SIMILAR PATTERNS OF AMINO ACIDS FOR 5DZK_Y_BEZY801_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.
1a40 PHOSPHATE-BINDING
PERIPLASMIC PROTEIN
PRECURSOR

(Escherichia
coli) 		PF12849
(PBP_like_2) 		4 ILE A 260
GLY A  68
ILE A 312
LEU A  69
 None
 0.85A 5dzkd-1a40A:
undetectable
5dzkk-1a40A:
undetectable
5dzky-1a40A:
undetectable		 5dzkd-1a40A:
20.94
5dzkk-1a40A:
20.12
5dzky-1a40A:
0.31
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.
1att ANTITHROMBIN III

(Bos taurus) 		PF00079
(Serpin) 		4 PHE A 176
GLY A 149
ILE A 208
LEU A 214
 None
 0.85A 5dzkd-1attA:
undetectable
5dzkk-1attA:
undetectable
5dzky-1attA:
undetectable		 5dzkd-1attA:
17.51
5dzkk-1attA:
19.91
5dzky-1attA:
0.64
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.
1bu2 CYCLIN HOMOLOG

(Saimiriine
gammaherpesvirus
2) 		PF00134
(Cyclin_N)
PF09241
(Herp-Cyclin) 		4 ILE A  79
GLY A  98
ILE A 104
LEU A  80
 None
 0.82A 5dzkd-1bu2A:
undetectable
5dzkk-1bu2A:
0.0
5dzky-1bu2A:
undetectable		 5dzkd-1bu2A:
20.39
5dzkk-1bu2A:
23.27
5dzky-1bu2A:
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.
1ebv PROSTAGLANDIN H2
SYNTHASE

(Ovis aries) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		4 PHE A 470
ILE A 124
GLY A 526
ILE A 151
 None
None
SCL  A 700 ( 4.0A)
None
 0.92A 5dzkd-1ebvA:
undetectable
5dzkk-1ebvA:
undetectable
5dzky-1ebvA:
undetectable		 5dzkd-1ebvA:
17.11
5dzkk-1ebvA:
16.57
5dzky-1ebvA:
3.28
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.
1i2o TRANSALDOLASE B

(Escherichia
coli) 		PF00923
(TAL_FSA) 		4 ILE A 233
GLY A 224
ILE A 244
LEU A 236
 None
 0.81A 5dzkd-1i2oA:
2.5
5dzkk-1i2oA:
0.0
5dzky-1i2oA:
undetectable		 5dzkd-1i2oA:
22.88
5dzkk-1i2oA:
21.38
5dzky-1i2oA:
0.63
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.
1isc IRON(III) SUPEROXIDE
DISMUTASE

(Escherichia
coli) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 ILE A  42
GLY A  62
ILE A  55
LEU A  41
 None
 0.91A 5dzkd-1iscA:
undetectable
5dzkk-1iscA:
undetectable
5dzky-1iscA:
undetectable		 5dzkd-1iscA:
22.46
5dzkk-1iscA:
19.63
5dzky-1iscA:
1.31
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.
1j3j BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE

(Plasmodium
falciparum) 		PF00303
(Thymidylat_synt) 		4 PHE C 312
ILE C 557
ILE C 307
LEU C 560
 None
 0.83A 5dzkd-1j3jC:
0.0
5dzkk-1j3jC:
0.0
5dzky-1j3jC:
undetectable		 5dzkd-1j3jC:
21.10
5dzkk-1j3jC:
19.94
5dzky-1j3jC:
2.25
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.
1kkh MEVALONATE KINASE

(Methanocaldococcus
jannaschii) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		5 PHE A 100
ILE A  67
GLY A  99
ILE A  85
LEU A  64
 None
 1.39A 5dzkd-1kkhA:
undetectable
5dzkk-1kkhA:
0.4
5dzky-1kkhA:
undetectable		 5dzkd-1kkhA:
19.09
5dzkk-1kkhA:
22.33
5dzky-1kkhA:
0.79
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.
1l1f GLUTAMATE
DEHYDROGENASE 1

(Homo sapiens) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		4 PHE A  67
ILE A 135
GLY A  81
ILE A 148
 None
 0.84A 5dzkd-1l1fA:
2.9
5dzkk-1l1fA:
0.2
5dzky-1l1fA:
undetectable		 5dzkd-1l1fA:
19.51
5dzkk-1l1fA:
19.56
5dzky-1l1fA:
0.48
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.
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococcus
jannaschii) 		PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon)
PF09181
(ProRS-C_2) 		4 ILE A 261
GLY A 332
ILE A  10
LEU A 272
 None
 0.92A 5dzkd-1nj8A:
undetectable
5dzkk-1nj8A:
undetectable
5dzky-1nj8A:
undetectable		 5dzkd-1nj8A:
21.05
5dzkk-1nj8A:
18.34
5dzky-1nj8A:
3.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1oj4 4-DIPHOSPHOCYTIDYL-2
-C-METHYL-D-ERYTHRIT
OL KINASE

(Escherichia
coli) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		4 ILE A  67
GLY A 107
ILE A  94
LEU A  66
 ANP  A1285 ( 4.9A)
ANP  A1285 (-3.2A)
None
ANP  A1285 (-4.0A)
 0.80A 5dzkd-1oj4A:
undetectable
5dzkk-1oj4A:
undetectable
5dzky-1oj4A:
undetectable		 5dzkd-1oj4A:
22.03
5dzkk-1oj4A:
21.23
5dzky-1oj4A:
0.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pp0 VOLVATOXIN A2

(Volvariella
volvacea) 		PF01338
(Bac_thur_toxin) 		4 ILE A 103
GLY A  76
ILE A  82
LEU A 104
 None
 0.72A 5dzkd-1pp0A:
undetectable
5dzkk-1pp0A:
undetectable
5dzky-1pp0A:
undetectable		 5dzkd-1pp0A:
21.21
5dzkk-1pp0A:
19.63
5dzky-1pp0A:
2.33
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.
1pxy FIMBRIN-LIKE PROTEIN

(Arabidopsis
thaliana) 		PF00307
(CH) 		4 ILE A 170
GLY A 163
ILE A 178
LEU A 166
 None
 0.93A 5dzkd-1pxyA:
undetectable
5dzkk-1pxyA:
undetectable
5dzky-1pxyA:
undetectable		 5dzkd-1pxyA:
16.63
5dzkk-1pxyA:
18.31
5dzky-1pxyA:
4.08
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.
1rt8 FIMBRIN

(Schizosaccharomyces
pombe) 		PF00307
(CH) 		4 ILE A 159
GLY A 152
ILE A 167
LEU A 155
 None
 0.86A 5dzkd-1rt8A:
undetectable
5dzkk-1rt8A:
undetectable
5dzky-1rt8A:
undetectable		 5dzkd-1rt8A:
18.54
5dzkk-1rt8A:
17.60
5dzky-1rt8A:
1.50
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.
1ucv EPHRIN TYPE-A
RECEPTOR 8

(Homo sapiens) 		PF00536
(SAM_1) 		4 ILE A  50
GLY A  54
ILE A  59
LEU A  52
 None
 0.87A 5dzkd-1ucvA:
undetectable
5dzkk-1ucvA:
undetectable
5dzky-1ucvA:
undetectable		 5dzkd-1ucvA:
15.81
5dzkk-1ucvA:
21.74
5dzky-1ucvA:
14.29
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.
1uer SUPEROXIDE DISMUTASE

(Porphyromonas
gingivalis) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 ILE A  43
GLY A  63
ILE A  56
LEU A  42
 None
 0.93A 5dzkd-1uerA:
undetectable
5dzkk-1uerA:
undetectable
5dzky-1uerA:
undetectable		 5dzkd-1uerA:
22.84
5dzkk-1uerA:
19.16
5dzky-1uerA:
1.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xc3 PUTATIVE
FRUCTOKINASE

(Bacillus
subtilis) 		PF00480
(ROK) 		4 PHE A 175
ILE A 128
GLY A 152
ILE A 209
 None
 0.85A 5dzkd-1xc3A:
undetectable
5dzkk-1xc3A:
undetectable
5dzky-1xc3A:
undetectable		 5dzkd-1xc3A:
21.00
5dzkk-1xc3A:
20.79
5dzky-1xc3A:
1.37
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.
1xr6 GENOME POLYPROTEIN

(Rhinovirus A) 		PF00680
(RdRP_1) 		4 PHE A 377
ILE A 330
GLY A 376
ILE A 221
 None
 0.87A 5dzkd-1xr6A:
undetectable
5dzkk-1xr6A:
undetectable
5dzky-1xr6A:
undetectable		 5dzkd-1xr6A:
18.65
5dzkk-1xr6A:
18.87
5dzky-1xr6A:
0.44
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.
1ysj PROTEIN YXEP

(Bacillus
subtilis) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 PHE A 300
ILE A  68
GLY A 336
ILE A 379
 None
 0.58A 5dzkd-1ysjA:
undetectable
5dzkk-1ysjA:
undetectable
5dzky-1ysjA:
undetectable		 5dzkd-1ysjA:
20.79
5dzkk-1ysjA:
21.99
5dzky-1ysjA:
1.45
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.
1zhg BETA
HYDROXYACYL-ACYL
CARRIER PROTEIN
DEHYDRATASE

(Plasmodium
falciparum) 		PF07977
(FabA) 		4 PHE A 171
ILE A 221
GLY A 173
ILE A 146
 None
 0.88A 5dzkd-1zhgA:
undetectable
5dzkk-1zhgA:
undetectable
5dzky-1zhgA:
undetectable		 5dzkd-1zhgA:
25.82
5dzkk-1zhgA:
20.32
5dzky-1zhgA:
14.29
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.
2afh NITROGENASE
MOLYBDENUM-IRON
PROTEIN

(Azotobacter
vinelandii) 		PF00148
(Oxidored_nitro)
PF11844
(DUF3364) 		4 PHE B 375
ILE B 443
GLY B 371
ILE B 469
 None
 0.80A 5dzkd-2afhB:
undetectable
5dzkk-2afhB:
undetectable
5dzky-2afhB:
undetectable		 5dzkd-2afhB:
16.70
5dzkk-2afhB:
16.54
5dzky-2afhB:
0.79
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.
2e1d TRANSALDOLASE

(Mus musculus) 		PF00923
(TAL_FSA) 		4 ILE A 244
GLY A 235
ILE A 255
LEU A 247
 None
 0.82A 5dzkd-2e1dA:
undetectable
5dzkk-2e1dA:
undetectable
5dzky-2e1dA:
undetectable		 5dzkd-2e1dA:
21.25
5dzkk-2e1dA:
20.59
5dzky-2e1dA:
0.78
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.
2eao EPHRIN TYPE-B
RECEPTOR 1

(Homo sapiens) 		PF00536
(SAM_1) 		4 ILE A  65
GLY A  69
ILE A  74
LEU A  67
 None
 0.92A 5dzkd-2eaoA:
undetectable
5dzkk-2eaoA:
undetectable
5dzky-2eaoA:
undetectable		 5dzkd-2eaoA:
18.96
5dzkk-2eaoA:
18.59
5dzky-2eaoA:
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.
2gdz NAD+-DEPENDENT
15-HYDROXYPROSTAGLAN
DIN DEHYDROGENASE

(Homo sapiens) 		PF00106
(adh_short) 		4 ILE A 219
GLY A 184
ILE A 214
LEU A 220
 None
 0.90A 5dzkd-2gdzA:
undetectable
5dzkk-2gdzA:
undetectable
5dzky-2gdzA:
undetectable		 5dzkd-2gdzA:
24.03
5dzkk-2gdzA:
21.07
5dzky-2gdzA:
7.14
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.
2hpv FMN-DEPENDENT
NADH-AZOREDUCTASE

(Enterococcus
faecalis) 		PF02525
(Flavodoxin_2) 		4 ILE A 100
GLY A 177
ILE A 163
LEU A 144
 None
 0.84A 5dzkd-2hpvA:
1.4
5dzkk-2hpvA:
undetectable
5dzky-2hpvA:
undetectable		 5dzkd-2hpvA:
22.18
5dzkk-2hpvA:
24.35
5dzky-2hpvA:
40.00
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.
2hzs RNA POLYMERASE II
MEDIATOR COMPLEX
SUBUNIT 20
RNA POLYMERASE II
MEDIATOR COMPLEX
SUBUNIT 18

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF08612
(Med20)
PF09637
(Med18) 		4 ILE A 115
GLY B 206
ILE A  46
LEU B 207
 None
 0.89A 5dzkd-2hzsA:
undetectable
5dzkk-2hzsA:
undetectable
5dzky-2hzsA:
undetectable		 5dzkd-2hzsA:
24.80
5dzkk-2hzsA:
22.61
5dzky-2hzsA:
0.96
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.
2i5b PHOSPHOMETHYLPYRIMID
INE KINASE

(Bacillus
subtilis) 		PF08543
(Phos_pyr_kin) 		4 ILE A  62
GLY A  11
ILE A  88
LEU A  38
 None
 0.74A 5dzkd-2i5bA:
3.1
5dzkk-2i5bA:
1.8
5dzky-2i5bA:
undetectable		 5dzkd-2i5bA:
23.16
5dzkk-2i5bA:
21.69
5dzky-2i5bA:
1.35
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.
2inv INSULIN
FRUCTOTRANSFERASE

(Bacillus sp.
snu-7) 		no annotation 4 PHE A 220
ILE A 215
GLY A 219
ILE A 204
 None
 0.93A 5dzkd-2invA:
2.2
5dzkk-2invA:
undetectable
5dzky-2invA:
undetectable		 5dzkd-2invA:
21.98
5dzkk-2invA:
19.26
5dzky-2invA:
0.85
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.
2jg5 FRUCTOSE 1-PHOSPHATE
KINASE

(Staphylococcus
aureus) 		PF00294
(PfkB) 		4 PHE A  80
ILE A  40
GLY A  57
ILE A  67
 None
 0.84A 5dzkd-2jg5A:
2.0
5dzkk-2jg5A:
undetectable
5dzky-2jg5A:
undetectable		 5dzkd-2jg5A:
22.22
5dzkk-2jg5A:
19.61
5dzky-2jg5A:
0.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pfz PUTATIVE EXPORTED
PROTEIN

(Bordetella
pertussis) 		PF03480
(DctP) 		4 PHE A  23
ILE A  62
GLY A 233
ILE A  37
 None
 0.83A 5dzkd-2pfzA:
undetectable
5dzkk-2pfzA:
undetectable
5dzky-2pfzA:
undetectable		 5dzkd-2pfzA:
20.82
5dzkk-2pfzA:
21.04
5dzky-2pfzA:
3.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qvl DIACYLGLYCEROL
KINASE DGKB

(Staphylococcus
aureus) 		PF00781
(DAGK_cat) 		4 ILE A 223
GLY A 139
ILE A 180
LEU A 193
 None
 0.65A 5dzkd-2qvlA:
undetectable
5dzkk-2qvlA:
undetectable
5dzky-2qvlA:
undetectable		 5dzkd-2qvlA:
21.53
5dzkk-2qvlA:
21.41
5dzky-2qvlA:
0.93
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.
2rin PUTATIVE GLYCINE
BETAINE-BINDING ABC
TRANSPORTER PROTEIN

(Sinorhizobium
meliloti) 		PF04069
(OpuAC) 		4 ILE A 293
GLY A 308
ILE A  56
LEU A 309
 None
 0.90A 5dzkd-2rinA:
undetectable
5dzkk-2rinA:
undetectable
5dzky-2rinA:
undetectable		 5dzkd-2rinA:
19.93
5dzkk-2rinA:
20.21
5dzky-2rinA:
0.88
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.
2vdc GLUTAMATE SYNTHASE
[NADPH] LARGE CHAIN

(Azospirillum
brasilense) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		4 PHE A 498
ILE A 754
GLY A 494
ILE A 749
 None
 0.86A 5dzkd-2vdcA:
2.3
5dzkk-2vdcA:
1.0
5dzky-2vdcA:
undetectable		 5dzkd-2vdcA:
9.76
5dzkk-2vdcA:
8.34
5dzky-2vdcA:
0.14
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.
2vvq RIBOSE-5-PHOSPHATE
ISOMERASE B

(Mycobacterium
tuberculosis) 		PF02502
(LacAB_rpiB) 		4 ILE A 108
GLY A  72
ILE A  66
LEU A  89
 None
R10  A 200 (-3.4A)
None
None
 0.93A 5dzkd-2vvqA:
undetectable
5dzkk-2vvqA:
undetectable
5dzky-2vvqA:
undetectable		 5dzkd-2vvqA:
24.77
5dzkk-2vvqA:
25.96
5dzky-2vvqA:
5.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xkk TOPOISOMERASE IV

(Acinetobacter
baumannii) 		PF00521
(DNA_topoisoIV)
PF00986
(DNA_gyraseB_C)
PF01751
(Toprim) 		4 ILE A1200
GLY A1195
ILE A1466
LEU A1199
 None
 0.80A 5dzkd-2xkkA:
undetectable
5dzkk-2xkkA:
undetectable
5dzky-2xkkA:
undetectable		 5dzkd-2xkkA:
17.06
5dzkk-2xkkA:
14.91
5dzky-2xkkA:
1.49
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.
3any ETHANOLAMINE
AMMONIA-LYASE HEAVY
CHAIN

(Escherichia
coli) 		PF06751
(EutB) 		4 ILE A 244
GLY A 222
ILE A 235
LEU A 243
 None
 0.88A 5dzkd-3anyA:
1.5
5dzkk-3anyA:
undetectable
5dzky-3anyA:
undetectable		 5dzkd-3anyA:
19.69
5dzkk-3anyA:
19.02
5dzky-3anyA:
0.52
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.
3c7t ECDYSTEROID-PHOSPHAT
E PHOSPHATASE

(Bombyx mori) 		PF00300
(His_Phos_1) 		4 PHE A 233
GLY A 237
ILE A 262
LEU A 186
 None
None
CL  A 332 ( 4.3A)
None
 0.93A 5dzkd-3c7tA:
undetectable
5dzkk-3c7tA:
undetectable
5dzky-3c7tA:
undetectable		 5dzkd-3c7tA:
20.94
5dzkk-3c7tA:
19.62
5dzky-3c7tA:
0.90
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.
3cj8 2,3,4,5-TETRAHYDROPY
RIDINE-2,6-DICARBOXY
LATE
N-ACETYLTRANSFERASE

(Enterococcus
faecalis) 		PF00132
(Hexapep)
PF08503
(DapH_N)
PF14602
(Hexapep_2) 		4 ILE A  97
GLY A  94
ILE A  91
LEU A  96
 None
 0.88A 5dzkd-3cj8A:
undetectable
5dzkk-3cj8A:
undetectable
5dzky-3cj8A:
undetectable		 5dzkd-3cj8A:
24.90
5dzkk-3cj8A:
24.18
5dzky-3cj8A:
0.85
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.
3eqn GLUCAN
1,3-BETA-GLUCOSIDASE

(Phanerochaete
chrysosporium) 		PF12708
(Pectate_lyase_3) 		4 ILE A 502
GLY A 592
ILE A 526
LEU A 554
 None
 0.71A 5dzkd-3eqnA:
undetectable
5dzkk-3eqnA:
undetectable
5dzky-3eqnA:
undetectable		 5dzkd-3eqnA:
13.53
5dzkk-3eqnA:
13.33
5dzky-3eqnA:
1.60
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.
3gs6 BETA-HEXOSAMINIDASE

(Vibrio cholerae) 		PF00933
(Glyco_hydro_3) 		4 ILE A  59
GLY A  27
ILE A  49
LEU A  58
 None
 0.93A 5dzkd-3gs6A:
2.8
5dzkk-3gs6A:
undetectable
5dzky-3gs6A:
undetectable		 5dzkd-3gs6A:
20.47
5dzkk-3gs6A:
22.49
5dzky-3gs6A:
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.
3h6e CARBOHYDRATE KINASE,
FGGY

(Novosphingobium
aromaticivorans) 		PF00370
(FGGY_N) 		4 ILE A  70
GLY A 228
ILE A   9
LEU A 226
 None
 0.92A 5dzkd-3h6eA:
undetectable
5dzkk-3h6eA:
undetectable
5dzky-3h6eA:
undetectable		 5dzkd-3h6eA:
18.99
5dzkk-3h6eA:
18.57
5dzky-3h6eA:
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.
3hfi PUTATIVE REGULATOR

(Escherichia
coli) 		PF07702
(UTRA) 		4 ILE A  95
GLY A  80
ILE A  73
LEU A  98
 None
 0.77A 5dzkd-3hfiA:
undetectable
5dzkk-3hfiA:
undetectable
5dzky-3hfiA:
undetectable		 5dzkd-3hfiA:
22.12
5dzkk-3hfiA:
24.42
5dzky-3hfiA:
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.
3mog PROBABLE
3-HYDROXYBUTYRYL-COA
DEHYDROGENASE

(Escherichia
coli) 		PF00725
(3HCDH)
PF02737
(3HCDH_N) 		4 ILE A 354
GLY A 294
ILE A 369
LEU A 380
 None
 0.93A 5dzkd-3mogA:
undetectable
5dzkk-3mogA:
undetectable
5dzky-3mogA:
undetectable		 5dzkd-3mogA:
19.58
5dzkk-3mogA:
21.38
5dzky-3mogA:
6.06
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.
3mw4 NEUREXIN-2-BETA

(Mus musculus) 		PF02210
(Laminin_G_2) 		4 PHE A  87
ILE A 249
GLY A 214
LEU A  93
 None
 0.78A 5dzkd-3mw4A:
undetectable
5dzkk-3mw4A:
undetectable
5dzky-3mw4A:
undetectable		 5dzkd-3mw4A:
20.52
5dzkk-3mw4A:
23.08
5dzky-3mw4A:
0.56
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.
3ne7 ACETYLTRANSFERASE

(Thermoplasma
acidophilum) 		PF00583
(Acetyltransf_1) 		4 ILE A  75
GLY A  67
ILE A 103
LEU A  74
 None
None
COA  A 161 (-4.9A)
None
 0.91A 5dzkd-3ne7A:
undetectable
5dzkk-3ne7A:
undetectable
5dzky-3ne7A:
undetectable		 5dzkd-3ne7A:
19.72
5dzkk-3ne7A:
21.63
5dzky-3ne7A:
3.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o8q SHIKIMATE
5-DEHYDROGENASE I
ALPHA

(Vibrio cholerae) 		PF01488
(Shikimate_DH)
PF08501
(Shikimate_dh_N) 		4 ILE B 266
GLY B 243
ILE B  23
LEU B 267
 None
 0.91A 5dzkd-3o8qB:
undetectable
5dzkk-3o8qB:
undetectable
5dzky-3o8qB:
undetectable		 5dzkd-3o8qB:
20.43
5dzkk-3o8qB:
21.20
5dzky-3o8qB:
0.73
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.
3of5 DETHIOBIOTIN
SYNTHETASE

(Francisella
tularensis) 		PF13500
(AAA_26) 		4 ILE A 172
GLY A   8
ILE A  18
LEU A 142
 None
 0.64A 5dzkd-3of5A:
undetectable
5dzkk-3of5A:
1.3
5dzky-3of5A:
undetectable		 5dzkd-3of5A:
20.51
5dzkk-3of5A:
20.75
5dzky-3of5A:
1.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pn1 DNA LIGASE

(Haemophilus
influenzae) 		PF01653
(DNA_ligase_aden) 		4 PHE A 111
ILE A  98
GLY A 263
ILE A 292
 None
 0.92A 5dzkd-3pn1A:
undetectable
5dzkk-3pn1A:
undetectable
5dzky-3pn1A:
undetectable		 5dzkd-3pn1A:
22.60
5dzkk-3pn1A:
22.67
5dzky-3pn1A:
1.90
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.
3sun DNA POLYMERASE

(Escherichia
virus RB69) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		5 PHE A 701
ILE A 727
GLY A 700
ILE A 749
LEU A 710
 None
 1.43A 5dzkd-3sunA:
undetectable
5dzkk-3sunA:
undetectable
5dzky-3sunA:
undetectable		 5dzkd-3sunA:
13.39
5dzkk-3sunA:
13.16
5dzky-3sunA:
1.32
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.
3tm5 CRYSTAL STRUCTURE OF
TRM14

(Pyrococcus
furiosus) 		PF01170
(UPF0020)
PF02926
(THUMP) 		4 ILE A 291
GLY A 246
ILE A 231
LEU A 222
 None
 0.81A 5dzkd-3tm5A:
undetectable
5dzkk-3tm5A:
undetectable
5dzky-3tm5A:
undetectable		 5dzkd-3tm5A:
20.47
5dzkk-3tm5A:
21.76
5dzky-3tm5A:
40.00
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.
3tqj SUPEROXIDE DISMUTASE
[FE]

(Coxiella
burnetii) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 ILE A  43
GLY A  63
ILE A  56
LEU A  42
 None
 0.88A 5dzkd-3tqjA:
undetectable
5dzkk-3tqjA:
undetectable
5dzky-3tqjA:
undetectable		 5dzkd-3tqjA:
22.76
5dzkk-3tqjA:
20.61
5dzky-3tqjA:
2.15
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.
3tsy FUSION PROTEIN
4-COUMARATE--COA
LIGASE 1,
RESVERATROL SYNTHASE

(Arabidopsis
thaliana;
Vitis vinifera) 		PF00195
(Chal_sti_synt_N)
PF00501
(AMP-binding)
PF02797
(Chal_sti_synt_C)
PF13193
(AMP-binding_C) 		4 ILE A 680
GLY A 849
ILE A 670
LEU A 678
 None
 0.84A 5dzkd-3tsyA:
undetectable
5dzkk-3tsyA:
undetectable
5dzky-3tsyA:
undetectable		 5dzkd-3tsyA:
12.95
5dzkk-3tsyA:
13.31
5dzky-3tsyA:
1.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3txm 26S PROTEASOME
REGULATORY COMPLEX
SUBUNIT P42B

(Drosophila
melanogaster) 		PF01399
(PCI) 		4 PHE A 232
ILE A 318
ILE A 216
LEU A 256
 None
 0.92A 5dzkd-3txmA:
undetectable
5dzkk-3txmA:
undetectable
5dzky-3txmA:
undetectable		 5dzkd-3txmA:
20.25
5dzkk-3txmA:
19.18
5dzky-3txmA:
1.59
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.
3u02 PUTATIVE
TRANSCRIPTION-ASSOCI
ATED PROTEIN TFIIS

(Pyrococcus
furiosus) 		PF08489
(DUF1743) 		4 ILE A  64
GLY A 100
ILE A  69
LEU A   2
 None
 0.78A 5dzkd-3u02A:
undetectable
5dzkk-3u02A:
undetectable
5dzky-3u02A:
undetectable		 5dzkd-3u02A:
21.84
5dzkk-3u02A:
21.69
5dzky-3u02A:
1.44
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.
3um6 BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE

(Plasmodium
falciparum) 		PF00186
(DHFR_1)
PF00303
(Thymidylat_synt) 		4 PHE A 312
ILE A 557
ILE A 307
LEU A 560
 None
 0.87A 5dzkd-3um6A:
undetectable
5dzkk-3um6A:
undetectable
5dzky-3um6A:
undetectable		 5dzkd-3um6A:
13.32
5dzkk-3um6A:
14.89
5dzky-3um6A:
1.31
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.
3wxr PROTEASOME SUBUNIT
BETA TYPE-5

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome) 		4 ILE L  12
GLY L  43
ILE L 112
LEU L  42
 None
 0.78A 5dzkd-3wxrL:
undetectable
5dzkk-3wxrL:
undetectable
5dzky-3wxrL:
undetectable		 5dzkd-3wxrL:
22.96
5dzkk-3wxrL:
20.20
5dzky-3wxrL:
1.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wyh LYSOZYME G

(Struthio
camelus) 		PF01464
(SLT) 		4 ILE A  52
GLY A 109
ILE A  70
LEU A  51
 None
 0.89A 5dzkd-3wyhA:
undetectable
5dzkk-3wyhA:
undetectable
5dzky-3wyhA:
undetectable		 5dzkd-3wyhA:
21.83
5dzkk-3wyhA:
21.95
5dzky-3wyhA:
2.50
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.
4av6 K(+)-STIMULATED
PYROPHOSPHATE-ENERGI
ZED SODIUM PUMP

(Thermotoga
maritima) 		PF03030
(H_PPase) 		4 ILE A  64
GLY A 178
ILE A 185
LEU A  68
 None
 0.90A 5dzkd-4av6A:
undetectable
5dzkk-4av6A:
undetectable
5dzky-4av6A:
undetectable		 5dzkd-4av6A:
14.19
5dzkk-4av6A:
12.83
5dzky-4av6A:
2.60
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.
4b46 CELL DIVISION
PROTEIN FTSZ

(Haloferax
volcanii) 		PF00091
(Tubulin) 		4 ILE A 271
GLY A 342
ILE A 311
LEU A 274
 None
 0.92A 5dzkd-4b46A:
undetectable
5dzkk-4b46A:
undetectable
5dzky-4b46A:
undetectable		 5dzkd-4b46A:
20.00
5dzkk-4b46A:
21.58
5dzky-4b46A:
4.44
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.
4d2i HERA

(Sulfolobus
solfataricus) 		PF01935
(DUF87)
PF05872
(DUF853)
PF09378
(HAS-barrel) 		4 ILE A 331
GLY A 380
ILE A 350
LEU A 332
 None
 0.92A 5dzkd-4d2iA:
undetectable
5dzkk-4d2iA:
undetectable
5dzky-4d2iA:
undetectable		 5dzkd-4d2iA:
18.03
5dzkk-4d2iA:
17.59
5dzky-4d2iA:
3.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ei8 PLASMID REPLICATION
PROTEIN REPX

(Bacillus cereus) 		PF00091
(Tubulin) 		4 ILE A  74
GLY A  22
ILE A 101
LEU A  52
 None
 0.93A 5dzkd-4ei8A:
undetectable
5dzkk-4ei8A:
1.5
5dzky-4ei8A:
undetectable		 5dzkd-4ei8A:
19.23
5dzkk-4ei8A:
20.62
5dzky-4ei8A:
1.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lg8 PRE-MRNA-PROCESSING
FACTOR 19

(Homo sapiens) 		PF00400
(WD40) 		4 ILE A 459
GLY A 453
ILE A 490
LEU A 452
 None
 0.70A 5dzkd-4lg8A:
undetectable
5dzkk-4lg8A:
undetectable
5dzky-4lg8A:
undetectable		 5dzkd-4lg8A:
21.11
5dzkk-4lg8A:
20.50
5dzky-4lg8A:
0.56
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.
4lut ALANINE RACEMASE

(Clostridioides
difficile) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		4 ILE A 227
GLY A  36
ILE A 211
LEU A 228
 None
 0.90A 5dzkd-4lutA:
undetectable
5dzkk-4lutA:
undetectable
5dzky-4lutA:
undetectable		 5dzkd-4lutA:
22.36
5dzkk-4lutA:
22.22
5dzky-4lutA:
7.14
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.
4o1j CARBONIC ANHYDRASE

(Sordaria
macrospora) 		PF00484
(Pro_CA) 		4 ILE A  96
GLY A 159
ILE A 169
LEU A  98
 None
 0.81A 5dzkd-4o1jA:
undetectable
5dzkk-4o1jA:
undetectable
5dzky-4o1jA:
undetectable		 5dzkd-4o1jA:
22.76
5dzkk-4o1jA:
25.47
5dzky-4o1jA:
1.47
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.
4om8 3-HYDROXYBUTYRYL-COA
DEHYDROGENASE

(Mesorhizobium
japonicum) 		PF00725
(3HCDH)
PF02737
(3HCDH_N) 		4 ILE A 101
GLY A  74
ILE A   8
LEU A 104
 None
None
NAD  A 402 (-4.6A)
None
 0.83A 5dzkd-4om8A:
undetectable
5dzkk-4om8A:
undetectable
5dzky-4om8A:
undetectable		 5dzkd-4om8A:
23.45
5dzkk-4om8A:
20.19
5dzky-4om8A:
1.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pj3 INTRON-BINDING
PROTEIN AQUARIUS

(Homo sapiens) 		PF13086
(AAA_11)
PF13087
(AAA_12)
PF16399
(Aquarius_N) 		4 ILE A 565
GLY A 594
ILE A 485
LEU A 564
 None
 0.82A 5dzkd-4pj3A:
undetectable
5dzkk-4pj3A:
undetectable
5dzky-4pj3A:
undetectable		 5dzkd-4pj3A:
9.86
5dzkk-4pj3A:
8.86
5dzky-4pj3A:
4.08
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.
4q98 MAJOR FIMBRIAL
SUBUNIT PROTEIN

(Porphyromonas
gingivalis) 		PF06321
(P_gingi_FimA)
PF15495
(Fimbrillin_C) 		4 ILE A  39
GLY A 136
ILE A  56
LEU A 168
 None
 0.93A 5dzkd-4q98A:
undetectable
5dzkk-4q98A:
undetectable
5dzky-4q98A:
undetectable		 5dzkd-4q98A:
19.35
5dzkk-4q98A:
19.84
5dzky-4q98A:
0.75
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.
4qv9 PROTEASOME SUBUNIT
BETA TYPE-5

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome) 		4 ILE K  12
GLY K  43
ILE K 112
LEU K  42
 None
 0.75A 5dzkd-4qv9K:
undetectable
5dzkk-4qv9K:
undetectable
5dzky-4qv9K:
undetectable		 5dzkd-4qv9K:
22.40
5dzkk-4qv9K:
22.13
5dzky-4qv9K:
4.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4raa PUTATIVE EXPORTED
PROTEIN

(Bacteroides
fragilis) 		PF17170
(DUF5128) 		4 PHE A  34
GLY A 300
ILE A  32
LEU A 301
 None
 0.85A 5dzkd-4raaA:
undetectable
5dzkk-4raaA:
undetectable
5dzky-4raaA:
undetectable		 5dzkd-4raaA:
22.79
5dzkk-4raaA:
19.55
5dzky-4raaA:
3.70
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.
4rfq HISTIDINE PROTEIN
METHYLTRANSFERASE 1
HOMOLOG

(Homo sapiens) 		PF13489
(Methyltransf_23) 		4 PHE A 215
GLY A 199
ILE A 213
LEU A 201
 None
 0.88A 5dzkd-4rfqA:
undetectable
5dzkk-4rfqA:
undetectable
5dzky-4rfqA:
undetectable		 5dzkd-4rfqA:
21.36
5dzkk-4rfqA:
21.11
5dzky-4rfqA:
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.
4ttp DEPHOSPHO-COA KINASE

(Legionella
pneumophila) 		PF01121
(CoaE) 		4 ILE A  36
GLY A  12
ILE A 102
LEU A 115
 None
 0.71A 5dzkd-4ttpA:
undetectable
5dzkk-4ttpA:
undetectable
5dzky-4ttpA:
undetectable		 5dzkd-4ttpA:
22.69
5dzkk-4ttpA:
24.29
5dzky-4ttpA:
1.96
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.
4tx8 PROBABLE CHITINASE A

(Chromobacterium
violaceum) 		PF00704
(Glyco_hydro_18) 		4 ILE A 254
GLY A 249
ILE A 201
LEU A 252
 None
 0.91A 5dzkd-4tx8A:
2.3
5dzkk-4tx8A:
1.2
5dzky-4tx8A:
undetectable		 5dzkd-4tx8A:
17.65
5dzkk-4tx8A:
17.31
5dzky-4tx8A:
13.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4u0g ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 1

(Mycobacterium
tuberculosis;
Mycobacterium
tuberculosis) 		PF00574
(CLP_protease)
PF00574
(CLP_protease) 		4 PHE A 147
ILE H  71
GLY H 127
ILE H 146
 ZIL  H 301 ( 4.8A)
ZIL  H 301 (-3.6A)
ZIL  H 301 ( 3.5A)
ZIL  H 301 ( 3.3A)
 0.35A 5dzkd-4u0gA:
27.4
5dzkk-4u0gA:
31.4
5dzky-4u0gA:
undetectable		 5dzkd-4u0gA:
100.00
5dzkk-4u0gA:
41.58
5dzky-4u0gA:
1.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4up7 LYSINE--TRNA LIGASE

(Entamoeba
histolytica) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		4 PHE A 112
ILE A 104
GLY A 131
ILE A  73
 None
 0.91A 5dzkd-4up7A:
undetectable
5dzkk-4up7A:
undetectable
5dzky-4up7A:
undetectable		 5dzkd-4up7A:
14.94
5dzkk-4up7A:
14.03
5dzky-4up7A:
0.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xrl MITOGEN-ACTIVATED
PROTEIN KINASE 1

(Rattus
norvegicus) 		PF00069
(Pkinase) 		4 ILE A  70
GLY A  83
ILE A  87
LEU A  73
 None
 0.92A 5dzkd-4xrlA:
undetectable
5dzkk-4xrlA:
undetectable
5dzky-4xrlA:
undetectable		 5dzkd-4xrlA:
20.46
5dzkk-4xrlA:
22.10
5dzky-4xrlA:
3.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xxk PHYCOBILIPROTEIN
APCE

(Nostoc sp. PCC
7120) 		PF00502
(Phycobilisome) 		4 ILE A  56
GLY A  50
ILE A 225
LEU A  54
 None
 0.85A 5dzkd-4xxkA:
undetectable
5dzkk-4xxkA:
undetectable
5dzky-4xxkA:
undetectable		 5dzkd-4xxkA:
22.67
5dzkk-4xxkA:
24.10
5dzky-4xxkA:
5.56
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.
5a31 ANAPHASE-PROMOTING
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF12859
(ANAPC1) 		4 ILE A1414
GLY A1308
ILE A1383
LEU A1376
 None
 0.92A 5dzkd-5a31A:
undetectable
5dzkk-5a31A:
undetectable
5dzky-5a31A:
undetectable		 5dzkd-5a31A:
9.87
5dzkk-5a31A:
8.84
5dzky-5a31A:
2.54
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.
5a5t EUKARYOTIC
TRANSLATION
INITIATION FACTOR 3
SUBUNIT M

(Oryctolagus
cuniculus) 		PF01399
(PCI) 		4 ILE M 243
GLY M 234
ILE M 208
LEU M 241
 None
 0.76A 5dzkd-5a5tM:
1.5
5dzkk-5a5tM:
undetectable
5dzky-5a5tM:
undetectable		 5dzkd-5a5tM:
22.13
5dzkk-5a5tM:
21.97
5dzky-5a5tM:
2.82
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.
5b3r IMP-18

(Pseudomonas
aeruginosa) 		no annotation 4 ILE A  65
GLY A  90
ILE A 148
LEU A  64
 None
 0.93A 5dzkd-5b3rA:
undetectable
5dzkk-5b3rA:
undetectable
5dzky-5b3rA:
undetectable		 5dzkd-5b3rA:
20.88
5dzkk-5b3rA:
22.27
5dzky-5b3rA:
1.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5eeb ALDEHYDE
DEHYDROGENASE

(Pyrobaculum
ferrireducens) 		PF00171
(Aldedh) 		4 PHE A 434
ILE A 261
ILE A 425
LEU A 260
 None
 0.79A 5dzkd-5eebA:
undetectable
5dzkk-5eebA:
undetectable
5dzky-5eebA:
undetectable		 5dzkd-5eebA:
18.33
5dzkk-5eebA:
18.74
5dzky-5eebA:
0.56
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.
5gtm INTERFERON-INDUCED
GTP-BINDING PROTEIN
MX1

(Homo sapiens) 		PF00350
(Dynamin_N)
PF01031
(Dynamin_M)
PF02212
(GED) 		4 ILE A 243
GLY A 239
ILE A 212
LEU A 271
 None
 0.91A 5dzkd-5gtmA:
undetectable
5dzkk-5gtmA:
undetectable
5dzky-5gtmA:
undetectable		 5dzkd-5gtmA:
17.91
5dzkk-5gtmA:
16.72
5dzky-5gtmA:
0.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hql RIBULOSE
BISPHOSPHATE
CARBOXYLASE

(Rhodopseudomonas
palustris) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		4 PHE A 398
ILE A 191
GLY A 404
ILE A 166
 None
KCX  A 192 ( 3.8A)
None
KCX  A 192 ( 4.8A)
 0.84A 5dzkd-5hqlA:
2.4
5dzkk-5hqlA:
1.4
5dzky-5hqlA:
undetectable		 5dzkd-5hqlA:
19.52
5dzkk-5hqlA:
18.45
5dzky-5hqlA:
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.
5jse PHIAB6 TAILSPIKE

(unidentified
phage) 		PF12708
(Pectate_lyase_3) 		4 PHE A 231
ILE A 222
GLY A 205
ILE A 210
 None
 0.92A 5dzkd-5jseA:
undetectable
5dzkk-5jseA:
undetectable
5dzky-5jseA:
undetectable		 5dzkd-5jseA:
13.81
5dzkk-5jseA:
14.82
5dzky-5jseA:
0.40
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.
5k0y EUKARYOTIC
INITIATION FACTOR 2
GAMMA SUBUNIT
(EIF2-GAMMA)

(Oryctolagus
cuniculus) 		PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2)
PF09173
(eIF2_C) 		4 ILE S 198
GLY S  58
ILE S 190
LEU S 169
 None
 0.83A 5dzkd-5k0yS:
undetectable
5dzkk-5k0yS:
undetectable
5dzky-5k0yS:
undetectable		 5dzkd-5k0yS:
18.03
5dzkk-5k0yS:
19.26
5dzky-5k0yS:
1.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ly6 PNEUMOLYSIN

(Streptococcus
pneumoniae) 		PF01289
(Thiol_cytolysin)
PF17440
(Thiol_cytolys_C) 		4 ILE B 329
GLY B 326
ILE B 198
LEU B 327
 None
 0.79A 5dzkd-5ly6B:
undetectable
5dzkk-5ly6B:
undetectable
5dzky-5ly6B:
undetectable		 5dzkd-5ly6B:
19.70
5dzkk-5ly6B:
17.83
5dzky-5ly6B:
9.52
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.
5mpd 26S PROTEASOME
REGULATORY SUBUNIT
RPN2

(Saccharomyces
cerevisiae) 		PF01851
(PC_rep)
PF13646
(HEAT_2) 		4 PHE N 137
ILE N 165
GLY N 160
ILE N 141
 None
 0.85A 5dzkd-5mpdN:
undetectable
5dzkk-5mpdN:
undetectable
5dzky-5mpdN:
undetectable		 5dzkd-5mpdN:
12.32
5dzkk-5mpdN:
13.12
5dzky-5mpdN:
20.00
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.
5o7x RNA POLYMERASE
I-SPECIFIC
TRANSCRIPTION
INITIATION FACTOR
RRN11

(Saccharomyces
cerevisiae) 		PF04090
(RNA_pol_I_TF) 		5 PHE C 236
ILE C 247
GLY C 252
ILE C 240
LEU C 250
 None
 1.20A 5dzkd-5o7xC:
undetectable
5dzkk-5o7xC:
undetectable
5dzky-5o7xC:
undetectable		 5dzkd-5o7xC:
17.22
5dzkk-5o7xC:
16.60
5dzky-5o7xC:
1.12
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.
5swv PENTAFUNCTIONAL AROM
POLYPEPTIDE

(Schizosaccharomyces
pombe) 		PF01487
(DHquinase_I)
PF08501
(Shikimate_dh_N) 		4 ILE C1430
GLY C1417
ILE C1464
LEU C1433
 None
 0.86A 5dzkd-5swvC:
undetectable
5dzkk-5swvC:
1.7
5dzky-5swvC:
undetectable		 5dzkd-5swvC:
19.04
5dzkk-5swvC:
17.84
5dzky-5swvC:
2.94
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.
5te1 ATP-CITRATE SYNTHASE

(Homo sapiens) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding)
PF16114
(Citrate_bind) 		4 PHE A 697
GLY A 717
ILE A 687
LEU A 716
 None
 0.92A 5dzkd-5te1A:
3.1
5dzkk-5te1A:
undetectable
5dzky-5te1A:
undetectable		 5dzkd-5te1A:
15.28
5dzkk-5te1A:
14.20
5dzky-5te1A:
13.33
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.
5uhe DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA'

(Mycobacterium
tuberculosis) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		4 ILE D 832
GLY D 822
ILE D 851
LEU D 823
 None
None
88G  D1404 (-3.5A)
None
 0.89A 5dzkd-5uheD:
undetectable
5dzkk-5uheD:
undetectable
5dzky-5uheD:
undetectable		 5dzkd-5uheD:
10.36
5dzkk-5uheD:
9.99
5dzky-5uheD:
20.00
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.
5uvr PILO PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 4 PHE A 127
GLY A 122
ILE A 148
LEU A 121
 None
 0.80A 5dzkd-5uvrA:
undetectable
5dzkk-5uvrA:
undetectable
5dzky-5uvrA:
undetectable		 5dzkd-5uvrA:
undetectable
5dzkk-5uvrA:
undetectable
5dzky-5uvrA:
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.
5vto BLASTICIDIN M

(Streptomyces
griseochromogenes) 		no annotation 4 ILE A 106
GLY A 134
ILE A 116
LEU A 131
 None
 0.83A 5dzkd-5vtoA:
undetectable
5dzkk-5vtoA:
undetectable
5dzky-5vtoA:
undetectable		 5dzkd-5vtoA:
undetectable
5dzkk-5vtoA:
undetectable
5dzky-5vtoA:
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.
5w3w ARYLDIALKYLPHOSPHATA
SE

(Sulfolobus
solfataricus) 		no annotation 4 ILE A 167
GLY A 198
ILE A 138
LEU A 196
 None
None
KCX  A 137 ( 3.7A)
None
 0.93A 5dzkd-5w3wA:
2.3
5dzkk-5w3wA:
2.0
5dzky-5w3wA:
undetectable		 5dzkd-5w3wA:
undetectable
5dzkk-5w3wA:
undetectable
5dzky-5w3wA:
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.
5wy8 INTERLEUKIN-1
RECEPTOR ACCESSORY
PROTEIN-LIKE 1

(Homo sapiens) 		no annotation 4 ILE B 131
GLY B 114
ILE B  51
LEU B 115
 None
 0.86A 5dzkd-5wy8B:
undetectable
5dzkk-5wy8B:
undetectable
5dzky-5wy8B:
undetectable		 5dzkd-5wy8B:
undetectable
5dzkk-5wy8B:
undetectable
5dzky-5wy8B:
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.
5yl7 PSEUDOALTEROMONAS
ARCTICA PAMC 21717

(Pseudoalteromonas
arctica) 		no annotation 4 ILE A 438
GLY A 433
ILE A 450
LEU A 437
 None
 0.93A 5dzkd-5yl7A:
undetectable
5dzkk-5yl7A:
undetectable
5dzky-5yl7A:
undetectable		 5dzkd-5yl7A:
undetectable
5dzkk-5yl7A:
undetectable
5dzky-5yl7A:
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.
6bhv POLY [ADP-RIBOSE]
POLYMERASE 1

(Homo sapiens) 		no annotation 4 PHE A 897
GLY A 922
ILE A 895
LEU A 920
 None
 0.81A 5dzkd-6bhvA:
undetectable
5dzkk-6bhvA:
undetectable
5dzky-6bhvA:
undetectable		 5dzkd-6bhvA:
undetectable
5dzkk-6bhvA:
undetectable
5dzky-6bhvA:
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.
6cp0 -

(-) 		no annotation 4 PHE A 372
ILE A 354
GLY A 369
ILE A 403
 None
 0.78A 5dzkd-6cp0A:
undetectable
5dzkk-6cp0A:
undetectable
5dzky-6cp0A:
undetectable		 5dzkd-6cp0A:
undetectable
5dzkk-6cp0A:
undetectable
5dzky-6cp0A:
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.
6d6d -

(-) 		no annotation 4 ILE A  86
GLY A 113
ILE A  92
LEU A 114
 None
 0.83A 5dzkd-6d6dA:
undetectable
5dzkk-6d6dA:
undetectable
5dzky-6d6dA:
undetectable		 5dzkd-6d6dA:
undetectable
5dzkk-6d6dA:
undetectable
5dzky-6d6dA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6en4 SPLICING FACTOR 3B
SUBUNIT 3

(Homo sapiens) 		no annotation 4 ILE A 556
GLY A 561
ILE A 544
LEU A 563
 None
 0.93A 5dzkd-6en4A:
undetectable
5dzkk-6en4A:
undetectable
5dzky-6en4A:
undetectable		 5dzkd-6en4A:
undetectable
5dzkk-6en4A:
undetectable
5dzky-6en4A:
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.
6eu6 AMMONIUM TRANSPORTER

(Candidatus
Kuenenia
stuttgartiensis) 		no annotation 4 ILE A 257
GLY A 250
ILE A 304
LEU A 254
 None
 0.79A 5dzkd-6eu6A:
undetectable
5dzkk-6eu6A:
undetectable
5dzky-6eu6A:
undetectable		 5dzkd-6eu6A:
undetectable
5dzkk-6eu6A:
undetectable
5dzky-6eu6A:
undetectable