SIMILAR PATTERNS OF AMINO ACIDS FOR 4XI3_D_29SD601

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.
1ao5 GLANDULAR
KALLIKREIN-13

(Mus musculus) 		PF00089
(Trypsin) 		5 THR A 161
ALA A 183
LEU A 181
LEU A 199
PRO A 130
 None
 1.09A 4xi3D-1ao5A:
undetectable		 4xi3D-1ao5A:
21.15
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.
1g8k ARSENITE OXIDASE

(Alcaligenes
faecalis) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		5 THR A 179
ALA A 567
LEU A 565
TRP A 595
LEU A 574
 None
 0.99A 4xi3D-1g8kA:
undetectable		 4xi3D-1g8kA:
16.12
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.
1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE

(Staphylococcus
aureus) 		PF07827
(KNTase_C) 		5 ALA A 172
LEU A 176
LEU A 143
LEU A 208
PRO A 202
 None
 1.13A 4xi3D-1knyA:
undetectable		 4xi3D-1knyA:
17.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1pcg ESTROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		10 THR A 347
ALA A 350
GLU A 353
TRP A 383
LEU A 387
LEU A 391
ARG A 394
MET A 421
HIS A 524
LEU A 525
 None
EST  A   1 ( 3.7A)
EST  A   1 (-2.8A)
None
EST  A   1 (-4.0A)
EST  A   1 ( 3.9A)
EST  A   1 (-3.7A)
EST  A   1 ( 4.3A)
EST  A   1 (-3.8A)
EST  A   1 (-3.6A)
 0.79A 4xi3D-1pcgA:
32.0		 4xi3D-1pcgA:
97.93
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.
1qh4 CREATINE KINASE

(Gallus gallus) 		PF00217
(ATP-gua_Ptrans)
PF02807
(ATP-gua_PtransN) 		5 THR A 282
ALA A  76
LEU A  88
HIS A  97
LEU A 287
 None
 1.11A 4xi3D-1qh4A:
undetectable		 4xi3D-1qh4A:
20.61
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.
1qvr CLPB PROTEIN

(Thermus
thermophilus) 		PF00004
(AAA)
PF02861
(Clp_N)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small) 		5 THR A 119
ALA A 116
LEU A 128
LEU A 125
PRO A  57
 None
 1.24A 4xi3D-1qvrA:
undetectable		 4xi3D-1qvrA:
15.90
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.
1rii 2,3-BISPHOSPHOGLYCER
ATE-DEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Mycobacterium
tuberculosis) 		PF00300
(His_Phos_1) 		5 THR A  58
ALA A 182
LEU A 187
LEU A 190
LEU A 179
 None
 1.29A 4xi3D-1riiA:
undetectable		 4xi3D-1riiA:
22.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1uhl RETINOIC ACID
RECEPTOR RXR-BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 ALA A 343
TRP A 376
LEU A 380
ARG A 387
LEU A 507
 MEI  A1001 (-3.3A)
None
MEI  A1001 (-3.8A)
MEI  A1001 (-3.6A)
MEI  A1001 (-4.6A)
 0.84A 4xi3D-1uhlA:
22.8		 4xi3D-1uhlA:
30.92
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.
1vrp CREATINE KINASE, M
CHAIN

(Tetronarce
californica) 		PF00217
(ATP-gua_Ptrans)
PF02807
(ATP-gua_PtransN) 		5 THR A 282
ALA A  76
LEU A  88
HIS A  97
LEU A 287
 None
 1.14A 4xi3D-1vrpA:
undetectable		 4xi3D-1vrpA:
22.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xb7 STEROID HORMONE
RECEPTOR ERR1

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 GLU A 331
TRP A 361
LEU A 365
ARG A 372
HIS A 494
 None
 0.79A 4xi3D-1xb7A:
25.4		 4xi3D-1xb7A:
32.55
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.
1xiu RXR-LIKE PROTEIN

(Biomphalaria
glabrata) 		PF00104
(Hormone_recep) 		5 ALA A 246
TRP A 279
LEU A 283
ARG A 290
LEU A 410
 9CR  A 201 (-3.6A)
None
9CR  A 201 ( 4.1A)
9CR  A 201 (-2.8A)
9CR  A 201 ( 4.8A)
 0.97A 4xi3D-1xiuA:
22.6		 4xi3D-1xiuA:
29.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xls RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 ALA A 272
TRP A 305
LEU A 309
ARG A 316
LEU A 436
 9CR  A 801 (-3.5A)
None
9CR  A 801 (-4.2A)
9CR  A 801 (-2.6A)
9CR  A 801 (-4.7A)
 0.91A 4xi3D-1xlsA:
22.4		 4xi3D-1xlsA:
31.10
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.
2arz HYPOTHETICAL PROTEIN
PA4388

(Pseudomonas
aeruginosa) 		PF10615
(DUF2470)
PF13883
(Pyrid_oxidase_2) 		5 ALA A  89
GLU A  90
LEU A  88
HIS A  57
LEU A  21
 None
 1.21A 4xi3D-2arzA:
undetectable		 4xi3D-2arzA:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2chp METALLOREGULATION
DNA-BINDING STRESS
PROTEIN

(Bacillus
subtilis) 		PF00210
(Ferritin) 		5 THR A  60
ALA A  57
LEU A  53
LEU A  27
LEU A  26
 None
 1.27A 4xi3D-2chpA:
undetectable		 4xi3D-2chpA:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2efj 3,7-DIMETHYLXANTHINE
METHYLTRANSFERASE

(Coffea
canephora) 		PF03492
(Methyltransf_7) 		5 ALA A 376
GLU A 285
LEU A 375
LEU A 287
LEU A  42
 None
 1.27A 4xi3D-2efjA:
undetectable		 4xi3D-2efjA:
21.63
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.
2gah HETEROTETRAMERIC
SARCOSINE OXIDASE
ALPHA-SUBUNIT

(Stenotrophomonas
maltophilia) 		PF01571
(GCV_T)
PF07992
(Pyr_redox_2)
PF08669
(GCV_T_C)
PF13510
(Fer2_4) 		5 THR A 367
ALA A 356
GLU A 357
LEU A 358
PRO A 469
 None
 1.14A 4xi3D-2gahA:
undetectable		 4xi3D-2gahA:
13.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2gpv ESTROGEN-RELATED
RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 ALA A 272
GLU A 275
TRP A 305
LEU A 309
ARG A 316
HIS A 434
 OHT  A 500 (-3.5A)
OHT  A 500 (-2.6A)
None
OHT  A 500 ( 4.0A)
OHT  A 500 (-3.8A)
OHT  A 500 ( 4.7A)
 0.71A 4xi3D-2gpvA:
26.0		 4xi3D-2gpvA:
36.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2gpv ESTROGEN-RELATED
RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 GLU A 275
LEU A 276
TRP A 305
ARG A 316
HIS A 434
 OHT  A 500 (-2.6A)
OHT  A 500 (-4.9A)
None
OHT  A 500 (-3.8A)
OHT  A 500 ( 4.7A)
 1.04A 4xi3D-2gpvA:
26.0		 4xi3D-2gpvA:
36.65
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.
2irw CORTICOSTEROID
11-BETA-DEHYDROGENAS
E ISOZYME 1

(Homo sapiens) 		PF00106
(adh_short) 		5 THR A 151
ALA A 154
MET A  93
HIS A 120
LEU A 118
 None
 1.27A 4xi3D-2irwA:
undetectable		 4xi3D-2irwA:
24.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ocf ESTROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		9 THR A 347
ALA A 350
GLU A 353
TRP A 383
LEU A 387
ARG A 394
MET A 421
HIS A 524
LEU A 525
 None
EST  A 596 ( 3.9A)
EST  A 596 (-2.7A)
None
EST  A 596 ( 4.2A)
EST  A 596 (-4.0A)
EST  A 596 (-4.5A)
EST  A 596 (-4.2A)
EST  A 596 (-3.6A)
 0.98A 4xi3D-2ocfA:
31.4		 4xi3D-2ocfA:
98.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ocf ESTROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		9 THR A 347
ALA A 350
GLU A 353
TRP A 383
LEU A 387
LEU A 391
ARG A 394
MET A 421
HIS A 524
 None
EST  A 596 ( 3.9A)
EST  A 596 (-2.7A)
None
EST  A 596 ( 4.2A)
EST  A 596 ( 4.6A)
EST  A 596 (-4.0A)
EST  A 596 (-4.5A)
EST  A 596 (-4.2A)
 0.84A 4xi3D-2ocfA:
31.4		 4xi3D-2ocfA:
98.77
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.
2qxl HEAT SHOCK PROTEIN
HOMOLOG SSE1

(Saccharomyces
cerevisiae) 		PF00012
(HSP70) 		5 ALA A 164
GLU A 554
LEU A  49
ARG A  47
LEU A   7
 None
 1.21A 4xi3D-2qxlA:
undetectable		 4xi3D-2qxlA:
16.64
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.
2uv8 FATTY ACID SYNTHASE
SUBUNIT BETA (FAS1)

(Saccharomyces
cerevisiae) 		PF00698
(Acyl_transf_1)
PF01575
(MaoC_dehydratas)
PF08354
(DUF1729)
PF13452
(MaoC_dehydrat_N)
PF16073
(SAT) 		5 ALA G 192
GLU G 193
LEU G 195
LEU G 173
PRO G 239
 None
 1.30A 4xi3D-2uv8G:
undetectable		 4xi3D-2uv8G:
7.75
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.
2vbi PYRUVATE
DECARBOXYLASE

(Acetobacter
pasteurianus) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 ALA A 307
LEU A 281
LEU A 280
MET A 243
LEU A 220
 None
 1.23A 4xi3D-2vbiA:
undetectable		 4xi3D-2vbiA:
18.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vpw THIOSULFATE
REDUCTASE

(Thermus
thermophilus) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		5 THR A 415
ALA A 416
GLU A 419
ARG A 451
PRO A 176
 None
 1.31A 4xi3D-2vpwA:
undetectable		 4xi3D-2vpwA:
13.76
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.
2wyx BETA-LACTAMSE TOHO-1

(Escherichia
coli) 		PF13354
(Beta-lactamase2) 		5 ALA A 283
LEU A 279
LEU A 261
LEU A 259
LEU A  33
 None
 1.27A 4xi3D-2wyxA:
undetectable		 4xi3D-2wyxA:
21.75
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.
3cia COLD-ACTIVE
AMINOPEPTIDASE

(Colwellia
psychrerythraea) 		PF01433
(Peptidase_M1)
PF09127
(Leuk-A4-hydro_C) 		5 THR A 364
ALA A 367
GLU A 370
MET A 276
PRO A 487
 None
 1.17A 4xi3D-3ciaA:
undetectable		 4xi3D-3ciaA:
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.
3dzu RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		5 ALA A 272
TRP A 305
LEU A 309
ARG A 316
LEU A 436
 9CR  A7223 (-4.2A)
None
9CR  A7223 ( 4.4A)
9CR  A7223 (-3.7A)
9CR  A7223 ( 4.7A)
 0.85A 4xi3D-3dzuA:
22.9		 4xi3D-3dzuA:
19.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ez0 UNCHARACTERIZED
PROTEIN WITH
FERRITIN-LIKE FOLD

(Arthrobacter
sp. FB24) 		PF13794
(MiaE_2) 		5 ALA A  23
GLU A  26
LEU A  27
LEU A  62
MET A  70
 None
UNL  A 500 (-3.5A)
None
None
None
 1.19A 4xi3D-3ez0A:
undetectable		 4xi3D-3ez0A:
20.97
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.
3f7c PROTEIN OF UNKNOWN
FUNCTION (DUF416)

(Marinobacter
hydrocarbonoclasticus) 		PF04222
(DUF416) 		5 ALA A  26
GLU A  27
LEU A  23
LEU A  52
LEU A  75
 None
 1.17A 4xi3D-3f7cA:
undetectable		 4xi3D-3f7cA:
20.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fd5 SELENIDE, WATER
DIKINASE 1

(Homo sapiens) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		5 THR A 157
ALA A 155
GLU A 154
LEU A 247
ARG A 101
 None
 1.22A 4xi3D-3fd5A:
undetectable		 4xi3D-3fd5A:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fjy PROBABLE MUTT1
PROTEIN

(Bifidobacterium
adolescentis) 		PF00293
(NUDIX)
PF00300
(His_Phos_1) 		5 ALA A 238
LEU A 237
MET A 308
LEU A 191
PRO A 234
 None
 0.97A 4xi3D-3fjyA:
undetectable		 4xi3D-3fjyA:
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.
3g4g CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D

(Homo sapiens) 		PF00233
(PDEase_I) 		5 ALA A 483
TRP A 268
LEU A 341
LEU A 342
MET A 288
 None
 1.10A 4xi3D-3g4gA:
undetectable		 4xi3D-3g4gA:
20.47
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.
3g5b NETRIN RECEPTOR
UNC5B

(Rattus
norvegicus) 		PF00531
(Death)
PF00791
(ZU5)
PF17217
(UPA) 		5 ALA A 691
TRP A 783
LEU A 746
HIS A 624
LEU A 601
 None
 1.31A 4xi3D-3g5bA:
undetectable		 4xi3D-3g5bA:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gcg L0028 (MITOCHONDRIA
ASSOCIATED PROTEIN)

(Escherichia
coli) 		PF03278
(IpaB_EvcA) 		5 THR B 190
ALA B 193
GLU B 196
LEU B 195
LEU B  91
 None
 1.22A 4xi3D-3gcgB:
undetectable		 4xi3D-3gcgB:
20.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i0y PUTATIVE POLYKETIDE
CYCLASE

(Xanthomonas
campestris) 		PF12680
(SnoaL_2) 		5 THR A 122
ALA A  33
GLU A  34
LEU A  29
LEU A  12
 None
 1.02A 4xi3D-3i0yA:
undetectable		 4xi3D-3i0yA:
20.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lnt 2,3-BISPHOSPHOGLYCER
ATE-DEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Burkholderia
pseudomallei) 		PF00300
(His_Phos_1) 		5 THR A  55
ALA A 181
LEU A 186
LEU A 189
LEU A 178
 None
 1.26A 4xi3D-3lntA:
undetectable		 4xi3D-3lntA:
21.90
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.
3mkr COATOMER SUBUNIT
ALPHA
COATOMER SUBUNIT
EPSILON

(Bos taurus) 		PF04733
(Coatomer_E)
PF06957
(COPI_C) 		5 THR A 152
GLU A 147
TRP A 188
LEU B 973
ARG A  58
 None
 1.15A 4xi3D-3mkrA:
undetectable		 4xi3D-3mkrA:
22.65
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.
3nrh UNCHARACTERIZED
PROTEIN BF1032

(Bacteroides
fragilis) 		PF16702
(DUF5063) 		5 ALA A  20
TRP A 153
LEU A  49
LEU A  48
LEU A  56
 None
 0.93A 4xi3D-3nrhA:
undetectable		 4xi3D-3nrhA:
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.
3o3m BETA SUBUNIT
2-HYDROXYACYL-COA
DEHYDRATASE

(Clostridioides
difficile) 		PF06050
(HGD-D) 		5 GLU B  41
LEU B 281
ARG B 171
MET B  98
LEU B 121
 None
 1.24A 4xi3D-3o3mB:
undetectable		 4xi3D-3o3mB:
20.81
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.
3o57 CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B

(Homo sapiens) 		PF00233
(PDEase_I) 		5 ALA A 391
TRP A 176
LEU A 249
LEU A 250
MET A 196
 None
 1.11A 4xi3D-3o57A:
undetectable		 4xi3D-3o57A:
20.92
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.
3o5a DIHEME CYTOCHROME C
NAPB
PERIPLASMIC NITRATE
REDUCTASE

(Cupriavidus
necator) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF03892
(NapB)
PF04879
(Molybdop_Fe4S4) 		5 THR B  10
LEU A 491
ARG A  76
MET A 465
LEU A 774
 None
FMT  B 139 (-4.5A)
None
None
CL  A 816 (-4.0A)
 1.26A 4xi3D-3o5aB:
undetectable		 4xi3D-3o5aB:
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.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT L

(Escherichia
coli) 		no annotation 5 THR L 247
ALA L 251
LEU L 252
LEU L 344
HIS L 453
 None
 1.26A 4xi3D-3rkoL:
undetectable		 4xi3D-3rkoL:
18.30
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.
3s29 SUCROSE SYNTHASE 1

(Arabidopsis
thaliana) 		PF00534
(Glycos_transf_1)
PF00862
(Sucrose_synth) 		5 THR A 393
ALA A 396
GLU A 399
LEU A 284
PRO A 408
 None
 1.27A 4xi3D-3s29A:
undetectable		 4xi3D-3s29A:
14.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sl5 CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D

(Homo sapiens) 		PF00233
(PDEase_I) 		5 ALA A 317
TRP A 102
LEU A 175
LEU A 176
MET A 122
 ALA  A 317 ( 0.0A)
TRP  A 102 ( 0.5A)
LEU  A 175 ( 0.6A)
LEU  A 176 ( 0.6A)
MET  A 122 ( 0.0A)
 1.15A 4xi3D-3sl5A:
undetectable		 4xi3D-3sl5A:
20.92
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.
3v71 PUF (PUMILIO/FBF)
DOMAIN-CONTAINING
PROTEIN 7, CONFIRMED
BY TRANSCRIPT
EVIDENCE

(Caenorhabditis
elegans) 		PF00806
(PUF) 		5 THR A 154
ALA A 153
LEU A 149
LEU A 161
LEU A 162
 None
 1.27A 4xi3D-3v71A:
undetectable		 4xi3D-3v71A:
23.00
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.
3wjp HYDROGENASE
EXPRESSION/FORMATION
PROTEIN HYPE

(Thermococcus
kodakarensis) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		5 THR A  62
GLU A 141
LEU A  66
HIS A 176
LEU A  76
 QCS  A 338 ( 3.6A)
GOL  A 415 ( 4.5A)
None
None
None
 1.29A 4xi3D-3wjpA:
undetectable		 4xi3D-3wjpA:
23.05
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.
3x17 ENDOGLUCANASE

(uncultured
bacterium) 		no annotation 5 LEU B 567
LEU B 484
HIS B 468
LEU B 465
PRO B 566
 None
 1.29A 4xi3D-3x17B:
undetectable		 4xi3D-3x17B:
18.20
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.
4ako SPORE COAT PROTEIN A

(Bacillus
subtilis) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 THR A 406
ALA A 479
TRP A 463
LEU A 425
PRO A 359
 EDO  A1522 ( 4.1A)
None
None
None
None
 1.10A 4xi3D-4akoA:
undetectable		 4xi3D-4akoA:
20.04
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.
4akx EXOU

(Pseudomonas
aeruginosa) 		PF01734
(Patatin) 		5 THR B 231
ALA B 234
LEU B 236
MET B 138
LEU B 269
 None
 1.14A 4xi3D-4akxB:
undetectable		 4xi3D-4akxB:
16.69
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.
4bub UDP-N-ACETYLMURAMOYL
-L-ALANYL-D-GLUTAMAT
E--LD-LYSINE LIGASE

(Thermotoga
maritima) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		5 ALA A  89
GLU A  88
LEU A 160
ARG A  44
LEU A 225
 None
 1.19A 4xi3D-4bubA:
undetectable		 4xi3D-4bubA:
18.96
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.
4dim PHOSPHORIBOSYLGLYCIN
AMIDE SYNTHETASE

(Anaerococcus
prevotii) 		PF01071
(GARS_A) 		5 THR A  74
ALA A  73
LEU A   7
LEU A  69
MET A  52
 None
 1.17A 4xi3D-4dimA:
undetectable		 4xi3D-4dimA:
19.85
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.
4eze HALOACID
DEHALOGENASE-LIKE
HYDROLASE

(Salmonella
enterica) 		PF12710
(HAD) 		5 THR A  45
ALA A  40
LEU A  42
LEU A 295
LEU A 286
 None
 1.31A 4xi3D-4ezeA:
undetectable		 4xi3D-4ezeA:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fiu HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		5 THR A 369
ALA A 372
GLU A 375
LEU A 438
LEU A 319
 None
 1.16A 4xi3D-4fiuA:
undetectable		 4xi3D-4fiuA:
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.
4fzw 2,3-DEHYDROADIPYL-CO
A HYDRATASE

(Escherichia
coli) 		PF00378
(ECH_1) 		5 ALA A 106
GLU A 109
LEU A 104
LEU A 113
LEU A  17
 GOL  A 301 ( 4.7A)
GOL  A 301 (-3.8A)
None
None
None
 1.27A 4xi3D-4fzwA:
undetectable		 4xi3D-4fzwA:
24.29
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.
4gnx PUTATIVE
UNCHARACTERIZED
PROTEIN

(Ustilago maydis) 		PF01336
(tRNA_anti-codon) 		5 THR B  52
ALA B 166
GLU B 165
LEU B  48
LEU B  70
 None
 1.24A 4xi3D-4gnxB:
undetectable		 4xi3D-4gnxB:
18.82
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.
4h8n CONJUGATED
POLYKETONE REDUCTASE
C2

(Candida
parapsilosis) 		PF00248
(Aldo_ket_red) 		5 THR A 242
ALA A 236
GLU A 237
LEU A 235
LEU A 220
 None
None
None
None
NDP  A3001 ( 4.2A)
 1.09A 4xi3D-4h8nA:
undetectable		 4xi3D-4h8nA:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hn9 IRON COMPLEX
TRANSPORT SYSTEM
SUBSTRATE-BINDING
PROTEIN

([Eubacterium]
eligens) 		PF01497
(Peripla_BP_2) 		5 THR A 176
ALA A 188
LEU A 191
LEU A  89
PRO A 314
 None
 1.22A 4xi3D-4hn9A:
undetectable		 4xi3D-4hn9A:
21.01
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.
4hx6 OXIDOREDUCTASE

(Streptomyces
globisporus) 		PF01613
(Flavin_Reduct) 		5 ALA A  80
GLU A 131
LEU A 130
LEU A 122
LEU A 114
 None
 1.10A 4xi3D-4hx6A:
undetectable		 4xi3D-4hx6A:
20.61
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.
4inj LMO1638 PROTEIN

(Listeria
monocytogenes) 		PF02016
(Peptidase_S66) 		5 THR A 207
ALA A 115
LEU A 116
LEU A  92
PRO A  17
 None
 1.24A 4xi3D-4injA:
undetectable		 4xi3D-4injA:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j5x RETINOIC ACID
RECEPTOR RXR-ALPHA,
NUCLEAR RECEPTOR
COACTIVATOR 1

(Homo sapiens) 		no annotation 5 ALA D 272
TRP D 305
LEU D 309
ARG D 316
LEU D 436
 None
 0.91A 4xi3D-4j5xD:
22.7		 4xi3D-4j5xD:
29.14
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.
4k9q BENZOYLFORMATE
DECARBOXYLASE

(Polynucleobacter
necessarius) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 ALA A  96
GLU A  28
LEU A 158
LEU A 110
PRO A 129
 None
 1.21A 4xi3D-4k9qA:
undetectable		 4xi3D-4k9qA:
20.08
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.
4mwt LYSOSOMAL PROTECTIVE
PROTEIN

(Homo sapiens) 		PF00450
(Peptidase_S10) 		5 THR A 306
ALA A 309
LEU A  67
LEU A  74
MET A 430
 THR  A 306 ( 0.8A)
ALA  A 309 ( 0.0A)
LEU  A  67 ( 0.5A)
LEU  A  74 ( 0.6A)
MET  A 430 ( 0.0A)
 1.28A 4xi3D-4mwtA:
undetectable		 4xi3D-4mwtA:
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.
4mwz PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
vivax) 		PF13649
(Methyltransf_25) 		5 THR A  41
ALA A  40
TRP A 255
LEU A 210
LEU A 213
 None
 1.31A 4xi3D-4mwzA:
undetectable		 4xi3D-4mwzA:
20.70
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.
4n03 ABC-TYPE
BRANCHED-CHAIN AMINO
ACID TRANSPORT
SYSTEMS PERIPLASMIC
COMPONENT-LIKE
PROTEIN

(Thermomonospora
curvata) 		PF13458
(Peripla_BP_6) 		5 LEU A 177
LEU A 245
LEU A 203
LEU A 236
PRO A 268
 None
 1.22A 4xi3D-4n03A:
undetectable		 4xi3D-4n03A:
21.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4n1y ESTROGEN RECEPTOR

(Crassostrea
gigas) 		PF00104
(Hormone_recep) 		6 ALA A 287
GLU A 290
LEU A 291
TRP A 320
LEU A 324
ARG A 331
 None
 0.71A 4xi3D-4n1yA:
26.7		 4xi3D-4n1yA:
38.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4n1y ESTROGEN RECEPTOR

(Crassostrea
gigas) 		PF00104
(Hormone_recep) 		5 ALA A 287
GLU A 290
LEU A 324
LEU A 325
LEU A 470
 None
 1.27A 4xi3D-4n1yA:
26.7		 4xi3D-4n1yA:
38.40
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.
4pfs COBYRINIC ACID
A,C-DIAMIDE SYNTHASE

(Mycolicibacterium
smegmatis) 		PF13614
(AAA_31) 		5 LEU A 186
TRP A 259
LEU A  13
MET A  89
LEU A  35
 None
 1.13A 4xi3D-4pfsA:
undetectable		 4xi3D-4pfsA:
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.
4phq HEMOLYSIN E,
CHROMOSOMAL

(Escherichia
coli) 		PF06109
(HlyE) 		5 THR A  19
ALA A  23
LEU A  24
TRP A  86
LEU A 127
 None
 1.27A 4xi3D-4phqA:
undetectable		 4xi3D-4phqA:
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.
4udb MINERALOCORTICOID
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 ALA A 773
TRP A 806
LEU A 810
LEU A 814
ARG A 817
 CV7  A1987 (-3.5A)
None
CV7  A1987 (-4.0A)
CV7  A1987 ( 4.0A)
CV7  A1987 (-3.7A)
 0.62A 4xi3D-4udbA:
24.2		 4xi3D-4udbA:
28.03
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.
4wzi CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B

(Homo sapiens) 		PF00233
(PDEase_I) 		5 ALA A 563
TRP A 348
LEU A 421
LEU A 422
MET A 368
 None
 1.09A 4xi3D-4wziA:
undetectable		 4xi3D-4wziA:
17.74
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.
4xj6 VC0179-LIKE PROTEIN

(Escherichia
coli) 		no annotation 5 ALA A 303
LEU A 300
LEU A 329
LEU A 328
PRO A 295
 None
 0.93A 4xi3D-4xj6A:
2.5		 4xi3D-4xj6A:
21.85
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.
4xr7 PAB-DEPENDENT
POLY(A)-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN2

(Saccharomyces
cerevisiae) 		no annotation 5 THR G 846
ALA G 794
LEU G 805
LEU G 739
PRO G 619
 None
 1.24A 4xi3D-4xr7G:
undetectable		 4xi3D-4xr7G:
14.69
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.
4z64 PHYTOSULFOKINE
RECEPTOR 1

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13855
(LRR_8) 		5 LEU A 406
TRP A 434
LEU A 383
LEU A 417
PRO A 432
 None
 1.31A 4xi3D-4z64A:
undetectable		 4xi3D-4z64A:
16.99
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.
4znj PHAGE TERMINASE
LARGE SUBUNIT

(Thermus virus
P74-26) 		PF03237
(Terminase_6) 		5 ALA A  46
GLU A  50
LEU A 175
ARG A   5
LEU A  37
 None
 1.25A 4xi3D-4znjA:
undetectable		 4xi3D-4znjA:
19.86
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.
5b2d HN PROTEIN

(Mumps
rubulavirus) 		PF00423
(HN) 		5 ALA A 247
TRP A 384
LEU A 380
LEU A 280
PRO A 250
 None
 1.31A 4xi3D-5b2dA:
undetectable		 4xi3D-5b2dA:
18.69
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.
5b2d HN PROTEIN

(Mumps
rubulavirus) 		PF00423
(HN) 		5 THR A 279
ALA A 254
TRP A 384
LEU A 318
LEU A 380
 None
 1.28A 4xi3D-5b2dA:
undetectable		 4xi3D-5b2dA:
18.69
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.
5cj5 ALPHA-1,4-GLUCAN:MAL
TOSE-1-PHOSPHATE
MALTOSYLTRANSFERASE

(Mycolicibacterium
thermoresistibile) 		PF00128
(Alpha-amylase)
PF11896
(DUF3416) 		5 THR A 253
LEU A 258
ARG A 558
HIS A 313
LEU A 316
 None
 1.31A 4xi3D-5cj5A:
undetectable		 4xi3D-5cj5A:
16.64
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.
5eyt ADENYLOSUCCINATE
LYASE

(Schistosoma
mansoni) 		PF00206
(Lyase_1)
PF10397
(ADSL_C) 		5 THR A 105
ALA A 104
LEU A 102
LEU A  40
LEU A  36
 None
 1.30A 4xi3D-5eytA:
undetectable		 4xi3D-5eytA:
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.
5ez3 ACYL-COA
DEHYDROGENASE

(Brucella
melitensis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M) 		5 THR A 360
ALA A 361
GLU A 506
LEU A 510
ARG A 368
 None
 1.27A 4xi3D-5ez3A:
undetectable		 4xi3D-5ez3A:
16.78
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.
5gkm AT5G51070/K3K7_27

(Arabidopsis
thaliana) 		PF02861
(Clp_N) 		5 THR A 223
ALA A 197
LEU A 115
ARG A  86
LEU A 212
 None
 1.13A 4xi3D-5gkmA:
undetectable		 4xi3D-5gkmA:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h1z PUTATIVE CYP ALKANE
HYDROXYLASE
CYP153D17

(Sphingomonas
sp. PAMC 26605) 		PF00067
(p450) 		5 THR A 250
ALA A 362
GLU A 363
LEU A 364
ARG A 355
 HEM  A 501 ( 4.8A)
HEM  A 501 (-3.4A)
None
None
None
 1.28A 4xi3D-5h1zA:
undetectable		 4xi3D-5h1zA:
21.24
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.
5hxd PROTEIN MPAA

(Escherichia
coli) 		PF00246
(Peptidase_M14) 		5 ALA A  62
LEU A 231
LEU A 230
LEU A  77
PRO A  14
 None
 1.16A 4xi3D-5hxdA:
undetectable		 4xi3D-5hxdA:
22.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5iq0 ESTERASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 THR A 211
ALA A 214
GLU A 217
ARG A  95
LEU A 195
 None
 0.74A 4xi3D-5iq0A:
undetectable		 4xi3D-5iq0A:
23.67
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.
5lgc ARCE4A

(Arthrobacter
sp. AW19M34-1) 		PF01522
(Polysacc_deac_1) 		5 THR A  30
ALA A  53
LEU A 197
LEU A  46
LEU A  43
 None
 1.05A 4xi3D-5lgcA:
undetectable		 4xi3D-5lgcA:
22.76
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.
5lgc ARCE4A

(Arthrobacter
sp. AW19M34-1) 		PF01522
(Polysacc_deac_1) 		5 THR A  54
ALA A  53
LEU A 197
LEU A  46
LEU A  43
 None
 1.19A 4xi3D-5lgcA:
undetectable		 4xi3D-5lgcA:
22.76
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.
5ltg AUTOPHAGY-RELATED
PROTEIN 18

(Ogataea angusta) 		no annotation 5 THR A 254
ALA A 253
LEU A 235
LEU A 230
LEU A 258
 None
 1.30A 4xi3D-5ltgA:
undetectable		 4xi3D-5ltgA:
19.85
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.
5mjv CAPSID SUBUNIT VP0
CAPSID SUBUNIT VP1

(Parechovirus A) 		PF00073
(Rhv)
no annotation 		5 THR C 205
GLU C 188
LEU A 210
LEU C 243
LEU A  42
 None
 1.25A 4xi3D-5mjvC:
undetectable		 4xi3D-5mjvC:
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.
5mlq CDPS

(Nocardia
brasiliensis) 		no annotation 5 GLU A 175
TRP A 184
ARG A  70
HIS A  40
LEU A  32
 None
 1.14A 4xi3D-5mlqA:
undetectable		 4xi3D-5mlqA:
16.18
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.
5nnz DYNEIN ASSEMBLY
FACTOR WITH WDR
REPEAT DOMAINS 1

(Homo sapiens) 		no annotation 5 THR B 320
ALA B 319
LEU B 317
LEU B 360
LEU B 361
 None
 1.24A 4xi3D-5nnzB:
undetectable		 4xi3D-5nnzB:
20.64
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.
5ohj CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B

(Homo sapiens) 		no annotation 5 ALA A 563
TRP A 348
LEU A 421
LEU A 422
MET A 368
 None
 1.08A 4xi3D-5ohjA:
undetectable		 4xi3D-5ohjA:
17.70
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.
5tfy FLAGELLIN

(Methanospirillum
hungatei) 		no annotation 5 THR I 121
LEU I 102
TRP I  92
LEU I 138
PRO I 125
 None
 1.27A 4xi3D-5tfyI:
undetectable		 4xi3D-5tfyI:
20.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5toa ESTROGEN RECEPTOR
BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		9 THR A 299
ALA A 302
GLU A 305
TRP A 335
LEU A 339
LEU A 343
ARG A 346
HIS A 475
LEU A 476
 None
EST  A 601 ( 3.9A)
EST  A 601 (-2.4A)
None
EST  A 601 (-3.9A)
EST  A 601 ( 4.4A)
EST  A 601 (-4.1A)
EST  A 601 (-4.4A)
EST  A 601 (-3.5A)
 0.83A 4xi3D-5toaA:
30.0		 4xi3D-5toaA:
59.35
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.
5tvj ENHANCED
INTRACELLULAR
SURVIVAL PROTEIN

(Mycobacterium
tuberculosis) 		PF13527
(Acetyltransf_9)
PF13530
(SCP2_2) 		5 THR A 135
ALA A 363
LEU A 369
LEU A 296
PRO A  72
 None
 1.20A 4xi3D-5tvjA:
undetectable		 4xi3D-5tvjA:
20.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uld TRANSPORTER, NADC
FAMILY

(Vibrio cholerae) 		PF00939
(Na_sulph_symp) 		5 THR A 367
ALA A 366
LEU A 406
LEU A 403
MET A 356
 None
 1.22A 4xi3D-5uldA:
undetectable		 4xi3D-5uldA:
19.41
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.
5wbf METHYL-ACCEPTING
CHEMOTAXIS
TRANSDUCER (TLPC)

(Helicobacter
pylori) 		no annotation 5 ALA A 117
LEU A 102
LEU A  94
LEU A  95
LEU A  70
 None
 0.96A 4xi3D-5wbfA:
undetectable		 4xi3D-5wbfA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wh6 CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D

(Homo sapiens) 		no annotation 5 ALA A 317
TRP A 102
LEU A 175
LEU A 176
MET A 122
 None
 1.12A 4xi3D-5wh6A:
undetectable		 4xi3D-5wh6A:
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.
5whz ANTI-HIV CODV-FAB
HEAVY CHAIN

(Homo sapiens) 		no annotation 5 THR H 214
ALA H 215
LEU H 217
LEU H 170
LEU H 140
 None
 1.25A 4xi3D-5whzH:
undetectable		 4xi3D-5whzH:
22.37
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.
6b2w PUTATIVE
PEPTIDYL-ARGININE
DEIMINASE FAMILY
PROTEIN

(Campylobacter
jejuni) 		no annotation 5 THR A 202
ALA A 263
LEU A 245
HIS A 224
LEU A 228
 None
 1.30A 4xi3D-6b2wA:
undetectable		 4xi3D-6b2wA:
18.75
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.
6fht BACTERIOPHYTOCHROME,
ADENYLATE CYCLASE

(Deinococcus
radiodurans;
Synechocystis
sp. PCC 6803) 		no annotation 5 ALA A 427
LEU A 395
LEU A 392
ARG A 371
LEU A 408
 None
 1.30A 4xi3D-6fhtA:
undetectable		 4xi3D-6fhtA:
21.67
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.
1a6d THERMOSOME (BETA
SUBUNIT)

(Thermoplasma
acidophilum) 		PF00118
(Cpn60_TCP1) 		3 LEU B 244
ASP B 297
ILE B 290
 None
 0.60A 4xi3D-1a6dB:
0.0		 4xi3D-1a6dB:
18.40
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.
1am2 MXE GYRA INTEIN

(Mycobacterium
xenopi) 		no annotation 3 LEU A  50
ASP A  48
ILE A   2
 None
 0.58A 4xi3D-1am2A:
0.0		 4xi3D-1am2A:
25.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1boo PROTEIN (N-4
CYTOSINE-SPECIFIC
METHYLTRANSFERASE
PVU II)

(Proteus
vulgaris) 		PF01555
(N6_N4_Mtase) 		3 LEU A  49
ASP A  90
ILE A 272
 None
 0.70A 4xi3D-1booA:
0.0		 4xi3D-1booA:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cen CELLULASE CELC

(Ruminiclostridium
thermocellum) 		PF00150
(Cellulase) 		3 LEU A  10
ASP A  88
ILE A 322
 None
 0.55A 4xi3D-1cenA:
0.0		 4xi3D-1cenA:
20.85
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.
1ci9 PROTEIN
(CARBOXYLESTERASE)

(Burkholderia
gladioli) 		PF00144
(Beta-lactamase) 		3 LEU A  22
ASP A  27
ILE A  41
 None
 0.58A 4xi3D-1ci9A:
0.0		 4xi3D-1ci9A:
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.
1cvm PHYTASE

(Bacillus
amyloliquefaciens) 		PF02333
(Phytase) 		3 LEU A 262
ASP A  56
ILE A 286
 None
CA  A 803 (-2.5A)
None
 0.71A 4xi3D-1cvmA:
0.0		 4xi3D-1cvmA:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dgj ALDEHYDE
OXIDOREDUCTASE

(Desulfovibrio
desulfuricans) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		3 LEU A  33
ASP A 198
ILE A  79
 None
 0.69A 4xi3D-1dgjA:
0.0		 4xi3D-1dgjA:
14.40
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.
1dll TETANUS TOXIN

(Clostridium
tetani) 		PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N) 		3 LEU A1130
ASP A1139
ILE A1176
 None
 0.67A 4xi3D-1dllA:
0.0		 4xi3D-1dllA:
21.57
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.
1e32 P97

(Mus musculus) 		PF00004
(AAA)
PF02359
(CDC48_N)
PF02933
(CDC48_2) 		3 LEU A  41
ASP A  47
ILE A  70
 None
 0.52A 4xi3D-1e32A:
0.0		 4xi3D-1e32A:
19.83
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.
1eav MOLYBDOPTERIN
BIOSYNTHESIS CNX1
PROTEIN

(Arabidopsis
thaliana) 		PF00994
(MoCF_biosynth) 		3 LEU A  63
ASP A  68
ILE A 135
 None
 0.66A 4xi3D-1eavA:
undetectable		 4xi3D-1eavA:
19.52
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.
1eay CHEA

(Escherichia
coli) 		PF09078
(CheY-binding) 		3 LEU C 164
ASP C 193
ILE C 198
 None
 0.40A 4xi3D-1eayC:
undetectable		 4xi3D-1eayC:
14.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1eep INOSINE
5'-MONOPHOSPHATE
DEHYDROGENASE

(Borreliella
burgdorferi) 		PF00478
(IMPDH) 		3 LEU A 169
ASP A 217
ILE A 155
 None
 0.62A 4xi3D-1eepA:
undetectable		 4xi3D-1eepA:
20.10
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.
1f2h TUMOR NECROSIS
FACTOR RECEPTOR TYPE
1 ASSOCIATED DEATH
DOMAIN PROTEIN

(Homo sapiens) 		PF09034
(TRADD_N) 		3 LEU A 118
ASP A 126
ILE A  72
 None
 0.65A 4xi3D-1f2hA:
undetectable		 4xi3D-1f2hA:
22.40
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.
1fw8 PHOSPHOGLYCERATE
KINASE

(Saccharomyces
cerevisiae) 		PF00162
(PGK) 		3 LEU A 357
ASP A 359
ILE A 390
 None
 0.70A 4xi3D-1fw8A:
undetectable		 4xi3D-1fw8A:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1g5q EPIDERMIN MODIFYING
ENZYME EPID

(Staphylococcus
epidermidis) 		PF02441
(Flavoprotein) 		3 LEU A   5
ASP A  54
ILE A 165
 None
 0.67A 4xi3D-1g5qA:
undetectable		 4xi3D-1g5qA:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1g8k ARSENITE OXIDASE

(Alcaligenes
faecalis) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		3 LEU A 299
ASP A 306
ILE A 273
 None
MGD  A5002 (-3.0A)
None
 0.61A 4xi3D-1g8kA:
undetectable		 4xi3D-1g8kA:
16.12
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.
1ga7 HYPOTHETICAL 23.7
KDA PROTEIN IN
ICC-TOLC INTERGENIC
REGION

(Escherichia
coli) 		PF00293
(NUDIX) 		3 LEU A 204
ASP A  70
ILE A 143
 None
 0.71A 4xi3D-1ga7A:
undetectable		 4xi3D-1ga7A:
20.97
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.
1guq GALACTOSE-1-PHOSPHAT
E
URIDYLYLTRANSFERASE

(Escherichia
coli) 		PF01087
(GalP_UDP_transf)
PF02744
(GalP_UDP_tr_C) 		3 LEU A  82
ASP A  85
ILE A 169
 None
 0.58A 4xi3D-1guqA:
undetectable		 4xi3D-1guqA:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hkw DIAMINOPIMELATE
DECARBOXYLASE

(Mycobacterium
tuberculosis) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		3 LEU A  42
ASP A 341
ILE A  26
 None
 0.64A 4xi3D-1hkwA:
undetectable		 4xi3D-1hkwA:
19.65
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.
1ihc GEPHYRIN

(Rattus
norvegicus) 		PF00994
(MoCF_biosynth) 		3 LEU A  70
ASP A  75
ILE A 142
 None
 0.61A 4xi3D-1ihcA:
undetectable		 4xi3D-1ihcA:
20.97
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.
1iko EPHRIN-B2

(Mus musculus) 		PF00812
(Ephrin) 		3 LEU P  33
ASP P  62
ILE P  57
 None
 0.67A 4xi3D-1ikoP:
undetectable		 4xi3D-1ikoP:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1joe AUTOINDUCER-2
PRODUCTION PROTEIN

(Haemophilus
influenzae) 		PF02664
(LuxS) 		3 LEU A  68
ASP A  66
ILE A  92
 None
 0.65A 4xi3D-1joeA:
undetectable		 4xi3D-1joeA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jqq PEROXISOMAL MEMBRANE
PROTEIN PAS20

(Saccharomyces
cerevisiae) 		PF00018
(SH3_1) 		3 LEU A  20
ASP A  22
ILE A  76
 None
 0.53A 4xi3D-1jqqA:
undetectable		 4xi3D-1jqqA:
17.49
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.
1js4 ENDO/EXOCELLULASE E4

(Thermobifida
fusca) 		PF00759
(Glyco_hydro_9)
PF00942
(CBM_3) 		3 LEU A  97
ASP A 102
ILE A 165
 None
 0.71A 4xi3D-1js4A:
undetectable		 4xi3D-1js4A:
16.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ka0 HALOTOLERANCE
PROTEIN HAL2

(Saccharomyces
cerevisiae) 		PF00459
(Inositol_P) 		3 LEU A 343
ASP A 315
ILE A 256
 None
 0.64A 4xi3D-1ka0A:
2.8		 4xi3D-1ka0A:
23.37
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.
1kpi CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE 2

(Mycobacterium
tuberculosis) 		PF02353
(CMAS) 		3 LEU A  68
ASP A 176
ILE A  79
 None
 0.70A 4xi3D-1kpiA:
undetectable		 4xi3D-1kpiA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kvk MEVALONATE KINASE

(Rattus
norvegicus) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		3 LEU A 294
ASP A 299
ILE A 372
 None
 0.58A 4xi3D-1kvkA:
undetectable		 4xi3D-1kvkA:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1l2q MONOMETHYLAMINE
METHYLTRANSFERASE

(Methanosarcina
barkeri) 		PF05369
(MtmB) 		3 LEU A  62
ASP A  57
ILE A 271
 None
 0.71A 4xi3D-1l2qA:
undetectable		 4xi3D-1l2qA:
19.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lth L-LACTATE
DEHYDROGENASE (T-
AND R- STATE
TETRAMER COMPLEX)

(Bifidobacterium
longum) 		no annotation 3 LEU T 122
ASP T 128
ILE T 119
 None
 0.71A 4xi3D-1lthT:
undetectable		 4xi3D-1lthT:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lvg GUANYLATE KINASE

(Mus musculus) 		PF00625
(Guanylate_kin) 		3 LEU A  20
ASP A 101
ILE A 170
 None
5GP  A1202 ( 3.4A)
None
 0.61A 4xi3D-1lvgA:
undetectable		 4xi3D-1lvgA:
22.35
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.
1lw7 TRANSCRIPTIONAL
REGULATOR NADR

(Haemophilus
influenzae) 		PF01467
(CTP_transf_like)
PF13521
(AAA_28) 		3 LEU A 367
ASP A 372
ILE A 231
 None
 0.53A 4xi3D-1lw7A:
undetectable		 4xi3D-1lw7A:
19.20
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.
1m2v PROTEIN TRANSPORT
PROTEIN SEC24

(Saccharomyces
cerevisiae) 		PF00626
(Gelsolin)
PF04810
(zf-Sec23_Sec24)
PF04811
(Sec23_trunk)
PF04815
(Sec23_helical)
PF08033
(Sec23_BS) 		3 LEU B 156
ASP B 647
ILE B 151
 None
 0.63A 4xi3D-1m2vB:
undetectable		 4xi3D-1m2vB:
13.06
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.
1mty METHANE
MONOOXYGENASE
HYDROXYLASE

(Methylococcus
capsulatus) 		PF02332
(Phenol_Hydrox) 		3 LEU D 485
ASP D 170
ILE D 469
 None
 0.62A 4xi3D-1mtyD:
undetectable		 4xi3D-1mtyD:
19.76
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.
1mzr 2,5-DIKETO-D-GLUCONA
TE REDUCTASE A

(Escherichia
coli) 		PF00248
(Aldo_ket_red) 		3 LEU A  90
ASP A  82
ILE A  74
 None
 0.66A 4xi3D-1mzrA:
undetectable		 4xi3D-1mzrA:
23.36
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.
1n5x XANTHINE
DEHYDROGENASE

(Bos taurus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		3 LEU A  36
ASP A 595
ILE A  91
 None
 0.69A 4xi3D-1n5xA:
undetectable		 4xi3D-1n5xA:
10.68
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.
1n5x XANTHINE
DEHYDROGENASE

(Bos taurus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		3 LEU A 834
ASP A 740
ILE A 666
 None
 0.64A 4xi3D-1n5xA:
undetectable		 4xi3D-1n5xA:
10.68
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.
1nfd N15 ALPHA-BETA
T-CELL RECEPTOR

(Mus musculus) 		PF07686
(V-set)
PF09291
(DUF1968) 		3 LEU A 140
ASP A 137
ILE A 162
 None
 0.68A 4xi3D-1nfdA:
undetectable		 4xi3D-1nfdA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nij HYPOTHETICAL PROTEIN
YJIA

(Escherichia
coli) 		PF02492
(cobW)
PF07683
(CobW_C) 		3 LEU A  80
ASP A  85
ILE A  33
 None
 0.63A 4xi3D-1nijA:
undetectable		 4xi3D-1nijA:
21.91
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.
1no5 HYPOTHETICAL PROTEIN
HI0073

(Haemophilus
influenzae) 		PF01909
(NTP_transf_2) 		3 LEU A  80
ASP A  46
ILE A  52
 None
ZN  A 511 ( 2.5A)
None
 0.69A 4xi3D-1no5A:
undetectable		 4xi3D-1no5A:
23.11
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.
1oed ACETYLCHOLINE
RECEPTOR PROTEIN,
BETA CHAIN

(Torpedo
marmorata) 		PF02932
(Neur_chan_memb) 		3 LEU B 263
ASP B 268
ILE B 296
 None
 0.64A 4xi3D-1oedB:
undetectable		 4xi3D-1oedB:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ort ORNITHINE
TRANSCARBAMOYLASE

(Pseudomonas
aeruginosa) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		3 LEU A  24
ASP A  29
ILE A 156
 None
 0.59A 4xi3D-1ortA:
undetectable		 4xi3D-1ortA:
19.10
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.
1p3w CYSTEINE DESULFURASE

(Escherichia
coli) 		no annotation 3 LEU B 199
ASP B  79
ILE B 175
 None
PLP  B 764 ( 4.5A)
None
 0.63A 4xi3D-1p3wB:
undetectable		 4xi3D-1p3wB:
20.78
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.
1p4m RIBOFLAVIN KINASE

(Homo sapiens) 		PF01687
(Flavokinase) 		3 LEU A 119
ASP A 117
ILE A  32
 None
 0.65A 4xi3D-1p4mA:
undetectable		 4xi3D-1p4mA:
19.26
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.
1p9m INTERLEUKIN-6
RECEPTOR BETA CHAIN

(Homo sapiens) 		PF00041
(fn3)
PF06328
(Lep_receptor_Ig)
PF09240
(IL6Ra-bind) 		3 LEU A  28
ASP A  34
ILE A  59
 None
 0.71A 4xi3D-1p9mA:
undetectable		 4xi3D-1p9mA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pa4 PROBABLE
RIBOSOME-BINDING
FACTOR A

(Mycoplasma
pneumoniae) 		PF02033
(RBFA) 		3 LEU A  51
ASP A  94
ILE A  14
 None
 0.71A 4xi3D-1pa4A:
undetectable		 4xi3D-1pa4A:
20.60
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.
1pgu ACTIN INTERACTING
PROTEIN 1

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		3 LEU A 321
ASP A 318
ILE A 312
 None
 0.68A 4xi3D-1pguA:
undetectable		 4xi3D-1pguA:
16.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qnh PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Plasmodium
falciparum) 		PF00160
(Pro_isomerase) 		3 LEU A  25
ASP A  28
ILE A  22
 None
 0.62A 4xi3D-1qnhA:
undetectable		 4xi3D-1qnhA:
20.32
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.
1qpg 3-PHOSPHOGLYCERATE
KINASE

(Saccharomyces
cerevisiae) 		PF00162
(PGK) 		3 LEU A  13
ASP A  15
ILE A  46
 None
 0.66A 4xi3D-1qpgA:
undetectable		 4xi3D-1qpgA:
19.18
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.
1t4w C.ELEGANS P53 TUMOR
SUPPRESSOR-LIKE
TRANSCRIPTION FACTOR

(Caenorhabditis
elegans) 		PF09287
(CEP1-DNA_bind) 		3 LEU A 344
ASP A 382
ILE A 357
 None
 0.71A 4xi3D-1t4wA:
undetectable		 4xi3D-1t4wA:
20.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u5v CITE

(Mycobacterium
tuberculosis) 		PF03328
(HpcH_HpaI) 		3 LEU A 183
ASP A 187
ILE A 140
 None
 0.65A 4xi3D-1u5vA:
undetectable		 4xi3D-1u5vA:
24.91
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.
1u89 TALIN 1

(Mus musculus) 		no annotation 3 LEU A 764
ASP A 760
ILE A 812
 None
 0.69A 4xi3D-1u89A:
undetectable		 4xi3D-1u89A:
17.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ued P450 MONOOXYGENASE

(Amycolatopsis
orientalis) 		PF00067
(p450) 		3 LEU A 218
ASP A 215
ILE A 243
 None
 0.69A 4xi3D-1uedA:
undetectable		 4xi3D-1uedA:
20.92
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.
1umg 385AA LONG CONSERVED
HYPOTHETICAL PROTEIN

(Sulfurisphaera
tokodaii) 		PF01950
(FBPase_3) 		3 LEU A  55
ASP A  53
ILE A  58
 None
MG  A 403 (-2.7A)
None
 0.65A 4xi3D-1umgA:
undetectable		 4xi3D-1umgA:
22.07
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.
1umg 385AA LONG CONSERVED
HYPOTHETICAL PROTEIN

(Sulfurisphaera
tokodaii) 		PF01950
(FBPase_3) 		3 LEU A 213
ASP A 210
ILE A 202
 None
 0.60A 4xi3D-1umgA:
undetectable		 4xi3D-1umgA:
22.07
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.
1uxt GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
(NADP+)

(Thermoproteus
tenax) 		PF00171
(Aldedh) 		3 LEU A  83
ASP A  88
ILE A 475
 None
 0.61A 4xi3D-1uxtA:
undetectable		 4xi3D-1uxtA:
18.71
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.
1vdw HYPOTHETICAL PROTEIN
PH1897

(Pyrococcus
horikoshii) 		PF00459
(Inositol_P) 		3 LEU A 172
ASP A  87
ILE A 151
 None
EDO  A1002 (-2.8A)
None
 0.58A 4xi3D-1vdwA:
undetectable		 4xi3D-1vdwA:
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.
1vjz ENDOGLUCANASE

(Thermotoga
maritima) 		PF00150
(Cellulase) 		3 LEU A  85
ASP A 176
ILE A  67
 None
 0.68A 4xi3D-1vjzA:
undetectable		 4xi3D-1vjzA:
19.41
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.
1vlj NADH-DEPENDENT
BUTANOL
DEHYDROGENASE

(Thermotoga
maritima) 		PF00465
(Fe-ADH) 		3 LEU A 334
ASP A 345
ILE A 327
 None
 0.65A 4xi3D-1vljA:
undetectable		 4xi3D-1vljA:
19.04
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.
1vls ASPARTATE RECEPTOR

(Salmonella
enterica) 		PF02203
(TarH) 		3 LEU A 137
ASP A 142
ILE A  65
 None
 0.71A 4xi3D-1vlsA:
undetectable		 4xi3D-1vlsA:
16.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w27 PHENYLALANINE
AMMONIA-LYASE 1

(Petroselinum
crispum) 		PF00221
(Lyase_aromatic) 		3 LEU A 519
ASP A 524
ILE A 324
 None
 0.66A 4xi3D-1w27A:
undetectable		 4xi3D-1w27A:
17.32
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.
1wkb LEUCYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1) 		3 LEU A  75
ASP A 605
ILE A 541
 None
 0.49A 4xi3D-1wkbA:
undetectable		 4xi3D-1wkbA:
15.26
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.
1wno CHITINASE

(Aspergillus
fumigatus) 		PF00704
(Glyco_hydro_18) 		3 LEU A 190
ASP A 144
ILE A 136
 None
 0.67A 4xi3D-1wnoA:
undetectable		 4xi3D-1wnoA:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wz2 LEUCYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1) 		3 LEU A  75
ASP A 605
ILE A 541
 None
 0.48A 4xi3D-1wz2A:
undetectable		 4xi3D-1wz2A:
13.04
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.
1xi6 EXTRAGENIC
SUPPRESSOR

(Pyrococcus
furiosus) 		PF00459
(Inositol_P) 		3 LEU A 173
ASP A  87
ILE A 152
 None
 0.66A 4xi3D-1xi6A:
undetectable		 4xi3D-1xi6A:
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.
1xx7 OXETANOCIN-LIKE
PROTEIN

(Pyrococcus
furiosus) 		PF13023
(HD_3) 		3 LEU A  11
ASP A  32
ILE A   5
 None
 0.69A 4xi3D-1xx7A:
undetectable		 4xi3D-1xx7A:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1y3t HYPOTHETICAL PROTEIN
YXAG

(Bacillus
subtilis) 		PF07883
(Cupin_2) 		3 LEU A 204
ASP A 202
ILE A 207
 None
 0.67A 4xi3D-1y3tA:
undetectable		 4xi3D-1y3tA:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zq1 GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT D

(Pyrococcus
abyssi) 		PF00710
(Asparaginase) 		3 LEU A 285
ASP A 270
ILE A 276
 None
 0.67A 4xi3D-1zq1A:
undetectable		 4xi3D-1zq1A:
19.77
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.
1zq1 GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT D
GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT E

(Pyrococcus
abyssi) 		PF00710
(Asparaginase)
PF02637
(GatB_Yqey)
PF02934
(GatB_N)
PF02938
(GAD) 		3 LEU A  61
ASP C 117
ILE A  12
 None
 0.65A 4xi3D-1zq1A:
undetectable		 4xi3D-1zq1A:
19.77
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.
2a5h L-LYSINE
2,3-AMINOMUTASE

(Clostridium
subterminale) 		PF04055
(Radical_SAM)
PF12544
(LAM_C) 		3 LEU A 261
ASP A 293
ILE A 309
 None
LYS  A 420 ( 3.2A)
None
 0.55A 4xi3D-2a5hA:
undetectable		 4xi3D-2a5hA:
21.03
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.
2amx ADENOSINE DEAMINASE

(Plasmodium
yoelii) 		PF00962
(A_deaminase) 		3 LEU A  58
ASP A 324
ILE A 157
 None
 0.45A 4xi3D-2amxA:
undetectable		 4xi3D-2amxA:
19.85
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.
2anp LEUCYL
AMINOPEPTIDASE

(Vibrio
proteolyticus) 		PF04389
(Peptidase_M28) 		3 LEU A 205
ASP A 210
ILE A 193
 None
NA  A 503 ( 4.2A)
None
 0.59A 4xi3D-2anpA:
undetectable		 4xi3D-2anpA:
21.64
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.
2apl HYPOTHETICAL PROTEIN
PG0816

(Porphyromonas
gingivalis) 		PF08989
(DUF1896) 		3 LEU A  70
ASP A  76
ILE A  34
 None
 0.70A 4xi3D-2aplA:
undetectable		 4xi3D-2aplA:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2asr ASPARTATE RECEPTOR

(Escherichia
coli) 		PF02203
(TarH) 		3 LEU A 137
ASP A 142
ILE A  65
 None
 0.67A 4xi3D-2asrA:
undetectable		 4xi3D-2asrA:
20.99
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.
2atv RAS-LIKE
ESTROGEN-REGULATED
GROWTH INHIBITOR

(Homo sapiens) 		PF00071
(Ras) 		3 LEU A  98
ASP A 103
ILE A  11
 None
 0.50A 4xi3D-2atvA:
undetectable		 4xi3D-2atvA:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ay9 AROMATIC AMINO ACID
AMINOTRANSFERASE

(Paracoccus
denitrificans) 		PF00155
(Aminotran_1_2) 		3 LEU A 202
ASP A 230
ILE A 208
 None
 0.68A 4xi3D-2ay9A:
undetectable		 4xi3D-2ay9A:
22.45
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.
2ayn UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 14

(Homo sapiens) 		PF00443
(UCH) 		3 LEU A 214
ASP A 243
ILE A 151
 None
 0.55A 4xi3D-2aynA:
undetectable		 4xi3D-2aynA:
19.65
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.
2b3x IRON-RESPONSIVE
ELEMENT BINDING
PROTEIN 1

(Homo sapiens) 		PF00330
(Aconitase)
PF00694
(Aconitase_C) 		3 LEU A 671
ASP A 673
ILE A 767
 None
 0.69A 4xi3D-2b3xA:
undetectable		 4xi3D-2b3xA:
13.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bvm TOXIN B

(Clostridioides
difficile) 		PF12918
(TcdB_N)
PF12919
(TcdA_TcdB) 		3 LEU A 265
ASP A 270
ILE A 107
 UDP  A1543 (-3.9A)
GLC  A1544 (-2.9A)
None
 0.70A 4xi3D-2bvmA:
undetectable		 4xi3D-2bvmA:
18.40
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.
2bwm PSATHYRELLA VELUTINA
LECTIN PVL

(Lacrymaria
velutina) 		PF13517
(VCBS) 		3 LEU A 377
ASP A 379
ILE A 352
 None
 0.65A 4xi3D-2bwmA:
undetectable		 4xi3D-2bwmA:
19.55
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.
2c1i PEPTIDOGLYCAN GLCNAC
DEACETYLASE

(Streptococcus
pneumoniae) 		PF01522
(Polysacc_deac_1) 		3 LEU A  53
ASP A  58
ILE A 134
 None
 0.64A 4xi3D-2c1iA:
undetectable		 4xi3D-2c1iA:
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.
2cqz 177AA LONG
HYPOTHETICAL PROTEIN

(Pyrococcus
horikoshii) 		PF13023
(HD_3) 		3 LEU A  11
ASP A  32
ILE A   5
 None
 0.63A 4xi3D-2cqzA:
undetectable		 4xi3D-2cqzA:
19.75
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.
2csq RIM BINDING PROTEIN
2

(Homo sapiens) 		PF07653
(SH3_2) 		3 LEU A  23
ASP A  25
ILE A  81
 None
 0.65A 4xi3D-2csqA:
undetectable		 4xi3D-2csqA:
15.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ddz 190AA LONG
HYPOTHETICAL PROTEIN

(Pyrococcus
horikoshii) 		PF04017
(DUF366) 		3 LEU A 138
ASP A  67
ILE A 104
 None
 0.65A 4xi3D-2ddzA:
undetectable		 4xi3D-2ddzA:
22.95
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.
2dl2 PROTEIN (MHC CLASS I
NK CELL RECEPTOR
PRECURSOR (P58
NATURAL KILLER CELL
RECEPTOR CLONE
CL-43))

(Homo sapiens) 		PF00047
(ig) 		3 LEU A  39
ASP A  47
ILE A  25
 None
 0.66A 4xi3D-2dl2A:
undetectable		 4xi3D-2dl2A:
24.29
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.
2exh BETA-D-XYLOSIDASE

(Geobacillus
stearothermophilus) 		PF04616
(Glyco_hydro_43) 		3 LEU A  62
ASP A 118
ILE A  65
 GOL  A2008 ( 4.8A)
None
None
 0.63A 4xi3D-2exhA:
undetectable		 4xi3D-2exhA:
18.11
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.
2fff PENICILLIN-BINDING
PROTEIN 1B

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase) 		3 LEU B 620
ASP B 647
ILE B 472
 None
 0.72A 4xi3D-2fffB:
undetectable		 4xi3D-2fffB:
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.
2fgy CARBOXYSOME SHELL
POLYPEPTIDE

(Halothiobacillus
neapolitanus) 		PF08936
(CsoSCA) 		3 LEU A  62
ASP A  67
ILE A 185
 None
 0.35A 4xi3D-2fgyA:
undetectable		 4xi3D-2fgyA:
19.24
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.
2fsv NAD(P)
TRANSHYDROGENASE
SUBUNIT BETA

(Rhodospirillum
rubrum) 		PF02233
(PNTB) 		3 LEU C  66
ASP C  71
ILE C  84
 None
 0.68A 4xi3D-2fsvC:
undetectable		 4xi3D-2fsvC:
20.87
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.
2ft0 TDP-FUCOSAMINE
ACETYLTRANSFERASE

(Escherichia
coli) 		no annotation 3 LEU A 155
ASP A 136
ILE A 141
 None
 0.69A 4xi3D-2ft0A:
undetectable		 4xi3D-2ft0A:
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.
2fuq HEPARINASE II
PROTEIN

(Pedobacter
heparinus) 		PF07940
(Hepar_II_III)
PF16332
(DUF4962) 		3 LEU A 610
ASP A 563
ILE A 687
 PO4  A 944 ( 3.9A)
None
None
 0.66A 4xi3D-2fuqA:
undetectable		 4xi3D-2fuqA:
14.72
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.
2hg4 6-DEOXYERYTHRONOLIDE
B SYNTHASE

(Saccharopolyspora
erythraea) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF08990
(Docking)
PF16197
(KAsynt_C_assoc) 		3 LEU A 772
ASP A 782
ILE A 646
 None
 0.70A 4xi3D-2hg4A:
undetectable		 4xi3D-2hg4A:
13.56
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.
2hiv THERMOSTABLE DNA
LIGASE

(Sulfolobus
solfataricus) 		PF01068
(DNA_ligase_A_M)
PF04675
(DNA_ligase_A_N)
PF04679
(DNA_ligase_A_C) 		3 LEU A 349
ASP A 258
ILE A 306
 None
 0.49A 4xi3D-2hivA:
undetectable		 4xi3D-2hivA:
16.26
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.
2hle EPHRIN-B2

(Homo sapiens) 		PF00812
(Ephrin) 		3 LEU B  33
ASP B  62
ILE B  57
 None
 0.70A 4xi3D-2hleB:
undetectable		 4xi3D-2hleB:
18.70
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.
2i7x PROTEIN CFT2

(Saccharomyces
cerevisiae) 		PF16661
(Lactamase_B_6) 		3 LEU A 282
ASP A 103
ILE A 339
 None
 0.59A 4xi3D-2i7xA:
undetectable		 4xi3D-2i7xA:
16.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i99 MU-CRYSTALLIN
HOMOLOG

(Homo sapiens) 		PF02423
(OCD_Mu_crystall) 		3 LEU A 212
ASP A 260
ILE A 141
 None
 0.67A 4xi3D-2i99A:
undetectable		 4xi3D-2i99A:
23.03
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.
2ihy ABC TRANSPORTER,
ATP-BINDING PROTEIN

(Staphylococcus
aureus) 		PF00005
(ABC_tran) 		3 LEU A 185
ASP A 190
ILE A 207
 None
 0.70A 4xi3D-2ihyA:
undetectable		 4xi3D-2ihyA:
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.
2iye COPPER-TRANSPORTING
ATPASE

(Sulfolobus
solfataricus) 		PF00702
(Hydrolase) 		3 LEU A 421
ASP A 517
ILE A 414
 None
 0.67A 4xi3D-2iyeA:
undetectable		 4xi3D-2iyeA:
23.59
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.
2j04 HYPOTHETICAL PROTEIN
YPL007C

(Saccharomyces
cerevisiae) 		PF12660
(zf-TFIIIC) 		3 LEU A 294
ASP A 296
ILE A 234
 None
 0.64A 4xi3D-2j04A:
undetectable		 4xi3D-2j04A:
18.00
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.
2jch PENICILLIN-BINDING
PROTEIN 1B

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase)
PF00912
(Transgly) 		3 LEU A 620
ASP A 647
ILE A 472
 None
 0.70A 4xi3D-2jchA:
undetectable		 4xi3D-2jchA:
15.59
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.
2jgz CELL DIVISION
PROTEIN KINASE 2

(Homo sapiens) 		PF00069
(Pkinase) 		3 LEU A 263
ASP A 256
ILE A 192
 None
 0.71A 4xi3D-2jgzA:
undetectable		 4xi3D-2jgzA:
22.90