SIMILAR PATTERNS OF AMINO ACIDS FOR 4Z90_F_4LEF402

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.
1b25 PROTEIN
(FORMALDEHYDE
FERREDOXIN
OXIDOREDUCTASE)


(Pyrococcus
furiosus)
PF01314
(AFOR_C)
PF02730
(AFOR_N)
4 LEU A 373
ALA A 352
LEU A 384
ALA A 388
None
0.54A 4z90F-1b25A:
0.0
4z90G-1b25A:
0.0
4z90H-1b25A:
0.0
4z90J-1b25A:
0.0
4z90F-1b25A:
20.50
4z90G-1b25A:
20.50
4z90H-1b25A:
20.50
4z90J-1b25A:
20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ci9 PROTEIN
(CARBOXYLESTERASE)


(Burkholderia
gladioli)
PF00144
(Beta-lactamase)
5 LEU A 369
ALA A 281
LEU A 367
ALA A 287
LEU A  73
None
1.01A 4z90F-1ci9A:
0.0
4z90G-1ci9A:
0.0
4z90H-1ci9A:
0.0
4z90J-1ci9A:
0.0
4z90F-1ci9A:
21.38
4z90G-1ci9A:
21.38
4z90H-1ci9A:
21.38
4z90J-1ci9A:
21.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1d2z DEATH DOMAIN OF
PELLE


(Drosophila
melanogaster)
PF00531
(Death)
4 LEU A  49
LEU A  58
LEU A  45
ALA A 113
None
0.67A 4z90F-1d2zA:
undetectable
4z90G-1d2zA:
undetectable
4z90H-1d2zA:
undetectable
4z90J-1d2zA:
undetectable
4z90F-1d2zA:
18.18
4z90G-1d2zA:
18.18
4z90H-1d2zA:
18.18
4z90J-1d2zA:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fx4 RECEPTOR-TYPE
ADENYLATE CYCLASE
GRESAG 4.3


(Trypanosoma
brucei)
PF00211
(Guanylate_cyc)
4 LEU A1069
LEU A1091
ALA A 953
LEU A1061
None
0.65A 4z90F-1fx4A:
0.0
4z90G-1fx4A:
0.0
4z90H-1fx4A:
undetectable
4z90J-1fx4A:
undetectable
4z90F-1fx4A:
21.04
4z90G-1fx4A:
21.04
4z90H-1fx4A:
21.04
4z90J-1fx4A:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gzg DELTA-AMINOLEVULINIC
ACID DEHYDRATASE


(Pseudomonas
aeruginosa)
PF00490
(ALAD)
5 LEU A  83
LEU A  85
ALA A 111
LEU A 122
ALA A  72
None
None
None
SO4  A1340 (-4.8A)
None
1.24A 4z90F-1gzgA:
0.0
4z90G-1gzgA:
0.0
4z90H-1gzgA:
0.0
4z90J-1gzgA:
0.0
4z90F-1gzgA:
21.59
4z90G-1gzgA:
21.59
4z90H-1gzgA:
21.59
4z90J-1gzgA:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hcu ALPHA-1,2-MANNOSIDAS
E


(Trichoderma
reesei)
PF01532
(Glyco_hydro_47)
4 LEU A 106
ALA A 137
LEU A 110
ALA A 141
None
0.67A 4z90F-1hcuA:
1.0
4z90G-1hcuA:
1.1
4z90H-1hcuA:
1.0
4z90J-1hcuA:
1.1
4z90F-1hcuA:
22.31
4z90G-1hcuA:
22.31
4z90H-1hcuA:
22.31
4z90J-1hcuA:
22.31
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.
1i4s RIBONUCLEASE III

(Aquifex
aeolicus)
PF14622
(Ribonucleas_3_3)
4 LEU A  21
ALA A 115
ALA A 111
LEU A   7
None
0.68A 4z90F-1i4sA:
undetectable
4z90G-1i4sA:
undetectable
4z90H-1i4sA:
undetectable
4z90J-1i4sA:
undetectable
4z90F-1i4sA:
19.14
4z90G-1i4sA:
19.14
4z90H-1i4sA:
19.14
4z90J-1i4sA:
19.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ile ISOLEUCYL-TRNA
SYNTHETASE


(Thermus
thermophilus)
PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1)
5 LEU A 287
LEU A 211
ALA A 222
ALA A 250
LEU A 284
None
1.24A 4z90F-1ileA:
3.5
4z90G-1ileA:
3.6
4z90H-1ileA:
3.6
4z90J-1ileA:
2.1
4z90F-1ileA:
17.36
4z90G-1ileA:
17.36
4z90H-1ileA:
17.36
4z90J-1ileA:
17.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1j2b ARCHAEOSINE
TRNA-GUANINE
TRANSGLYCOSYLASE


(Pyrococcus
horikoshii)
PF01472
(PUA)
PF01702
(TGT)
PF14809
(TGT_C1)
PF14810
(TGT_C2)
5 LEU A 150
ALA A 153
LEU A 184
ALA A 166
LEU A 146
None
1.09A 4z90F-1j2bA:
0.0
4z90G-1j2bA:
undetectable
4z90H-1j2bA:
0.0
4z90J-1j2bA:
0.0
4z90F-1j2bA:
21.12
4z90G-1j2bA:
21.12
4z90H-1j2bA:
21.12
4z90J-1j2bA:
21.12
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.
1kej TERMINAL
DEOXYNUCLEOTIDYLTRAN
SFERASE SHORT
ISOFORM


(Mus musculus)
PF10391
(DNA_pol_lambd_f)
PF14716
(HHH_8)
PF14791
(DNA_pol_B_thumb)
PF14792
(DNA_pol_B_palm)
4 LEU A 406
LEU A 408
ALA A 318
LEU A 435
None
0.61A 4z90F-1kejA:
0.0
4z90G-1kejA:
0.0
4z90H-1kejA:
0.0
4z90J-1kejA:
0.0
4z90F-1kejA:
19.79
4z90G-1kejA:
19.79
4z90H-1kejA:
19.79
4z90J-1kejA:
19.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lns X-PROLYL DIPEPTIDYL
AMINOPEPTIDASE


(Lactococcus
lactis)
PF02129
(Peptidase_S15)
PF08530
(PepX_C)
PF09168
(PepX_N)
4 LEU A 619
ALA A 634
LEU A 711
LEU A 754
None
0.63A 4z90F-1lnsA:
0.0
4z90G-1lnsA:
0.0
4z90H-1lnsA:
0.0
4z90J-1lnsA:
0.0
4z90F-1lnsA:
17.57
4z90G-1lnsA:
17.57
4z90H-1lnsA:
17.57
4z90J-1lnsA:
17.57
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.
1mdf 2,3-DIHYDROXYBENZOAT
E-AMP LIGASE


(Bacillus
subtilis)
PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
5 LEU A 303
LEU A 278
ALA A 229
ALA A 264
LEU A 300
None
1.46A 4z90F-1mdfA:
undetectable
4z90G-1mdfA:
undetectable
4z90H-1mdfA:
undetectable
4z90J-1mdfA:
undetectable
4z90F-1mdfA:
19.64
4z90G-1mdfA:
19.64
4z90H-1mdfA:
19.64
4z90J-1mdfA:
19.64
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.
1mn6 POLYKETIDE SYNTHASE
IV


(Streptomyces
venezuelae)
PF00975
(Thioesterase)
4 LEU A  29
ALA A 217
LEU A 197
ALA A  79
None
0.58A 4z90F-1mn6A:
undetectable
4z90G-1mn6A:
undetectable
4z90H-1mn6A:
undetectable
4z90J-1mn6A:
undetectable
4z90F-1mn6A:
19.35
4z90G-1mn6A:
19.35
4z90H-1mn6A:
19.35
4z90J-1mn6A:
19.35
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.
1n11 ANKYRIN

(Homo sapiens)
PF00023
(Ank)
PF12796
(Ank_2)
PF13637
(Ank_4)
PF13857
(Ank_5)
5 LEU A 490
LEU A 474
ALA A 478
ALA A 510
ALA A 521
None
1.01A 4z90F-1n11A:
undetectable
4z90G-1n11A:
undetectable
4z90H-1n11A:
undetectable
4z90J-1n11A:
undetectable
4z90F-1n11A:
18.64
4z90G-1n11A:
18.64
4z90H-1n11A:
18.64
4z90J-1n11A:
18.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ngr P75 LOW AFFINITY
NEUROTROPHIN
RECEPTOR


(Rattus
norvegicus)
PF00531
(Death)
5 LEU A 360
ALA A 402
LEU A 364
ALA A 398
LEU A 352
None
0.91A 4z90F-1ngrA:
undetectable
4z90G-1ngrA:
undetectable
4z90H-1ngrA:
undetectable
4z90J-1ngrA:
undetectable
4z90F-1ngrA:
15.56
4z90G-1ngrA:
15.56
4z90H-1ngrA:
15.56
4z90J-1ngrA:
15.56
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.
1nps DEVELOPMENT-SPECIFIC
PROTEIN S


(Myxococcus
xanthus)
PF00030
(Crystall)
4 LEU A  71
LEU A  51
ALA A  49
ALA A  68
None
0.61A 4z90F-1npsA:
undetectable
4z90G-1npsA:
undetectable
4z90H-1npsA:
undetectable
4z90J-1npsA:
undetectable
4z90F-1npsA:
13.98
4z90G-1npsA:
13.98
4z90H-1npsA:
13.98
4z90J-1npsA:
13.98
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.
1nxi CONSERVED
HYPOTHETICAL PROTEIN
VC0424


(Vibrio cholerae)
PF06877
(RraB)
5 LEU A 104
ALA A  60
LEU A 107
ALA A  56
ALA A  86
None
1.02A 4z90F-1nxiA:
undetectable
4z90G-1nxiA:
undetectable
4z90H-1nxiA:
undetectable
4z90J-1nxiA:
undetectable
4z90F-1nxiA:
16.67
4z90G-1nxiA:
16.67
4z90H-1nxiA:
16.67
4z90J-1nxiA:
16.67
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.
1o9g RRNA
METHYLTRANSFERASE


(Streptomyces
viridochromogenes)
PF11599
(AviRa)
5 LEU A  69
ALA A  43
ALA A 211
LEU A  65
ALA A  36
None
1.08A 4z90F-1o9gA:
undetectable
4z90G-1o9gA:
undetectable
4z90H-1o9gA:
undetectable
4z90J-1o9gA:
undetectable
4z90F-1o9gA:
24.11
4z90G-1o9gA:
24.11
4z90H-1o9gA:
24.11
4z90J-1o9gA:
24.11
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.
1o9g RRNA
METHYLTRANSFERASE


(Streptomyces
viridochromogenes)
PF11599
(AviRa)
5 LEU A  69
LEU A  55
ALA A 211
LEU A  65
ALA A  36
None
1.15A 4z90F-1o9gA:
undetectable
4z90G-1o9gA:
undetectable
4z90H-1o9gA:
undetectable
4z90J-1o9gA:
undetectable
4z90F-1o9gA:
24.11
4z90G-1o9gA:
24.11
4z90H-1o9gA:
24.11
4z90J-1o9gA:
24.11
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.
1ojl TRANSCRIPTIONAL
REGULATORY PROTEIN
ZRAR


(Salmonella
enterica)
PF00158
(Sigma54_activat)
PF02954
(HTH_8)
4 LEU A 382
LEU A 349
ALA A 323
ALA A 368
None
0.67A 4z90F-1ojlA:
undetectable
4z90G-1ojlA:
undetectable
4z90H-1ojlA:
undetectable
4z90J-1ojlA:
undetectable
4z90F-1ojlA:
21.81
4z90G-1ojlA:
21.81
4z90H-1ojlA:
21.81
4z90J-1ojlA:
21.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1on0 YYCN PROTEIN

(Bacillus
subtilis)
PF00583
(Acetyltransf_1)
5 LEU A 113
ALA A 117
LEU A 125
ALA A  89
LEU A  76
None
1.08A 4z90F-1on0A:
undetectable
4z90G-1on0A:
undetectable
4z90H-1on0A:
undetectable
4z90J-1on0A:
undetectable
4z90F-1on0A:
18.07
4z90G-1on0A:
18.07
4z90H-1on0A:
18.07
4z90J-1on0A:
18.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pg6 HYPOTHETICAL PROTEIN
SPYM3_0169


(Streptococcus
pyogenes)
PF01987
(AIM24)
5 LEU A  86
LEU A  88
ALA A 115
LEU A  23
ALA A  78
None
1.29A 4z90F-1pg6A:
undetectable
4z90G-1pg6A:
undetectable
4z90H-1pg6A:
undetectable
4z90J-1pg6A:
undetectable
4z90F-1pg6A:
20.49
4z90G-1pg6A:
20.49
4z90H-1pg6A:
20.49
4z90J-1pg6A:
20.49
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.
1q8r CROSSOVER JUNCTION
ENDODEOXYRIBONUCLEAS
E RUSA


(Escherichia
coli)
PF05866
(RusA)
4 LEU A 112
ALA A  85
LEU A   8
ALA A  78
None
0.60A 4z90F-1q8rA:
undetectable
4z90G-1q8rA:
undetectable
4z90H-1q8rA:
undetectable
4z90J-1q8rA:
undetectable
4z90F-1q8rA:
16.33
4z90G-1q8rA:
16.33
4z90H-1q8rA:
16.33
4z90J-1q8rA:
16.33
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.
1rk2 RIBOKINASE

(Escherichia
coli)
PF00294
(PfkB)
4 LEU A 261
ALA A 274
LEU A 265
LEU A 221
None
0.68A 4z90F-1rk2A:
undetectable
4z90G-1rk2A:
undetectable
4z90H-1rk2A:
undetectable
4z90J-1rk2A:
undetectable
4z90F-1rk2A:
22.87
4z90G-1rk2A:
22.87
4z90H-1rk2A:
22.87
4z90J-1rk2A:
22.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ul1 FLAP ENDONUCLEASE-1

(Homo sapiens)
PF00752
(XPG_N)
PF00867
(XPG_I)
4 LEU X 226
ALA X 246
LEU X 230
LEU X 216
None
0.65A 4z90F-1ul1X:
undetectable
4z90G-1ul1X:
undetectable
4z90H-1ul1X:
undetectable
4z90J-1ul1X:
undetectable
4z90F-1ul1X:
21.99
4z90G-1ul1X:
21.99
4z90H-1ul1X:
21.99
4z90J-1ul1X:
21.99
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.
1wwl MONOCYTE
DIFFERENTIATION
ANTIGEN CD14


(Mus musculus)
no annotation 4 LEU A 232
ALA A 228
ALA A 224
LEU A 235
None
0.67A 4z90F-1wwlA:
undetectable
4z90G-1wwlA:
undetectable
4z90H-1wwlA:
undetectable
4z90J-1wwlA:
undetectable
4z90F-1wwlA:
22.82
4z90G-1wwlA:
22.82
4z90H-1wwlA:
22.82
4z90J-1wwlA:
22.82
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.
1y4c MALTOSE BINDING
PROTEIN FUSED WITH
DESIGNED HELICAL
PROTEIN


(Escherichia
coli)
PF13416
(SBP_bac_8)
4 ALA A 621
LEU A 638
ALA A 582
ALA A 625
None
0.67A 4z90F-1y4cA:
7.1
4z90G-1y4cA:
7.0
4z90H-1y4cA:
6.3
4z90J-1y4cA:
7.0
4z90F-1y4cA:
18.91
4z90G-1y4cA:
18.91
4z90H-1y4cA:
18.91
4z90J-1y4cA:
18.91
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.
1y4c MALTOSE BINDING
PROTEIN FUSED WITH
DESIGNED HELICAL
PROTEIN


(Escherichia
coli)
PF13416
(SBP_bac_8)
4 LEU A 579
ALA A 566
LEU A 583
ALA A 637
None
0.60A 4z90F-1y4cA:
7.1
4z90G-1y4cA:
7.0
4z90H-1y4cA:
6.3
4z90J-1y4cA:
7.0
4z90F-1y4cA:
18.91
4z90G-1y4cA:
18.91
4z90H-1y4cA:
18.91
4z90J-1y4cA:
18.91
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.
1y4c MALTOSE BINDING
PROTEIN FUSED WITH
DESIGNED HELICAL
PROTEIN


(Escherichia
coli)
PF13416
(SBP_bac_8)
4 LEU A 583
ALA A 637
LEU A 579
ALA A 566
None
0.68A 4z90F-1y4cA:
7.1
4z90G-1y4cA:
7.0
4z90H-1y4cA:
6.3
4z90J-1y4cA:
7.0
4z90F-1y4cA:
18.91
4z90G-1y4cA:
18.91
4z90H-1y4cA:
18.91
4z90J-1y4cA:
18.91
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.
1y4c MALTOSE BINDING
PROTEIN FUSED WITH
DESIGNED HELICAL
PROTEIN


(Escherichia
coli)
PF13416
(SBP_bac_8)
4 LEU A 607
ALA A 648
LEU A 611
ALA A 555
None
0.67A 4z90F-1y4cA:
7.1
4z90G-1y4cA:
7.0
4z90H-1y4cA:
6.3
4z90J-1y4cA:
7.0
4z90F-1y4cA:
18.91
4z90G-1y4cA:
18.91
4z90H-1y4cA:
18.91
4z90J-1y4cA:
18.91
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.
1y4c MALTOSE BINDING
PROTEIN FUSED WITH
DESIGNED HELICAL
PROTEIN


(Escherichia
coli)
PF13416
(SBP_bac_8)
4 LEU A 634
ALA A 621
LEU A 638
ALA A 582
None
0.64A 4z90F-1y4cA:
7.1
4z90G-1y4cA:
7.0
4z90H-1y4cA:
6.3
4z90J-1y4cA:
7.0
4z90F-1y4cA:
18.91
4z90G-1y4cA:
18.91
4z90H-1y4cA:
18.91
4z90J-1y4cA:
18.91
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.
1yaa ASPARTATE
AMINOTRANSFERASE


(Saccharomyces
cerevisiae)
PF00155
(Aminotran_1_2)
5 LEU A 392
LEU A 337
ALA A 401
ALA A 403
LEU A  35
None
1.30A 4z90F-1yaaA:
undetectable
4z90G-1yaaA:
undetectable
4z90H-1yaaA:
undetectable
4z90J-1yaaA:
undetectable
4z90F-1yaaA:
23.08
4z90G-1yaaA:
23.08
4z90H-1yaaA:
23.08
4z90J-1yaaA:
23.08
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.
1yxo 4-HYDROXYTHREONINE-4
-PHOSPHATE
DEHYDROGENASE 1


(Pseudomonas
aeruginosa)
PF04166
(PdxA)
4 LEU A1041
ALA A1036
ALA A1118
ALA A1034
None
0.63A 4z90F-1yxoA:
undetectable
4z90G-1yxoA:
undetectable
4z90H-1yxoA:
undetectable
4z90J-1yxoA:
undetectable
4z90F-1yxoA:
22.74
4z90G-1yxoA:
22.74
4z90H-1yxoA:
22.74
4z90J-1yxoA:
22.74
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.
2a1j DNA EXCISION REPAIR
PROTEIN ERCC-1


(Homo sapiens)
PF14520
(HHH_5)
4 LEU B 285
LEU B 271
ALA B 266
LEU B 239
None
0.48A 4z90F-2a1jB:
undetectable
4z90G-2a1jB:
undetectable
4z90H-2a1jB:
undetectable
4z90J-2a1jB:
undetectable
4z90F-2a1jB:
12.10
4z90G-2a1jB:
12.10
4z90H-2a1jB:
12.10
4z90J-2a1jB:
12.10
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.
2ay9 AROMATIC AMINO ACID
AMINOTRANSFERASE


(Paracoccus
denitrificans)
PF00155
(Aminotran_1_2)
5 LEU A 392
LEU A 337
ALA A 401
ALA A 403
LEU A  35
None
1.21A 4z90F-2ay9A:
undetectable
4z90G-2ay9A:
undetectable
4z90H-2ay9A:
undetectable
4z90J-2ay9A:
undetectable
4z90F-2ay9A:
22.28
4z90G-2ay9A:
22.28
4z90H-2ay9A:
22.28
4z90J-2ay9A:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dc0 PROBABLE AMIDASE

(Thermus
thermophilus)
PF01425
(Amidase)
5 LEU A 164
ALA A 109
ALA A 107
LEU A 223
ALA A 100
None
1.34A 4z90F-2dc0A:
undetectable
4z90G-2dc0A:
undetectable
4z90H-2dc0A:
undetectable
4z90J-2dc0A:
undetectable
4z90F-2dc0A:
21.14
4z90G-2dc0A:
21.14
4z90H-2dc0A:
21.14
4z90J-2dc0A:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dou PROBABLE
N-SUCCINYLDIAMINOPIM
ELATE
AMINOTRANSFERASE


(Thermus
thermophilus)
PF00155
(Aminotran_1_2)
5 LEU A 104
ALA A 127
LEU A 100
ALA A 120
LEU A 114
None
0.92A 4z90F-2douA:
undetectable
4z90G-2douA:
undetectable
4z90H-2douA:
undetectable
4z90J-2douA:
undetectable
4z90F-2douA:
23.15
4z90G-2douA:
23.15
4z90H-2douA:
23.15
4z90J-2douA:
23.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2elc ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE


(Thermus
thermophilus)
PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
5 LEU A 311
ALA A 284
ALA A 286
LEU A 270
ALA A 280
None
1.21A 4z90F-2elcA:
undetectable
4z90G-2elcA:
undetectable
4z90H-2elcA:
undetectable
4z90J-2elcA:
undetectable
4z90F-2elcA:
22.47
4z90G-2elcA:
22.47
4z90H-2elcA:
22.47
4z90J-2elcA:
22.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gqt UDP-N-ACETYLENOLPYRU
VYLGLUCOSAMINE
REDUCTASE


(Thermus
caldophilus)
PF01565
(FAD_binding_4)
PF02873
(MurB_C)
5 LEU A  98
LEU A  83
ALA A 111
LEU A 166
ALA A 126
None
None
FAD  A 601 (-4.1A)
None
None
0.85A 4z90F-2gqtA:
undetectable
4z90G-2gqtA:
undetectable
4z90H-2gqtA:
undetectable
4z90J-2gqtA:
undetectable
4z90F-2gqtA:
20.93
4z90G-2gqtA:
20.93
4z90H-2gqtA:
20.93
4z90J-2gqtA:
20.93
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.
2id3 PUTATIVE
TRANSCRIPTIONAL
REGULATOR


(Streptomyces
coelicolor)
PF00440
(TetR_N)
PF16859
(TetR_C_11)
4 LEU A  39
ALA A  30
ALA A  48
LEU A  65
None
0.60A 4z90F-2id3A:
2.6
4z90G-2id3A:
2.7
4z90H-2id3A:
2.6
4z90J-2id3A:
2.6
4z90F-2id3A:
18.83
4z90G-2id3A:
18.83
4z90H-2id3A:
18.83
4z90J-2id3A:
18.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2id5 LEUCINE RICH REPEAT
NEURONAL 6A


(Homo sapiens)
PF07679
(I-set)
PF13306
(LRR_5)
PF13855
(LRR_8)
4 LEU A 164
ALA A 171
ALA A 147
LEU A 140
None
0.61A 4z90F-2id5A:
undetectable
4z90G-2id5A:
undetectable
4z90H-2id5A:
undetectable
4z90J-2id5A:
undetectable
4z90F-2id5A:
22.00
4z90G-2id5A:
22.00
4z90H-2id5A:
22.00
4z90J-2id5A:
22.00
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.
2jjf L-LYSINE EPSILON
AMINOTRANSFERASE


(Mycobacterium
tuberculosis)
PF00202
(Aminotran_3)
4 LEU A 402
ALA A 444
LEU A 406
ALA A 440
None
0.64A 4z90F-2jjfA:
undetectable
4z90G-2jjfA:
undetectable
4z90H-2jjfA:
undetectable
4z90J-2jjfA:
undetectable
4z90F-2jjfA:
21.41
4z90G-2jjfA:
21.41
4z90H-2jjfA:
21.41
4z90J-2jjfA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2l6b NR1C

(Escherichia
coli)
PF12796
(Ank_2)
5 LEU A  62
ALA A  66
ALA A  70
LEU A  94
ALA A  50
None
1.42A 4z90F-2l6bA:
undetectable
4z90G-2l6bA:
undetectable
4z90H-2l6bA:
undetectable
4z90J-2l6bA:
undetectable
4z90F-2l6bA:
13.66
4z90G-2l6bA:
13.66
4z90H-2l6bA:
13.66
4z90J-2l6bA:
13.66
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.
2no5 (S)-2-HALOACID
DEHALOGENASE IVA


(Burkholderia
cepacia)
PF13419
(HAD_2)
5 LEU A 130
LEU A 139
ALA A 116
LEU A 126
ALA A  12
None
None
None
None
ASL  A  11 ( 3.3A)
1.09A 4z90F-2no5A:
undetectable
4z90G-2no5A:
undetectable
4z90H-2no5A:
undetectable
4z90J-2no5A:
undetectable
4z90F-2no5A:
19.57
4z90G-2no5A:
19.57
4z90H-2no5A:
19.57
4z90J-2no5A:
19.57
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.
2q80 GERANYLGERANYL
PYROPHOSPHATE
SYNTHETASE


(Homo sapiens)
PF00348
(polyprenyl_synt)
4 LEU A 158
LEU A 162
ALA A 111
LEU A  56
None
0.67A 4z90F-2q80A:
undetectable
4z90G-2q80A:
3.0
4z90H-2q80A:
undetectable
4z90J-2q80A:
2.0
4z90F-2q80A:
21.84
4z90G-2q80A:
21.84
4z90H-2q80A:
21.84
4z90J-2q80A:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q8q IRON-REGULATED
SURFACE DETERMINANT
E


(Staphylococcus
aureus)
PF01497
(Peripla_BP_2)
4 LEU A 145
LEU A 149
ALA A 276
ALA A 272
None
0.63A 4z90F-2q8qA:
undetectable
4z90G-2q8qA:
undetectable
4z90H-2q8qA:
undetectable
4z90J-2q8qA:
undetectable
4z90F-2q8qA:
22.39
4z90G-2q8qA:
22.39
4z90H-2q8qA:
22.39
4z90J-2q8qA:
22.39
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.
2waa XYLAN ESTERASE,
PUTATIVE, AXE2C


(Cellvibrio
japonicus)
PF13472
(Lipase_GDSL_2)
4 LEU A 333
LEU A 228
LEU A 329
ALA A 303
None
0.64A 4z90F-2waaA:
undetectable
4z90G-2waaA:
undetectable
4z90H-2waaA:
undetectable
4z90J-2waaA:
undetectable
4z90F-2waaA:
20.43
4z90G-2waaA:
20.43
4z90H-2waaA:
20.43
4z90J-2waaA:
20.43
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.
2zau SELENIDE, WATER
DIKINASE


(Aquifex
aeolicus)
PF00586
(AIRS)
PF02769
(AIRS_C)
5 LEU A 226
ALA A 229
LEU A 333
ALA A 240
LEU A 289
None
0.97A 4z90F-2zauA:
undetectable
4z90G-2zauA:
undetectable
4z90H-2zauA:
undetectable
4z90J-2zauA:
undetectable
4z90F-2zauA:
22.10
4z90G-2zauA:
22.10
4z90H-2zauA:
22.10
4z90J-2zauA:
22.10
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.
2zop PUTATIVE
UNCHARACTERIZED
PROTEIN TTHB164


(Thermus
thermophilus)
PF09701
(Cas_Cmr5)
4 LEU A  78
ALA A  82
LEU A  48
LEU A  70
None
0.62A 4z90F-2zopA:
2.1
4z90G-2zopA:
2.0
4z90H-2zopA:
2.2
4z90J-2zopA:
2.0
4z90F-2zopA:
16.77
4z90G-2zopA:
16.77
4z90H-2zopA:
16.77
4z90J-2zopA:
16.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3agf GLUTAMINASE 1

(Bacillus
subtilis)
PF04960
(Glutaminase)
4 LEU A 198
ALA A 133
ALA A 129
ALA A 181
None
0.65A 4z90F-3agfA:
undetectable
4z90G-3agfA:
undetectable
4z90H-3agfA:
undetectable
4z90J-3agfA:
undetectable
4z90F-3agfA:
18.80
4z90G-3agfA:
18.80
4z90H-3agfA:
18.80
4z90J-3agfA:
18.80
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.
3aoe GLUTAMATE
DEHYDROGENASE


(Thermus
thermophilus)
no annotation 5 LEU E 295
LEU E 293
ALA E 312
ALA E 336
LEU E 323
None
1.48A 4z90F-3aoeE:
undetectable
4z90G-3aoeE:
undetectable
4z90H-3aoeE:
undetectable
4z90J-3aoeE:
undetectable
4z90F-3aoeE:
21.48
4z90G-3aoeE:
21.48
4z90H-3aoeE:
21.48
4z90J-3aoeE:
21.48
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.
3b95 EUCHROMATIC
HISTONE-LYSINE
N-METHYLTRANSFERASE
1


(Homo sapiens)
PF12796
(Ank_2)
PF13637
(Ank_4)
4 LEU A 879
ALA A 883
LEU A 895
ALA A 891
None
0.66A 4z90F-3b95A:
undetectable
4z90G-3b95A:
undetectable
4z90H-3b95A:
undetectable
4z90J-3b95A:
undetectable
4z90F-3b95A:
19.35
4z90G-3b95A:
19.35
4z90H-3b95A:
19.35
4z90J-3b95A:
19.35
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.
3bjd PUTATIVE
3-OXOACYL-(ACYL-CARR
IER-PROTEIN)
SYNTHASE


(Pseudomonas
aeruginosa)
PF14515
(HOASN)
PF14518
(Haem_oxygenas_2)
5 LEU A  63
ALA A  19
ALA A  23
ALA A  25
LEU A  42
None
1.22A 4z90F-3bjdA:
undetectable
4z90G-3bjdA:
undetectable
4z90H-3bjdA:
undetectable
4z90J-3bjdA:
undetectable
4z90F-3bjdA:
19.84
4z90G-3bjdA:
19.84
4z90H-3bjdA:
19.84
4z90J-3bjdA:
19.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3c87 ENTEROCHELIN
ESTERASE


(Shigella
flexneri)
PF00756
(Esterase)
PF11806
(DUF3327)
4 LEU A 384
ALA A 278
LEU A 388
ALA A 197
None
0.63A 4z90F-3c87A:
3.6
4z90G-3c87A:
2.9
4z90H-3c87A:
2.9
4z90J-3c87A:
3.4
4z90F-3c87A:
21.69
4z90G-3c87A:
21.69
4z90H-3c87A:
21.69
4z90J-3c87A:
21.69
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.
3cb0 4-HYDROXYPHENYLACETA
TE 3-MONOOXYGENASE


(Brucella
melitensis)
PF01613
(Flavin_Reduct)
5 LEU A 122
LEU A  84
ALA A  92
ALA A  94
ALA A 110
None
1.46A 4z90F-3cb0A:
undetectable
4z90G-3cb0A:
undetectable
4z90H-3cb0A:
undetectable
4z90J-3cb0A:
undetectable
4z90F-3cb0A:
17.18
4z90G-3cb0A:
17.18
4z90H-3cb0A:
17.18
4z90J-3cb0A:
17.18
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.
3ck6 PUTATIVE MEMBRANE
TRANSPORT PROTEIN


(Vibrio
parahaemolyticus)
PF01544
(CorA)
4 LEU A  76
ALA A 190
LEU A  78
ALA A 212
None
0.68A 4z90F-3ck6A:
5.1
4z90G-3ck6A:
5.1
4z90H-3ck6A:
5.1
4z90J-3ck6A:
3.9
4z90F-3ck6A:
20.45
4z90G-3ck6A:
20.45
4z90H-3ck6A:
20.45
4z90J-3ck6A:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ck6 PUTATIVE MEMBRANE
TRANSPORT PROTEIN


(Vibrio
parahaemolyticus)
PF01544
(CorA)
4 LEU A  78
ALA A 212
LEU A  76
ALA A 190
None
0.68A 4z90F-3ck6A:
5.1
4z90G-3ck6A:
5.1
4z90H-3ck6A:
5.1
4z90J-3ck6A:
3.9
4z90F-3ck6A:
20.45
4z90G-3ck6A:
20.45
4z90H-3ck6A:
20.45
4z90J-3ck6A:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cux MALATE SYNTHASE

(Bacillus
anthracis)
PF01274
(Malate_synthase)
4 LEU A 133
ALA A 136
LEU A 160
ALA A 103
None
0.59A 4z90F-3cuxA:
1.4
4z90G-3cuxA:
1.4
4z90H-3cuxA:
undetectable
4z90J-3cuxA:
undetectable
4z90F-3cuxA:
22.48
4z90G-3cuxA:
22.48
4z90H-3cuxA:
22.48
4z90J-3cuxA:
22.48
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.
3cux MALATE SYNTHASE

(Bacillus
anthracis)
PF01274
(Malate_synthase)
4 LEU A 160
ALA A 103
LEU A 133
ALA A 136
None
0.56A 4z90F-3cuxA:
1.4
4z90G-3cuxA:
1.4
4z90H-3cuxA:
undetectable
4z90J-3cuxA:
undetectable
4z90F-3cuxA:
22.48
4z90G-3cuxA:
22.48
4z90H-3cuxA:
22.48
4z90J-3cuxA:
22.48
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.
3cv2 MALATE SYNTHASE A

(Escherichia
coli)
PF01274
(Malate_synthase)
4 LEU A 136
ALA A 139
LEU A 163
ALA A 106
None
None
None
COA  A1002 (-3.6A)
0.65A 4z90F-3cv2A:
2.7
4z90G-3cv2A:
1.9
4z90H-3cv2A:
1.8
4z90J-3cv2A:
3.1
4z90F-3cv2A:
22.72
4z90G-3cv2A:
22.72
4z90H-3cv2A:
22.72
4z90J-3cv2A:
22.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cv2 MALATE SYNTHASE A

(Escherichia
coli)
PF01274
(Malate_synthase)
4 LEU A 163
ALA A 106
LEU A 136
ALA A 139
None
COA  A1002 (-3.6A)
None
None
0.61A 4z90F-3cv2A:
2.7
4z90G-3cv2A:
1.9
4z90H-3cv2A:
1.8
4z90J-3cv2A:
3.1
4z90F-3cv2A:
22.72
4z90G-3cv2A:
22.72
4z90H-3cv2A:
22.72
4z90J-3cv2A:
22.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cwv DNA GYRASE, B
SUBUNIT, TRUNCATED


(Myxococcus
xanthus)
PF00204
(DNA_gyraseB)
4 LEU A 343
ALA A 278
ALA A 274
LEU A 242
None
0.65A 4z90F-3cwvA:
undetectable
4z90G-3cwvA:
undetectable
4z90H-3cwvA:
undetectable
4z90J-3cwvA:
undetectable
4z90F-3cwvA:
19.95
4z90G-3cwvA:
19.95
4z90H-3cwvA:
19.95
4z90J-3cwvA:
19.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d8n UROPORPHYRINOGEN-III
SYNTHASE


(Thermus
thermophilus)
PF02602
(HEM4)
5 LEU A 167
ALA A   4
ALA A 210
LEU A 190
ALA A   6
None
0.94A 4z90F-3d8nA:
undetectable
4z90G-3d8nA:
undetectable
4z90H-3d8nA:
undetectable
4z90J-3d8nA:
undetectable
4z90F-3d8nA:
21.05
4z90G-3d8nA:
21.05
4z90H-3d8nA:
21.05
4z90J-3d8nA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dm5 SIGNAL RECOGNITION
54 KDA PROTEIN


(Pyrococcus
furiosus)
PF00448
(SRP54)
PF02881
(SRP54_N)
PF02978
(SRP_SPB)
4 LEU A  10
LEU A  83
LEU A   6
ALA A  38
None
0.63A 4z90F-3dm5A:
3.5
4z90G-3dm5A:
2.1
4z90H-3dm5A:
3.4
4z90J-3dm5A:
3.7
4z90F-3dm5A:
21.43
4z90G-3dm5A:
21.43
4z90H-3dm5A:
21.43
4z90J-3dm5A:
21.43
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.
3f8t PREDICTED ATPASE
INVOLVED IN
REPLICATION CONTROL,
CDC46/MCM FAMILY


(Methanopyrus
kandleri)
PF00493
(MCM)
4 LEU A 279
LEU A 271
ALA A 312
ALA A 319
None
0.61A 4z90F-3f8tA:
undetectable
4z90G-3f8tA:
undetectable
4z90H-3f8tA:
undetectable
4z90J-3f8tA:
undetectable
4z90F-3f8tA:
23.40
4z90G-3f8tA:
23.40
4z90H-3f8tA:
23.40
4z90J-3f8tA:
23.40
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.
3g8a RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G


(Thermus
thermophilus)
PF02527
(GidB)
5 LEU A 195
LEU A 163
ALA A 182
ALA A 180
LEU A 199
None
1.17A 4z90F-3g8aA:
undetectable
4z90G-3g8aA:
undetectable
4z90H-3g8aA:
undetectable
4z90J-3g8aA:
undetectable
4z90F-3g8aA:
18.55
4z90G-3g8aA:
18.55
4z90H-3g8aA:
18.55
4z90J-3g8aA:
18.55
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.
3hkm OS03G0854200 PROTEIN

(Oryza sativa)
PF01138
(RNase_PH)
4 LEU A  84
LEU A  88
ALA A 126
ALA A 119
None
0.66A 4z90F-3hkmA:
undetectable
4z90G-3hkmA:
undetectable
4z90H-3hkmA:
undetectable
4z90J-3hkmA:
undetectable
4z90F-3hkmA:
21.08
4z90G-3hkmA:
21.08
4z90H-3hkmA:
21.08
4z90J-3hkmA:
21.08
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.
3hra ANKYRIN REPEAT
FAMILY PROTEIN


(Enterococcus
faecalis)
PF12796
(Ank_2)
PF13857
(Ank_5)
4 LEU A   9
ALA A  13
ALA A  46
LEU A  25
None
0.65A 4z90F-3hraA:
undetectable
4z90G-3hraA:
undetectable
4z90H-3hraA:
undetectable
4z90J-3hraA:
undetectable
4z90F-3hraA:
21.05
4z90G-3hraA:
21.05
4z90H-3hraA:
21.05
4z90J-3hraA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hra ANKYRIN REPEAT
FAMILY PROTEIN


(Enterococcus
faecalis)
PF12796
(Ank_2)
PF13857
(Ank_5)
5 LEU A  25
LEU A   9
ALA A  13
ALA A  46
ALA A  57
None
1.12A 4z90F-3hraA:
undetectable
4z90G-3hraA:
undetectable
4z90H-3hraA:
undetectable
4z90J-3hraA:
undetectable
4z90F-3hraA:
21.05
4z90G-3hraA:
21.05
4z90H-3hraA:
21.05
4z90J-3hraA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3il7 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3


(Staphylococcus
aureus)
PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III)
4 LEU A 135
ALA A  62
ALA A 161
LEU A  94
None
0.67A 4z90F-3il7A:
undetectable
4z90G-3il7A:
undetectable
4z90H-3il7A:
undetectable
4z90J-3il7A:
undetectable
4z90F-3il7A:
23.29
4z90G-3il7A:
23.29
4z90H-3il7A:
23.29
4z90J-3il7A:
23.29
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.
3js8 CHOLESTEROL OXIDASE

(Chromobacterium
sp. DS-1)
PF01565
(FAD_binding_4)
PF09129
(Chol_subst-bind)
5 LEU A 135
ALA A 104
LEU A 113
LEU A 139
ALA A 210
None
0.95A 4z90F-3js8A:
undetectable
4z90G-3js8A:
undetectable
4z90H-3js8A:
undetectable
4z90J-3js8A:
undetectable
4z90F-3js8A:
20.98
4z90G-3js8A:
20.98
4z90H-3js8A:
20.98
4z90J-3js8A:
20.98
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.
3l0s ADENYLATE KINASE

(Desulfovibrio
gigas)
PF00406
(ADK)
4 LEU A  72
LEU A  69
ALA A  98
LEU A  82
None
0.67A 4z90F-3l0sA:
undetectable
4z90G-3l0sA:
undetectable
4z90H-3l0sA:
undetectable
4z90J-3l0sA:
undetectable
4z90F-3l0sA:
22.01
4z90G-3l0sA:
22.01
4z90H-3l0sA:
22.01
4z90J-3l0sA:
22.01
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.
3lez BETA-LACTAMASE

(Oceanobacillus
iheyensis)
PF13354
(Beta-lactamase2)
5 LEU A  60
ALA A 274
ALA A  64
LEU A  49
ALA A 294
None
0.90A 4z90F-3lezA:
undetectable
4z90G-3lezA:
undetectable
4z90H-3lezA:
undetectable
4z90J-3lezA:
undetectable
4z90F-3lezA:
20.86
4z90G-3lezA:
20.86
4z90H-3lezA:
20.86
4z90J-3lezA:
20.86
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.
3lvu ABC TRANSPORTER,
PERIPLASMIC
SUBSTRATE-BINDING
PROTEIN


(Ruegeria
pomeroyi)
PF00496
(SBP_bac_5)
5 LEU A 440
LEU A 462
ALA A 339
ALA A 335
LEU A 438
None
None
None
None
GOL  A 604 (-4.5A)
1.46A 4z90F-3lvuA:
undetectable
4z90G-3lvuA:
undetectable
4z90H-3lvuA:
undetectable
4z90J-3lvuA:
undetectable
4z90F-3lvuA:
21.88
4z90G-3lvuA:
21.88
4z90H-3lvuA:
21.88
4z90J-3lvuA:
21.88
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.
3ml0 PENICILLIN G
ACYLASE, BETA
SUBUNIT


(Alcaligenes
faecalis)
PF01804
(Penicil_amidase)
5 LEU B 321
LEU B 342
ALA B 426
ALA B 422
LEU B 301
None
1.16A 4z90F-3ml0B:
undetectable
4z90G-3ml0B:
undetectable
4z90H-3ml0B:
undetectable
4z90J-3ml0B:
undetectable
4z90F-3ml0B:
20.43
4z90G-3ml0B:
20.43
4z90H-3ml0B:
20.43
4z90J-3ml0B:
20.43
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.
3mv3 COATOMER SUBUNIT
EPSILON


(Saccharomyces
cerevisiae)
PF04733
(Coatomer_E)
4 LEU B 204
ALA B 216
LEU B 208
ALA B 251
None
0.66A 4z90F-3mv3B:
3.5
4z90G-3mv3B:
3.5
4z90H-3mv3B:
3.6
4z90J-3mv3B:
3.4
4z90F-3mv3B:
22.70
4z90G-3mv3B:
22.70
4z90H-3mv3B:
22.70
4z90J-3mv3B:
22.70
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.
3mvk PROTEIN FUCU

(Bifidobacterium
longum)
PF05025
(RbsD_FucU)
4 LEU A  56
LEU A 137
ALA A 106
LEU A  60
None
0.57A 4z90F-3mvkA:
undetectable
4z90G-3mvkA:
undetectable
4z90H-3mvkA:
undetectable
4z90J-3mvkA:
undetectable
4z90F-3mvkA:
19.12
4z90G-3mvkA:
19.12
4z90H-3mvkA:
19.12
4z90J-3mvkA:
19.12
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.
3mwt NUCLEOPROTEIN

(Lassa
mammarenavirus)
PF00843
(Arena_nucleocap)
PF17290
(Arena_ncap_C)
5 LEU A 554
LEU A 445
ALA A 448
ALA A 452
ALA A 376
None
1.34A 4z90F-3mwtA:
undetectable
4z90G-3mwtA:
undetectable
4z90H-3mwtA:
undetectable
4z90J-3mwtA:
undetectable
4z90F-3mwtA:
20.44
4z90G-3mwtA:
20.44
4z90H-3mwtA:
20.44
4z90J-3mwtA:
20.44
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.
3myu HIGH AFFINITY
TRANSPORT SYSTEM
PROTEIN P37


(Mycoplasma
genitalium)
PF06646
(Mycoplasma_p37)
4 LEU A  59
ALA A 323
LEU A  63
LEU A  34
None
0.65A 4z90F-3myuA:
undetectable
4z90G-3myuA:
undetectable
4z90H-3myuA:
undetectable
4z90J-3myuA:
undetectable
4z90F-3myuA:
21.43
4z90G-3myuA:
21.43
4z90H-3myuA:
21.43
4z90J-3myuA:
21.43
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.
3n0u PROBABLE
N-GLYCOSYLASE/DNA
LYASE


(Thermotoga
maritima)
no annotation 4 LEU A  79
ALA A  59
LEU A  47
LEU A  75
None
0.64A 4z90F-3n0uA:
undetectable
4z90G-3n0uA:
undetectable
4z90H-3n0uA:
undetectable
4z90J-3n0uA:
undetectable
4z90F-3n0uA:
20.24
4z90G-3n0uA:
20.24
4z90H-3n0uA:
20.24
4z90J-3n0uA:
20.24
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.
3nxs LAO/AO TRANSPORT
SYSTEM ATPASE


(Mycolicibacterium
smegmatis)
PF03308
(ArgK)
4 LEU A  43
ALA A  25
ALA A  21
ALA A 144
None
0.66A 4z90F-3nxsA:
undetectable
4z90G-3nxsA:
undetectable
4z90H-3nxsA:
undetectable
4z90J-3nxsA:
undetectable
4z90F-3nxsA:
21.20
4z90G-3nxsA:
21.20
4z90H-3nxsA:
21.20
4z90J-3nxsA:
21.20
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.
3p9z UROPORPHYRINOGEN III
COSYNTHASE (HEMD)


(Helicobacter
pylori)
PF02602
(HEM4)
4 LEU A 113
ALA A 136
LEU A  28
LEU A  38
None
0.68A 4z90F-3p9zA:
undetectable
4z90G-3p9zA:
undetectable
4z90H-3p9zA:
undetectable
4z90J-3p9zA:
undetectable
4z90F-3p9zA:
18.83
4z90G-3p9zA:
18.83
4z90H-3p9zA:
18.83
4z90J-3p9zA:
18.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pnx PUTATIVE
SULFURTRANSFERASE
DSRE


(Syntrophomonas
wolfei)
PF13686
(DrsE_2)
5 LEU A  46
ALA A 110
ALA A  25
LEU A  10
ALA A  18
None
1.17A 4z90F-3pnxA:
undetectable
4z90G-3pnxA:
undetectable
4z90H-3pnxA:
undetectable
4z90J-3pnxA:
undetectable
4z90F-3pnxA:
19.50
4z90G-3pnxA:
19.50
4z90H-3pnxA:
19.50
4z90J-3pnxA:
19.50
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.
3pv2 DEGQ

(Legionella
fallonii)
PF13180
(PDZ_2)
PF13365
(Trypsin_2)
4 LEU A 412
ALA A 416
LEU A 355
ALA A 401
None
0.64A 4z90F-3pv2A:
undetectable
4z90G-3pv2A:
undetectable
4z90H-3pv2A:
undetectable
4z90J-3pv2A:
undetectable
4z90F-3pv2A:
22.08
4z90G-3pv2A:
22.08
4z90H-3pv2A:
22.08
4z90J-3pv2A:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qsj NUDIX HYDROLASE

(Alicyclobacillus
acidocaldarius)
PF00293
(NUDIX)
4 LEU A 117
LEU A 121
ALA A  89
ALA A  81
None
0.62A 4z90F-3qsjA:
undetectable
4z90G-3qsjA:
undetectable
4z90H-3qsjA:
undetectable
4z90J-3qsjA:
undetectable
4z90F-3qsjA:
19.63
4z90G-3qsjA:
19.63
4z90H-3qsjA:
19.63
4z90J-3qsjA:
19.63
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.
3rms UNCHARACTERIZED
PROTEIN


(Saccharomonospora
viridis)
PF16827
(zf-HC3)
5 LEU A 105
LEU A  95
ALA A  62
ALA A  64
ALA A  78
None
1.12A 4z90F-3rmsA:
undetectable
4z90G-3rmsA:
undetectable
4z90H-3rmsA:
undetectable
4z90J-3rmsA:
undetectable
4z90F-3rmsA:
16.29
4z90G-3rmsA:
16.29
4z90H-3rmsA:
16.29
4z90J-3rmsA:
16.29
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.
3rv6 ISOCHORISMATE
SYNTHASE/ISOCHORISMA
TE-PYRUVATE LYASE
MBTI


(Mycobacterium
tuberculosis)
PF00425
(Chorismate_bind)
5 LEU A 398
ALA A 400
LEU A 353
ALA A 132
LEU A 392
None
1.04A 4z90F-3rv6A:
undetectable
4z90G-3rv6A:
undetectable
4z90H-3rv6A:
undetectable
4z90J-3rv6A:
undetectable
4z90F-3rv6A:
22.54
4z90G-3rv6A:
22.54
4z90H-3rv6A:
22.54
4z90J-3rv6A:
22.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tdf DIHYDRODIPICOLINATE
SYNTHASE


(Acinetobacter
baumannii)
PF00701
(DHDPS)
5 LEU A 102
LEU A 130
ALA A 123
ALA A 125
ALA A  85
None
1.35A 4z90F-3tdfA:
undetectable
4z90G-3tdfA:
undetectable
4z90H-3tdfA:
undetectable
4z90J-3tdfA:
undetectable
4z90F-3tdfA:
20.93
4z90G-3tdfA:
20.93
4z90H-3tdfA:
20.93
4z90J-3tdfA:
20.93
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.
3tma METHYLTRANSFERASE

(Thermus
thermophilus)
PF01170
(UPF0020)
PF02926
(THUMP)
5 LEU A  75
ALA A  78
LEU A 146
ALA A  62
LEU A  66
None
1.26A 4z90F-3tmaA:
undetectable
4z90G-3tmaA:
undetectable
4z90H-3tmaA:
undetectable
4z90J-3tmaA:
undetectable
4z90F-3tmaA:
21.52
4z90G-3tmaA:
21.52
4z90H-3tmaA:
21.52
4z90J-3tmaA:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tx1 UDP-N-ACETYLENOLPYRU
VOYLGLUCOSAMINE
REDUCTASE


(Listeria
monocytogenes)
PF01565
(FAD_binding_4)
PF02873
(MurB_C)
4 LEU A 188
ALA A  95
LEU A 116
ALA A 108
None
0.64A 4z90F-3tx1A:
undetectable
4z90G-3tx1A:
undetectable
4z90H-3tx1A:
undetectable
4z90J-3tx1A:
undetectable
4z90F-3tx1A:
19.94
4z90G-3tx1A:
19.94
4z90H-3tx1A:
19.94
4z90J-3tx1A:
19.94
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.
3va9 SENSOR HISTIDINE
KINASE


(Rhodopseudomonas
palustris)
PF05227
(CHASE3)
4 LEU A  99
ALA A  52
LEU A 103
ALA A 167
None
0.62A 4z90F-3va9A:
6.1
4z90G-3va9A:
7.5
4z90H-3va9A:
7.2
4z90J-3va9A:
7.6
4z90F-3va9A:
19.25
4z90G-3va9A:
19.25
4z90H-3va9A:
19.25
4z90J-3va9A:
19.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3va9 SENSOR HISTIDINE
KINASE


(Rhodopseudomonas
palustris)
PF05227
(CHASE3)
4 LEU A 103
ALA A 167
LEU A  99
ALA A  52
None
0.62A 4z90F-3va9A:
6.1
4z90G-3va9A:
7.5
4z90H-3va9A:
7.2
4z90J-3va9A:
7.6
4z90F-3va9A:
19.25
4z90G-3va9A:
19.25
4z90H-3va9A:
19.25
4z90J-3va9A:
19.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vkg DYNEIN HEAVY CHAIN,
CYTOPLASMIC


(Dictyostelium
discoideum)
PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9)
5 LEU A3855
LEU A3834
ALA A3837
ALA A3841
LEU A3567
None
1.32A 4z90F-3vkgA:
undetectable
4z90G-3vkgA:
undetectable
4z90H-3vkgA:
undetectable
4z90J-3vkgA:
undetectable
4z90F-3vkgA:
6.73
4z90G-3vkgA:
6.73
4z90H-3vkgA:
6.73
4z90J-3vkgA:
6.73
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.
3wcx SPHINGOMYELINASE C

(Streptomyces
griseocarneus)
PF03372
(Exo_endo_phos)
5 ALA A  79
ALA A  75
ALA A 101
LEU A 146
ALA A 108
None
1.06A 4z90F-3wcxA:
undetectable
4z90G-3wcxA:
undetectable
4z90H-3wcxA:
undetectable
4z90J-3wcxA:
undetectable
4z90F-3wcxA:
22.59
4z90G-3wcxA:
22.59
4z90H-3wcxA:
22.59
4z90J-3wcxA:
22.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3x0v L-LYSINE OXIDASE

(Trichoderma
viride)
PF01593
(Amino_oxidase)
4 LEU A 296
LEU A 301
ALA A 458
LEU A 291
None
0.67A 4z90F-3x0vA:
undetectable
4z90G-3x0vA:
undetectable
4z90H-3x0vA:
undetectable
4z90J-3x0vA:
undetectable
4z90F-3x0vA:
21.60
4z90G-3x0vA:
21.60
4z90H-3x0vA:
21.60
4z90J-3x0vA:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zpj TON_1535

(Thermococcus
onnurineus)
no annotation 4 LEU A 248
LEU A 290
LEU A 244
ALA A 269
None
0.60A 4z90F-3zpjA:
undetectable
4z90G-3zpjA:
2.6
4z90H-3zpjA:
1.6
4z90J-3zpjA:
1.5
4z90F-3zpjA:
21.61
4z90G-3zpjA:
21.61
4z90H-3zpjA:
21.61
4z90J-3zpjA:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ays AMYLOSUCRASE

(Deinococcus
radiodurans)
PF00128
(Alpha-amylase)
4 LEU A 452
ALA A 494
LEU A 468
LEU A 456
None
0.67A 4z90F-4aysA:
undetectable
4z90G-4aysA:
undetectable
4z90H-4aysA:
undetectable
4z90J-4aysA:
undetectable
4z90F-4aysA:
18.88
4z90G-4aysA:
18.88
4z90H-4aysA:
18.88
4z90J-4aysA:
18.88
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.
4b45 CELL DIVISION
PROTEIN FTSZ


(Haloferax
volcanii)
PF00091
(Tubulin)
5 LEU A 315
ALA A 223
LEU A 217
ALA A 159
LEU A 193
None
1.19A 4z90F-4b45A:
undetectable
4z90G-4b45A:
undetectable
4z90H-4b45A:
undetectable
4z90J-4b45A:
undetectable
4z90F-4b45A:
22.52
4z90G-4b45A:
22.52
4z90H-4b45A:
22.52
4z90J-4b45A:
22.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bt1 TRANSCRIPTIONAL
REGULATOR


(Escherichia
virus Mu)
no annotation 4 LEU A 380
LEU A 347
ALA A 321
ALA A 366
None
0.66A 4z90F-4bt1A:
undetectable
4z90G-4bt1A:
undetectable
4z90H-4bt1A:
undetectable
4z90J-4bt1A:
undetectable
4z90F-4bt1A:
12.85
4z90G-4bt1A:
12.85
4z90H-4bt1A:
12.85
4z90J-4bt1A:
12.85
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.
4g25 PENTATRICOPEPTIDE
REPEAT-CONTAINING
PROTEIN AT2G32230,
MITOCHONDRIAL


(Arabidopsis
thaliana)
PF16953
(PRORP)
PF17177
(PPR_long)
5 LEU A 100
LEU A 104
ALA A 116
LEU A 130
ALA A 123
None
1.01A 4z90F-4g25A:
2.9
4z90G-4g25A:
3.0
4z90H-4g25A:
3.0
4z90J-4g25A:
2.9
4z90F-4g25A:
19.77
4z90G-4g25A:
19.77
4z90H-4g25A:
19.77
4z90J-4g25A:
19.77