF00340
(IL1) 		5 LEU A 133
LEU A 121
LEU A  78
GLU A  81
LEU A  68
 None
 1.11A 4wg0F-4p0jA:
undetectable
4wg0G-4p0jA:
undetectable
4wg0H-4p0jA:
undetectable		 4wg0F-4p0jA:
6.94
4wg0G-4p0jA:
6.94
4wg0H-4p0jA:
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.
4pr3 5'-METHYLTHIOADENOSI
NE NUCLEOSIDASE /
S-ADENOSYLHOMOCYSTEI
NE NUCLEOSIDASE

(Brucella
melitensis) 		PF01048
(PNP_UDP_1) 		5 LEU A 190
LEU A  23
LEU A  63
GLU A 145
ALA A  15
 None
 1.07A 4wg0F-4pr3A:
undetectable
4wg0G-4pr3A:
undetectable
4wg0H-4pr3A:
undetectable		 4wg0F-4pr3A:
4.82
4wg0G-4pr3A:
4.82
4wg0H-4pr3A:
4.82
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.
4q5h PROTEIN KINASE OSPG

(Shigella sonnei) 		no annotation 5 LEU A 139
GLU A 131
LEU A 129
LEU A 125
TYR A 122
 None
 0.79A 4wg0F-4q5hA:
undetectable
4wg0G-4q5hA:
undetectable
4wg0H-4q5hA:
undetectable		 4wg0F-4q5hA:
7.88
4wg0G-4q5hA:
7.88
4wg0H-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.
4rly NAV1.2 - ANKB
CHIMERA

(Homo sapiens;
Mus musculus) 		PF00023
(Ank)
PF12796
(Ank_2)
PF13637
(Ank_4) 		5 LEU A2251
LEU A2252
LEU A2212
ALA A2195
LEU A2196
 SO4  A2406 (-4.2A)
None
None
None
None
 1.07A 4wg0F-4rlyA:
undetectable
4wg0G-4rlyA:
undetectable
4wg0H-4rlyA:
undetectable		 4wg0F-4rlyA:
6.31
4wg0G-4rlyA:
6.31
4wg0H-4rlyA:
6.31
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.
4u63 DNA PHOTOLYASE

(Agrobacterium
fabrum) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		5 LEU A  66
LEU A 172
LEU A  18
ALA A  23
LEU A  24
 None
 1.17A 4wg0F-4u63A:
undetectable
4wg0G-4u63A:
undetectable
4wg0H-4u63A:
undetectable		 4wg0F-4u63A:
4.66
4wg0G-4u63A:
4.66
4wg0H-4u63A:
4.66
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.
4xb6 ALPHA-D-RIBOSE
1-METHYLPHOSPHONATE
5-TRIPHOSPHATE
SYNTHASE SUBUNIT
PHNH

(Escherichia
coli) 		PF05845
(PhnH) 		5 ASN B  74
LEU B  77
ARG B  78
LEU B  52
ALA B  92
 None
 1.09A 4wg0F-4xb6B:
undetectable
4wg0G-4xb6B:
undetectable
4wg0H-4xb6B:
undetectable		 4wg0F-4xb6B:
5.75
4wg0G-4xb6B:
5.75
4wg0H-4xb6B:
5.75
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.
4xmv AMINOPEPTIDASE N

(Escherichia
coli) 		PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C) 		5 LEU A 699
GLU A 655
ALA A 658
LEU A 657
TYR A 660
 None
 1.03A 4wg0F-4xmvA:
undetectable
4wg0G-4xmvA:
undetectable
4wg0H-4xmvA:
undetectable		 4wg0F-4xmvA:
1.38
4wg0G-4xmvA:
1.38
4wg0H-4xmvA:
1.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zdl O-PHOSPHOSERYL-TRNA(
SEC) SELENIUM
TRANSFERASE

(Homo sapiens) 		PF05889
(SepSecS) 		5 LEU A 454
LEU A 395
GLU A 361
LEU A 434
ALA A 387
 None
 1.12A 4wg0F-4zdlA:
undetectable
4wg0G-4zdlA:
undetectable
4wg0H-4zdlA:
undetectable		 4wg0F-4zdlA:
4.32
4wg0G-4zdlA:
4.32
4wg0H-4zdlA:
4.32
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.
5auo ATPASE INVOLVED IN
CHROMOSOME
PARTITIONING,
PARA/MIND FAMILY,
MRP HOMOLOG

(Thermococcus
kodakarensis) 		PF10609
(ParA) 		5 ARG B 247
LEU B 248
LEU B  40
GLU B  46
LEU B  44
 None
 1.19A 4wg0F-5auoB:
undetectable
4wg0G-5auoB:
undetectable
4wg0H-5auoB:
undetectable		 4wg0F-5auoB:
5.47
4wg0G-5auoB:
5.47
4wg0H-5auoB:
5.47
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.
5b5r GASDERMIN-A3

(Mus musculus) 		PF04598
(Gasdermin) 		5 LEU A 352
LEU A 441
LEU A 360
ALA A 412
LEU A 413
 None
 1.13A 4wg0F-5b5rA:
undetectable
4wg0G-5b5rA:
undetectable
4wg0H-5b5rA:
undetectable		 4wg0F-5b5rA:
3.51
4wg0G-5b5rA:
3.51
4wg0H-5b5rA:
3.51
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.
5dtp PROBABLE ENOYL-COA
HYDRATASE ECHA6

(Mycobacterium
tuberculosis) 		PF00378
(ECH_1) 		5 LEU A  75
LEU A  78
LEU A  24
ALA A 105
LEU A 104
 None
 1.06A 4wg0F-5dtpA:
undetectable
4wg0G-5dtpA:
undetectable
4wg0H-5dtpA:
undetectable		 4wg0F-5dtpA:
4.90
4wg0G-5dtpA:
4.90
4wg0H-5dtpA:
4.90
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.
5e1r 7S VICILIN

(Carya
illinoinensis) 		PF00190
(Cupin_1) 		5 LEU A 710
LEU A 712
LEU A 686
GLU A 649
ALA A 701
 None
MPD  A 802 ( 4.5A)
None
None
None
 1.04A 4wg0F-5e1rA:
undetectable
4wg0G-5e1rA:
undetectable
4wg0H-5e1rA:
undetectable		 4wg0F-5e1rA:
2.12
4wg0G-5e1rA:
2.12
4wg0H-5e1rA:
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.
5e3e CDII IMMUNITY
PROTEIN

(Yersinia
kristensenii) 		no annotation 5 LEU A  13
GLU A  31
ALA A  34
LEU A  33
TYR A  36
 None
 1.02A 4wg0F-5e3eA:
undetectable
4wg0G-5e3eA:
undetectable
4wg0H-5e3eA:
undetectable		 4wg0F-5e3eA:
14.67
4wg0G-5e3eA:
14.67
4wg0H-5e3eA:
14.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5f0l VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 26A

(Homo sapiens) 		PF03643
(Vps26) 		5 LEU B  18
GLU B 146
LEU B 132
LEU B 149
TYR B  40
 None
None
None
None
GOL  B 406 (-4.1A)
 0.78A 4wg0F-5f0lB:
undetectable
4wg0G-5f0lB:
undetectable
4wg0H-5f0lB:
undetectable		 4wg0F-5f0lB:
6.32
4wg0G-5f0lB:
6.32
4wg0H-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.
5fcl CRISPR-ASSOCIATED
ENDONUCLEASE CAS1

(Pectobacterium
atrosepticum) 		PF01867
(Cas_Cas1) 		5 LEU A 201
LEU A 198
GLU A 165
LEU A 167
LEU A 171
 None
 1.14A 4wg0F-5fclA:
undetectable
4wg0G-5fclA:
undetectable
4wg0H-5fclA:
undetectable		 4wg0F-5fclA:
4.20
4wg0G-5fclA:
4.20
4wg0H-5fclA:
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.
5h2v IMPORTIN SUBUNIT
BETA-3

(Saccharomyces
cerevisiae) 		PF13513
(HEAT_EZ) 		5 LEU A  51
LEU A  47
LEU A  70
ALA A  30
LEU A  34
 None
 1.03A 4wg0F-5h2vA:
undetectable
4wg0G-5h2vA:
undetectable
4wg0H-5h2vA:
undetectable		 4wg0F-5h2vA:
1.22
4wg0G-5h2vA:
1.22
4wg0H-5h2vA:
1.22
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.
5ikn THIOREDOXIN-1

(Escherichia
coli) 		PF00085
(Thioredoxin) 		5 LEU K 103
LEU K  24
LEU K  99
GLU K  44
LEU K  42
 None
 0.97A 4wg0F-5iknK:
undetectable
4wg0G-5iknK:
undetectable
4wg0H-5iknK:
undetectable		 4wg0F-5iknK:
7.62
4wg0G-5iknK:
7.62
4wg0H-5iknK:
7.62
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.
5iy6 GENERAL
TRANSCRIPTION FACTOR
IIF SUBUNIT 2

(Homo sapiens) 		PF02270
(TFIIF_beta) 		5 LEU T 199
GLU T 219
LYS T 218
LEU T 217
LEU T 213
 None
 1.10A 4wg0F-5iy6T:
undetectable
4wg0G-5iy6T:
undetectable
4wg0H-5iy6T:
undetectable		 4wg0F-5iy6T:
5.78
4wg0G-5iy6T:
5.78
4wg0H-5iy6T:
5.78
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.
5jhq TANKYRASE-1

(Homo sapiens) 		PF00023
(Ank)
PF12796
(Ank_2)
PF13606
(Ank_3) 		5 LEU A 480
ARG A 481
LEU A 484
GLU A 441
LEU A 439
 None
 1.17A 4wg0F-5jhqA:
undetectable
4wg0G-5jhqA:
undetectable
4wg0H-5jhqA:
undetectable		 4wg0F-5jhqA:
3.32
4wg0G-5jhqA:
3.32
4wg0H-5jhqA:
3.32
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.
5lox PEPTIDASE

(Pseudomonas
aeruginosa) 		no annotation 5 LEU A 169
ARG A 170
LEU A 173
LEU A 192
TYR A 214
 None
 1.04A 4wg0F-5loxA:
undetectable
4wg0G-5loxA:
undetectable
4wg0H-5loxA:
undetectable		 4wg0F-5loxA:
3.93
4wg0G-5loxA:
3.93
4wg0H-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.
5op0 DNA POLYMERASE LIGD,
POLYMERASE DOMAIN

(Mycolicibacterium
smegmatis) 		no annotation 5 LEU B 169
LEU B 164
LEU B 185
ALA B 202
LEU B 203
 None
 1.00A 4wg0F-5op0B:
undetectable
4wg0G-5op0B:
undetectable
4wg0H-5op0B:
undetectable		 4wg0F-5op0B:
6.91
4wg0G-5op0B:
6.91
4wg0H-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 LEU A  88
LEU A  84
ALA A  59
LEU A  58
TYR A  61
 None
 0.92A 4wg0F-5ovtA:
undetectable
4wg0G-5ovtA:
undetectable
4wg0H-5ovtA:
undetectable		 4wg0F-5ovtA:
undetectable
4wg0G-5ovtA:
undetectable
4wg0H-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.
5tub SHARK TBC1D15
GTPASE-ACTIVATING
PROTEIN

(Squalimorphii) 		PF00566
(RabGAP-TBC) 		5 LEU A 648
LEU A 525
ALA A 627
LEU A 584
TYR A 631
 None
 1.15A 4wg0F-5tubA:
undetectable
4wg0G-5tubA:
undetectable
4wg0H-5tubA:
undetectable		 4wg0F-5tubA:
3.17
4wg0G-5tubA:
3.17
4wg0H-5tubA:
3.17
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.
5xft DEHYDROASCORBATE
REDUCTASE

(Chlamydomonas
reinhardtii) 		no annotation 5 LEU A 162
LEU A 177
ALA A 189
LEU A 188
TYR A 187
 None
 1.15A 4wg0F-5xftA:
undetectable
4wg0G-5xftA:
undetectable
4wg0H-5xftA:
undetectable		 4wg0F-5xftA:
undetectable
4wg0G-5xftA:
undetectable
4wg0H-5xftA:
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.
5xoh BERGAPTOL
O-METHYLTRANSFERASE

(Peucedanum
praeruptorum) 		no annotation 5 LEU A 110
LEU A  40
LEU A  31
ALA A  80
LEU A  79
 None
 1.02A 4wg0F-5xohA:
undetectable
4wg0G-5xohA:
undetectable
4wg0H-5xohA:
undetectable		 4wg0F-5xohA:
undetectable
4wg0G-5xohA:
undetectable
4wg0H-5xohA:
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.
5xxu RIBOSOMAL PROTEIN
US11
RIBOSOMAL PROTEIN
ES26

(Toxoplasma
gondii;
Toxoplasma
gondii) 		PF00411
(Ribosomal_S11)
PF00318
(Ribosomal_S2) 		5 ASN a  43
LEU a  64
LEU a  53
ALA O 117
LEU O 121
 None
 1.06A 4wg0F-5xxua:
undetectable
4wg0G-5xxua:
undetectable
4wg0H-5xxua:
undetectable		 4wg0F-5xxua:
11.76
4wg0G-5xxua:
11.76
4wg0H-5xxua:
11.76
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.
5y4d ANKYRIN-1,ANKYRIN-2,
ANKYRIN-2

(Homo sapiens;
Mus musculus) 		PF00023
(Ank)
PF12796
(Ank_2)
PF13637
(Ank_4) 		5 LEU A2251
LEU A2252
LEU A2212
ALA A2195
LEU A2196
 None
 0.98A 4wg0F-5y4dA:
undetectable
4wg0G-5y4dA:
undetectable
4wg0H-5y4dA:
undetectable		 4wg0F-5y4dA:
1.38
4wg0G-5y4dA:
1.38
4wg0H-5y4dA:
1.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c7s PUTATIVE RIFAMPIN
MONOOXYGENASE

(Nocardia
farcinica) 		no annotation 5 ASN A 298
LEU A 299
LEU A 272
LEU A 303
LEU A 316
 None
 1.17A 4wg0F-6c7sA:
undetectable
4wg0G-6c7sA:
undetectable
4wg0H-6c7sA:
undetectable		 4wg0F-6c7sA:
undetectable
4wg0G-6c7sA:
undetectable
4wg0H-6c7sA:
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.
6ccz SERINE
HYDROXYMETHYLTRANSFE
RASE

(Medicago
truncatula) 		no annotation 5 LEU A 401
ARG A 268
LEU A 394
GLU A 471
LEU A 390
 None
 1.13A 4wg0F-6cczA:
undetectable
4wg0G-6cczA:
undetectable
4wg0H-6cczA:
undetectable		 4wg0F-6cczA:
undetectable
4wg0G-6cczA:
undetectable
4wg0H-6cczA:
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.
6cf6 TANKYRASE-1

(Mus musculus) 		no annotation 5 LEU A 473
ARG A 474
LEU A 477
GLU A 434
LEU A 432
 None
 1.13A 4wg0F-6cf6A:
undetectable
4wg0G-6cf6A:
undetectable
4wg0H-6cf6A:
undetectable		 4wg0F-6cf6A:
undetectable
4wg0G-6cf6A:
undetectable
4wg0H-6cf6A:
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.
6eot DIPEPTIDYL PEPTIDASE
8

(Homo sapiens) 		no annotation 5 LEU A  65
LEU A  64
LEU A 881
ALA A 693
LEU A 695
 None
 1.18A 4wg0F-6eotA:
undetectable
4wg0G-6eotA:
undetectable
4wg0H-6eotA:
undetectable		 4wg0F-6eotA:
undetectable
4wg0G-6eotA:
undetectable
4wg0H-6eotA:
undetectable