SIMILAR PATTERNS OF AMINO ACIDS FOR 1QKN_A_RALA600

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.
1b4b ARGININE REPRESSOR

(Geobacillus
stearothermophilus) 		PF02863
(Arg_repressor_C) 		6 LEU A  96
THR A 127
ALA A 103
LEU A 109
ILE A 118
GLY A 120
 None
 1.08A 1qknA-1b4bA:
undetectable		 1qknA-1b4bA:
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.
1bea BIFUNCTIONAL
AMYLASE/SERINE
PROTEASE INHIBITOR

(Zea mays) 		PF00234
(Tryp_alpha_amyl) 		5 LEU A  60
THR A  58
LEU A  80
ARG A  21
GLY A 120
 None
 0.96A 1qknA-1beaA:
undetectable		 1qknA-1beaA:
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.
1dm3 BIOSYNTHETIC
THIOLASE ACETYLATED
AT CYS89

(Zoogloea
ramigera) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		6 LEU A 377
THR A 376
ALA A 375
LEU A 361
ILE A 346
GLY A 342
 SCY  A  89 ( 3.8A)
None
None
None
None
None
 1.50A 1qknA-1dm3A:
undetectable		 1qknA-1dm3A:
21.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gju MALTODEXTRIN
GLYCOSYLTRANSFERASE

(Thermotoga
maritima) 		PF00128
(Alpha-amylase)
PF09083
(DUF1923) 		5 THR A 118
LEU A 125
LEU A 126
ILE A   6
GLY A  49
 None
 0.86A 1qknA-1gjuA:
undetectable		 1qknA-1gjuA:
18.25
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.
1gze MONO-ADP-RIBOSYLTRAN
SFERASE C3

(Clostridium
botulinum) 		PF03496
(ADPrib_exo_Tox) 		5 LEU A 135
ALA A 133
ILE A 239
ILE A 189
GLY A 129
 None
 0.93A 1qknA-1gzeA:
undetectable		 1qknA-1gzeA:
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.
1ih5 AQUAPORIN-1

(Homo sapiens) 		PF00230
(MIP) 		5 ALA A  20
LEU A  63
ILE A  70
GLY A  72
LEU A  75
 None
 0.94A 1qknA-1ih5A:
undetectable		 1qknA-1ih5A:
26.21
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.
1ihc GEPHYRIN

(Rattus
norvegicus) 		PF00994
(MoCF_biosynth) 		5 LEU A  70
LEU A  79
ILE A 104
ILE A 135
GLY A 137
 None
 0.98A 1qknA-1ihcA:
undetectable		 1qknA-1ihcA:
22.75
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.
1jhl IGG1-KAPPA D11.15 FV
(LIGHT CHAIN)

(Mus musculus) 		PF07686
(V-set) 		5 LEU L  73
THR L  20
LEU L 104
ILE L  87
GLY L 101
 None
 0.98A 1qknA-1jhlL:
undetectable		 1qknA-1jhlL:
16.08
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.
1k4q GLUTATHIONE
REDUCTASE

(Homo sapiens) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		6 ALA A 155
LEU A 153
LEU A  24
ILE A 125
ILE A 123
LEU A  33
 FAD  A 499 (-4.5A)
None
None
None
None
NIY  A 114 ( 4.1A)
 1.25A 1qknA-1k4qA:
undetectable		 1qknA-1k4qA:
18.62
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.
1mty METHANE
MONOOXYGENASE
HYDROXYLASE

(Methylococcus
capsulatus) 		PF02332
(Phenol_Hydrox) 		5 LEU D 349
LEU D 405
ILE D 469
GLY D 178
LEU D 180
 None
 0.92A 1qknA-1mtyD:
2.3		 1qknA-1mtyD:
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.
1oyw ATP-DEPENDENT DNA
HELICASE

(Escherichia
coli) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF09382
(RQC)
PF16124
(RecQ_Zn_bind) 		5 LEU A 180
THR A 181
ALA A 148
LEU A 196
ILE A  33
 None
 0.91A 1qknA-1oywA:
undetectable		 1qknA-1oywA:
19.29
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) 		9 LEU A 346
ALA A 350
GLU A 353
LEU A 387
LEU A 391
ARG A 394
ILE A 424
GLY A 521
LEU A 525
 EST  A   1 (-4.4A)
EST  A   1 ( 3.7A)
EST  A   1 (-2.8A)
EST  A   1 (-4.0A)
EST  A   1 ( 3.9A)
EST  A   1 (-3.7A)
EST  A   1 ( 4.5A)
EST  A   1 ( 4.1A)
EST  A   1 (-3.6A)
 0.71A 1qknA-1pcgA:
29.8		 1qknA-1pcgA:
59.92
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) 		9 LEU A 346
THR A 347
ALA A 350
GLU A 353
LEU A 387
LEU A 391
ARG A 394
GLY A 521
LEU A 525
 EST  A   1 (-4.4A)
None
EST  A   1 ( 3.7A)
EST  A   1 (-2.8A)
EST  A   1 (-4.0A)
EST  A   1 ( 3.9A)
EST  A   1 (-3.7A)
EST  A   1 ( 4.1A)
EST  A   1 (-3.6A)
 0.67A 1qknA-1pcgA:
29.8		 1qknA-1pcgA:
59.92
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) 		6 THR A 347
ALA A 350
GLU A 353
ARG A 394
ILE A 424
LEU A 525
 None
EST  A   1 ( 3.7A)
EST  A   1 (-2.8A)
EST  A   1 (-3.7A)
EST  A   1 ( 4.5A)
EST  A   1 (-3.6A)
 1.21A 1qknA-1pcgA:
29.8		 1qknA-1pcgA:
59.92
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.
1ss4 GLYOXALASE FAMILY
PROTEIN

(Bacillus cereus) 		PF13669
(Glyoxalase_4) 		5 LEU A 110
THR A 111
ILE A 141
ILE A 139
GLY A 138
 None
 0.99A 1qknA-1ss4A:
undetectable		 1qknA-1ss4A:
19.69
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.
1suv TRANSFERRIN RECEPTOR
PROTEIN 1

(Homo sapiens) 		PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28) 		6 THR A 239
ALA A 235
LEU A 232
ILE A 332
ILE A 277
GLY A 252
 None
 1.31A 1qknA-1suvA:
undetectable		 1qknA-1suvA:
16.95
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.
1u8x MALTOSE-6'-PHOSPHATE
GLUCOSIDASE

(Bacillus
subtilis) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		5 LEU X 394
THR X 395
ALA X 398
GLU X 401
ILE X 412
 None
 0.95A 1qknA-1u8xX:
undetectable		 1qknA-1u8xX:
21.14
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
LEU A 380
ARG A 387
ILE A 416
LEU A 507
 MEI  A1001 (-3.3A)
MEI  A1001 (-3.8A)
MEI  A1001 (-3.6A)
None
MEI  A1001 (-4.6A)
 0.92A 1qknA-1uhlA:
22.5		 1qknA-1uhlA:
31.20
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
LEU A 380
ARG A 387
ILE A 499
GLY A 500
 MEI  A1001 (-3.3A)
MEI  A1001 (-3.8A)
MEI  A1001 (-3.6A)
None
None
 0.97A 1qknA-1uhlA:
22.5		 1qknA-1uhlA:
31.20
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.
1vcg ISOPENTENYL-DIPHOSPH
ATE DELTA-ISOMERASE

(Thermus
thermophilus) 		PF01070
(FMN_dh) 		5 LEU A  48
THR A  49
LEU A 281
LEU A 282
ILE A 303
 None
 0.92A 1qknA-1vcgA:
undetectable		 1qknA-1vcgA:
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.
1x87 UROCANASE PROTEIN

(Geobacillus
stearothermophilus) 		PF01175
(Urocanase)
PF17391
(Urocanase_N)
PF17392
(Urocanase_C) 		5 LEU A 166
THR A 165
LEU A 218
ILE A 191
GLY A 234
 None
 0.93A 1qknA-1x87A:
undetectable		 1qknA-1x87A:
16.85
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
MET A 362
LEU A 365
ARG A 372
GLY A 489
 None
 0.88A 1qknA-1xb7A:
25.2		 1qknA-1xb7A:
34.51
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 LEU A 324
GLU A 331
MET A 362
LEU A 365
ARG A 372
 None
 0.47A 1qknA-1xb7A:
25.2		 1qknA-1xb7A:
34.51
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.
1xiu RXR-LIKE PROTEIN

(Biomphalaria
glabrata) 		PF00104
(Hormone_recep) 		6 ALA A 246
LEU A 283
ARG A 290
ILE A 319
ILE A 402
GLY A 403
 9CR  A 201 (-3.6A)
9CR  A 201 ( 4.1A)
9CR  A 201 (-2.8A)
None
None
None
 1.03A 1qknA-1xiuA:
23.1		 1qknA-1xiuA:
30.00
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) 		6 ALA A 272
LEU A 309
ARG A 316
ILE A 345
ILE A 428
GLY A 429
 9CR  A 801 (-3.5A)
9CR  A 801 (-4.2A)
9CR  A 801 (-2.6A)
9CR  A 801 ( 4.5A)
None
None
 1.03A 1qknA-1xlsA:
22.4		 1qknA-1xlsA:
31.43
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.
1yz6 PROBABLE TRANSLATION
INITIATION FACTOR 2
ALPHA SUBUNIT

(Pyrococcus
abyssi) 		PF00575
(S1)
PF07541
(EIF_2_alpha) 		6 THR A  18
ALA A  17
LEU A  80
LEU A  82
ILE A  54
GLY A  26
 None
 1.13A 1qknA-1yz6A:
undetectable		 1qknA-1yz6A:
19.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2akz GAMMA ENOLASE

(Homo sapiens) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		5 ALA A  45
LEU A  48
ILE A  72
ILE A  68
GLY A 112
 None
 1.00A 1qknA-2akzA:
undetectable		 1qknA-2akzA:
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.
2b3d MODULATOR OF DRUG
ACTIVITY B

(Escherichia
coli) 		PF02525
(Flavodoxin_2) 		5 LEU A  35
THR A  36
ALA A  39
LEU A 199
ILE A 178
 None
 0.93A 1qknA-2b3dA:
undetectable		 1qknA-2b3dA:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b5m DAMAGE-SPECIFIC DNA
BINDING PROTEIN 1

(Homo sapiens) 		PF03178
(CPSF_A)
PF10433
(MMS1_N) 		5 LEU A 273
LEU A 284
LEU A 300
ILE A 220
GLY A 268
 None
 1.01A 1qknA-2b5mA:
undetectable		 1qknA-2b5mA:
14.45
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.
2bg9 ACETYLCHOLINE
RECEPTOR PROTEIN,
GAMMA CHAIN

(Torpedo
marmorata) 		PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb) 		5 LEU E  36
THR E  37
LEU E  49
ILE E 185
GLY E 181
 None
 1.01A 1qknA-2bg9E:
undetectable		 1qknA-2bg9E:
22.25
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.
2d5r CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 7

(Homo sapiens) 		PF04857
(CAF1) 		5 LEU A 233
THR A 234
ALA A 237
LEU A 216
GLY A 207
 None
 0.90A 1qknA-2d5rA:
undetectable		 1qknA-2d5rA:
21.23
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.
2eb5 2-OXO-HEPT-3-ENE-1,7
-DIOATE HYDRATASE

(Escherichia
coli) 		PF01557
(FAA_hydrolase) 		5 LEU A  64
THR A  65
ALA A  68
ILE A 162
ILE A  36
 OXL  A2001 ( 4.7A)
OXL  A2001 ( 4.5A)
None
None
None
 0.99A 1qknA-2eb5A:
undetectable		 1qknA-2eb5A:
21.18
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 LEU A 268
ALA A 272
GLU A 275
MET A 306
LEU A 309
ARG A 316
 OHT  A 500 (-4.1A)
OHT  A 500 (-3.5A)
OHT  A 500 (-2.6A)
OHT  A 500 (-3.9A)
OHT  A 500 ( 4.0A)
OHT  A 500 (-3.8A)
 0.41A 1qknA-2gpvA:
27.6		 1qknA-2gpvA:
33.60
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.
2kb2 BLRP1

(Klebsiella
pneumoniae) 		PF04940
(BLUF) 		6 THR A 105
ALA A 108
GLU A 111
LEU A  98
LEU A 102
GLY A  47
 None
 1.42A 1qknA-2kb2A:
undetectable		 1qknA-2kb2A:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o78 PUTATIVE HISTIDINE
AMMONIA-LYASE

(Rhodobacter
sphaeroides) 		PF00221
(Lyase_aromatic) 		5 LEU A  82
THR A  81
ALA A  84
LEU A 199
ILE A  53
 None
 1.00A 1qknA-2o78A:
undetectable		 1qknA-2o78A:
19.96
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) 		8 LEU A 346
ALA A 350
GLU A 353
LEU A 387
ARG A 394
ILE A 424
GLY A 521
LEU A 525
 EST  A 596 (-4.4A)
EST  A 596 ( 3.9A)
EST  A 596 (-2.7A)
EST  A 596 ( 4.2A)
EST  A 596 (-4.0A)
EST  A 596 ( 4.7A)
EST  A 596 ( 4.0A)
EST  A 596 (-3.6A)
 0.84A 1qknA-2ocfA:
30.0		 1qknA-2ocfA:
53.61
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) 		8 LEU A 346
ALA A 350
GLU A 353
LEU A 387
LEU A 391
ARG A 394
ILE A 424
GLY A 521
 EST  A 596 (-4.4A)
EST  A 596 ( 3.9A)
EST  A 596 (-2.7A)
EST  A 596 ( 4.2A)
EST  A 596 ( 4.6A)
EST  A 596 (-4.0A)
EST  A 596 ( 4.7A)
EST  A 596 ( 4.0A)
 0.61A 1qknA-2ocfA:
30.0		 1qknA-2ocfA:
53.61
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) 		8 LEU A 346
THR A 347
ALA A 350
GLU A 353
LEU A 387
ARG A 394
GLY A 521
LEU A 525
 EST  A 596 (-4.4A)
None
EST  A 596 ( 3.9A)
EST  A 596 (-2.7A)
EST  A 596 ( 4.2A)
EST  A 596 (-4.0A)
EST  A 596 ( 4.0A)
EST  A 596 (-3.6A)
 0.83A 1qknA-2ocfA:
30.0		 1qknA-2ocfA:
53.61
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) 		8 LEU A 346
THR A 347
ALA A 350
GLU A 353
LEU A 387
LEU A 391
ARG A 394
GLY A 521
 EST  A 596 (-4.4A)
None
EST  A 596 ( 3.9A)
EST  A 596 (-2.7A)
EST  A 596 ( 4.2A)
EST  A 596 ( 4.6A)
EST  A 596 (-4.0A)
EST  A 596 ( 4.0A)
 0.53A 1qknA-2ocfA:
30.0		 1qknA-2ocfA:
53.61
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) 		6 THR A 347
ALA A 350
GLU A 353
ARG A 394
ILE A 424
LEU A 525
 None
EST  A 596 ( 3.9A)
EST  A 596 (-2.7A)
EST  A 596 (-4.0A)
EST  A 596 ( 4.7A)
EST  A 596 (-3.6A)
 1.35A 1qknA-2ocfA:
30.0		 1qknA-2ocfA:
53.61
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.
2pmp 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE

(Arabidopsis
thaliana) 		PF02542
(YgbB) 		5 ALA A 151
LEU A 132
ILE A  28
ILE A  26
GLY A  25
 None
 0.90A 1qknA-2pmpA:
undetectable		 1qknA-2pmpA:
23.50
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.
2q3y ANCESTRAL CORTICIOD
RECEPTOR

(unidentified) 		PF00104
(Hormone_recep) 		5 LEU A  32
ALA A  36
MET A  70
LEU A  77
ARG A  80
 1CA  A 247 (-4.0A)
1CA  A 247 (-3.6A)
1CA  A 247 ( 3.8A)
1CA  A 247 ( 3.9A)
1CA  A 247 (-3.8A)
 0.33A 1qknA-2q3yA:
25.4		 1qknA-2q3yA:
30.00
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.
2qvl DIACYLGLYCEROL
KINASE DGKB

(Staphylococcus
aureus) 		PF00781
(DAGK_cat) 		5 ALA A 280
LEU A 268
LEU A 266
ILE A 223
LEU A 196
 None
 0.92A 1qknA-2qvlA:
undetectable		 1qknA-2qvlA:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vmh FIBRONECTIN TYPE III
DOMAIN PROTEIN

(Clostridium
perfringens) 		PF08305
(NPCBM) 		5 LEU A1049
THR A1050
GLU A 905
ILE A 952
GLY A 951
 None
 0.86A 1qknA-2vmhA:
undetectable		 1qknA-2vmhA:
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.
2x7x SENSOR PROTEIN

(Bacteroides
thetaiotaomicron) 		PF13407
(Peripla_BP_4) 		5 ALA A 201
GLU A 204
LEU A 160
ILE A 247
GLY A 246
 None
 0.85A 1qknA-2x7xA:
undetectable		 1qknA-2x7xA:
22.02
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.
3byq UNCHARACTERIZED
PROTEIN DUF1185

(Bordetella
bronchiseptica) 		PF06684
(AA_synth) 		6 LEU A  62
THR A  61
ALA A  64
LEU A 165
ILE A   4
ILE A  37
 None
 1.48A 1qknA-3byqA:
undetectable		 1qknA-3byqA:
21.97
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.
3c87 ENTEROCHELIN
ESTERASE

(Shigella
flexneri) 		PF00756
(Esterase)
PF11806
(DUF3327) 		5 LEU A 258
ALA A 253
LEU A 175
ILE A 168
ILE A 169
 None
 0.97A 1qknA-3c87A:
undetectable		 1qknA-3c87A:
20.34
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.
3d1r FRUCTOSE-1,6-BISPHOS
PHATASE CLASS II
GLPX

(Escherichia
coli) 		PF03320
(FBPase_glpX) 		5 THR A  13
ALA A  16
ILE A  82
ILE A  53
GLY A  56
 None
 0.91A 1qknA-3d1rA:
undetectable		 1qknA-3d1rA:
20.74
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.
3d7n FLAVODOXIN,
WRBA-LIKE PROTEIN

(Agrobacterium
fabrum) 		PF03358
(FMN_red) 		5 ALA A  77
LEU A  52
ILE A  59
GLY A  95
LEU A 114
 None
 1.00A 1qknA-3d7nA:
undetectable		 1qknA-3d7nA:
21.13
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.
3dh9 THIOREDOXIN
REDUCTASE 1

(Drosophila
melanogaster) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ALA A 284
LEU A 282
LEU A 191
ILE A 242
GLY A 204
 None
 0.95A 1qknA-3dh9A:
undetectable		 1qknA-3dh9A:
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.
3dzu RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		5 ALA A 272
LEU A 309
ARG A 316
ILE A 345
LEU A 436
 9CR  A7223 (-4.2A)
9CR  A7223 ( 4.4A)
9CR  A7223 (-3.7A)
9CR  A7223 ( 4.9A)
9CR  A7223 ( 4.7A)
 0.98A 1qknA-3dzuA:
22.6		 1qknA-3dzuA:
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.
3dzu RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		5 ALA A 272
LEU A 309
ARG A 316
ILE A 428
GLY A 429
 9CR  A7223 (-4.2A)
9CR  A7223 ( 4.4A)
9CR  A7223 (-3.7A)
None
None
 0.94A 1qknA-3dzuA:
22.6		 1qknA-3dzuA:
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.
3g25 GLYCEROL KINASE

(Staphylococcus
aureus) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 LEU A 285
THR A 287
LEU A 271
ILE A 400
GLY A 258
 None
 1.00A 1qknA-3g25A:
undetectable		 1qknA-3g25A:
17.71
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.
3i4e ISOCITRATE LYASE

(Burkholderia
pseudomallei) 		PF00463
(ICL) 		5 LEU A 125
THR A 126
ILE A 151
GLY A  49
LEU A  45
 None
 0.71A 1qknA-3i4eA:
undetectable		 1qknA-3i4eA:
19.68
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.
3ksd GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
1

(Staphylococcus
aureus) 		no annotation 6 LEU Q 331
THR Q 327
ALA Q 329
LEU Q  27
ILE Q  90
LEU Q  94
 None
 1.44A 1qknA-3ksdQ:
undetectable		 1qknA-3ksdQ:
20.82
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.
3m9v FAD-DEPENDENT
OXIDOREDUCTASE

(Actinomadura
kijaniata) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 LEU A  86
ALA A  88
LEU A  14
GLY A  22
LEU A  25
 None
 0.95A 1qknA-3m9vA:
undetectable		 1qknA-3m9vA:
21.54
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.
3ne5 CATION EFFLUX SYSTEM
PROTEIN CUSA

(Escherichia
coli) 		PF00873
(ACR_tran) 		5 LEU A 864
ALA A 868
LEU A 467
ILE A 670
LEU A 562
 None
 0.99A 1qknA-3ne5A:
undetectable		 1qknA-3ne5A:
14.13
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.
3pay PUTATIVE ADHESIN

(Bacteroides
ovatus) 		PF08842
(Mfa2) 		5 THR A 271
LEU A 301
ILE A 324
GLY A 317
LEU A 327
 None
 0.82A 1qknA-3payA:
undetectable		 1qknA-3payA:
23.01
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.
3pfo PUTATIVE
ACETYLORNITHINE
DEACETYLASE

(Rhodopseudomonas
palustris) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 THR A 416
ALA A 154
LEU A 105
ILE A 199
GLY A 109
 None
 0.95A 1qknA-3pfoA:
undetectable		 1qknA-3pfoA:
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.
3rh3 UNCHARACTERIZED
DUF3829-LIKE PROTEIN

(Bacteroides
thetaiotaomicron) 		no annotation 5 LEU A 171
THR A 172
ALA A 175
GLU A 178
GLY A  99
 None
None
None
None
PEG  A 290 (-3.3A)
 0.85A 1qknA-3rh3A:
undetectable		 1qknA-3rh3A:
21.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wwx S12 FAMILY PEPTIDASE

(Streptomyces
sp. 82F2) 		PF00144
(Beta-lactamase) 		6 THR A  90
ALA A  93
LEU A  97
ARG A 132
GLY A 290
LEU A 287
 None
 1.41A 1qknA-3wwxA:
undetectable		 1qknA-3wwxA:
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.
4aut DECAPRENYL-PHOSPHORY
L-BETA-D-RIBOFURANOS
E-2-OXIDOREDUCTASE

(Mycolicibacterium
smegmatis) 		PF01565
(FAD_binding_4)
PF04030
(ALO) 		5 THR A  48
ALA A  51
ILE A  79
GLY A 189
LEU A 159
 None
 1.00A 1qknA-4autA:
undetectable		 1qknA-4autA:
20.26
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.
4e3c INHIBITOR OF NUCLEAR
FACTOR KAPPA-B
KINASE SUBUNIT BETA

(Homo sapiens) 		PF00069
(Pkinase) 		6 LEU A 125
THR A 124
ALA A 121
ILE A 151
GLY A 102
LEU A 153
 None
 1.41A 1qknA-4e3cA:
undetectable		 1qknA-4e3cA:
17.73
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.
4ga6 PUTATIVE THYMIDINE
PHOSPHORYLASE

(Thermococcus
kodakarensis) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C) 		5 LEU A 338
ALA A 340
LEU A 177
ILE A 394
ILE A 393
 None
 0.95A 1qknA-4ga6A:
undetectable		 1qknA-4ga6A:
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.
4hgk SHARK V-NAR ANTIBODY

(Squalus
acanthias) 		PF07686
(V-set) 		5 LEU C  87
THR C  38
LEU C 119
ILE C 101
GLY C 116
 None
 0.98A 1qknA-4hgkC:
undetectable		 1qknA-4hgkC:
15.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4j5x RETINOIC ACID
RECEPTOR RXR-ALPHA,
NUCLEAR RECEPTOR
COACTIVATOR 1

(Homo sapiens) 		no annotation 6 ALA D 272
LEU D 309
ARG D 316
ILE D 345
ILE D 428
GLY D 429
 None
 1.01A 1qknA-4j5xD:
23.1		 1qknA-4j5xD:
30.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jz6 SALICYLALDEHYDE
DEHYDROGENASE NAHF

(Pseudomonas
putida) 		PF00171
(Aldedh) 		5 LEU A  95
ALA A  97
ILE A 323
ILE A 324
GLY A 325
 None
 1.00A 1qknA-4jz6A:
undetectable		 1qknA-4jz6A:
19.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k26 CORTICOSTEROID
11-BETA-DEHYDROGENAS
E ISOZYME 1

(Mus musculus) 		PF00106
(adh_short) 		5 LEU A  54
ALA A  83
ILE A 117
ILE A  38
LEU A  63
 None
 0.97A 1qknA-4k26A:
undetectable		 1qknA-4k26A:
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.
4kpr THIOREDOXIN
REDUCTASE 1,
CYTOPLASMIC

(Rattus
norvegicus) 		no annotation 5 ALA E 290
LEU E 288
LEU E 194
ILE E 245
GLY E 207
 None
 0.97A 1qknA-4kprE:
undetectable		 1qknA-4kprE:
18.44
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.
4kzk L-ARABINOSE ABC
TRANSPORTER,
PERIPLASMIC
L-ARABINOSE-BINDING
PROTEIN

(Burkholderia
thailandensis) 		PF00532
(Peripla_BP_1) 		5 THR A 209
ALA A 212
LEU A 170
ILE A 261
GLY A 260
 None
 0.93A 1qknA-4kzkA:
undetectable		 1qknA-4kzkA:
20.52
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.
4m1z MEMBRANE-ANCHORED
MYCOSIN MYCP1

(Mycolicibacterium
smegmatis) 		PF00082
(Peptidase_S8) 		5 ALA A 301
LEU A 278
ILE A 130
ILE A 131
GLY A 342
 None
 0.95A 1qknA-4m1zA:
undetectable		 1qknA-4m1zA:
20.83
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) 		7 LEU A 283
ALA A 287
GLU A 290
MET A 321
LEU A 324
ARG A 331
GLY A 447
 None
 0.60A 1qknA-4n1yA:
27.0		 1qknA-4n1yA:
39.15
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 LEU A 283
MET A 321
ARG A 331
ILE A 361
GLY A 447
 None
 0.83A 1qknA-4n1yA:
27.0		 1qknA-4n1yA:
39.15
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.
4n75 OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTOR BAMA

(Escherichia
coli) 		PF01103
(Bac_surface_Ag) 		5 THR A 617
GLU A 717
ARG A 661
GLY A 584
LEU A 581
 None
 0.99A 1qknA-4n75A:
undetectable		 1qknA-4n75A:
18.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q48 DNA HELICASE RECQ

(Deinococcus
radiodurans) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF09382
(RQC)
PF16124
(RecQ_Zn_bind) 		5 LEU A 179
THR A 180
ALA A 147
LEU A 195
ILE A  32
 None
 0.86A 1qknA-4q48A:
undetectable		 1qknA-4q48A:
19.58
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.
4rp8 ASCORBATE-SPECIFIC
PERMEASE IIC
COMPONENT ULAA

(Escherichia
coli) 		PF03611
(EIIC-GAT) 		6 LEU A 165
THR A 162
ALA A 163
LEU A 114
ILE A 172
GLY A 171
 None
 1.41A 1qknA-4rp8A:
undetectable		 1qknA-4rp8A:
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.
4s3n 2'-5'-OLIGOADENYLATE
SYNTHASE 3

(Homo sapiens) 		PF10421
(OAS1_C) 		5 LEU A 232
THR A 233
ALA A 236
LEU A 345
LEU A 353
 None
 0.91A 1qknA-4s3nA:
undetectable		 1qknA-4s3nA:
21.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4udb MINERALOCORTICOID
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 LEU A 769
ALA A 773
MET A 807
LEU A 810
LEU A 814
ARG A 817
 CV7  A1987 (-4.1A)
CV7  A1987 (-3.5A)
CV7  A1987 ( 3.9A)
CV7  A1987 (-4.0A)
CV7  A1987 ( 4.0A)
CV7  A1987 (-3.7A)
 0.48A 1qknA-4udbA:
24.7		 1qknA-4udbA:
29.21
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.
4yfa PROTEIN RELATED TO
PENICILLIN ACYLASE

(Acidovorax sp.
MR-S7) 		PF01804
(Penicil_amidase) 		5 ALA A  98
GLU A  97
ILE A 172
ILE C 151
LEU A 161
 None
 0.98A 1qknA-4yfaA:
undetectable		 1qknA-4yfaA:
17.25
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.
4zwl BETAINE-ALDEHYDE
DEHYDROGENASE

(Staphylococcus
aureus) 		PF00171
(Aldedh) 		5 LEU A 187
THR A 188
GLU A 194
ILE A  37
GLY A   0
 None
 0.93A 1qknA-4zwlA:
undetectable		 1qknA-4zwlA:
19.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c9i PROTEIN RELATED TO
PENICILLIN ACYLASE

(Acidovorax sp.
MR-S7) 		PF01804
(Penicil_amidase) 		5 ALA A  98
GLU A  97
ILE A 172
ILE A 353
LEU A 161
 None
 0.92A 1qknA-5c9iA:
undetectable		 1qknA-5c9iA:
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.
5dcq ARTIFICIAL REPEAT
PROTEINS (ALPHAREP3)

(synthetic
construct) 		PF03130
(HEAT_PBS)
PF13646
(HEAT_2) 		6 THR A  35
ALA A  34
LEU A  49
LEU A  53
ILE A 102
GLY A  72
 None
 1.49A 1qknA-5dcqA:
undetectable		 1qknA-5dcqA:
22.05
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.
5epe SAM-DEPENDENT
METHYLTRANSFERASE

(Thiobacillus
denitrificans) 		PF13847
(Methyltransf_31) 		5 LEU A 125
THR A 124
ALA A 127
LEU A  41
ILE A 115
 None
None
None
None
SAH  A 301 (-4.7A)
 0.92A 1qknA-5epeA:
undetectable		 1qknA-5epeA:
23.32
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.
5exe OXALATE
OXIDOREDUCTASE
SUBUNIT DELTA

(Moorella
thermoacetica) 		PF00037
(Fer4)
PF01558
(POR) 		5 LEU B  35
THR B  36
ALA B  39
GLU B  42
ILE B  87
 None
 0.73A 1qknA-5exeB:
undetectable		 1qknA-5exeB:
21.11
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.
5guh PIWI

(Bombyx mori) 		PF02170
(PAZ)
PF02171
(Piwi) 		5 LEU A 596
LEU A 568
ILE A 552
ILE A 553
LEU A 530
 None
 0.95A 1qknA-5guhA:
undetectable		 1qknA-5guhA:
14.45
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.
5ihv BETA-LACTAMASE

(Burkholderia
ambifaria) 		PF13354
(Beta-lactamase2) 		5 THR A 126
ALA A 129
MET A 163
LEU A 166
LEU A  45
 EDO  A 301 (-3.4A)
None
None
None
None
 0.94A 1qknA-5ihvA:
undetectable		 1qknA-5ihvA:
20.36
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.
5iq0 ESTERASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 THR A 211
ALA A 214
GLU A 217
ARG A  95
LEU A 195
 None
 0.97A 1qknA-5iq0A:
undetectable		 1qknA-5iq0A:
22.43
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.
5ltm PHENYLALANINE
AMMONIA LYASE

(Anabaena) 		no annotation 5 LEU B 242
THR B 243
ALA B 246
LEU B 386
ILE B 471
 None
 0.97A 1qknA-5ltmB:
undetectable		 1qknA-5ltmB:
18.34
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.
5mwp MINERALOCORTICOID
RECEPTOR

(Homo sapiens) 		no annotation 5 LEU A 769
ALA A 773
MET A 807
LEU A 814
ARG A 817
 ECV  A1101 (-4.7A)
ECV  A1101 (-3.8A)
ECV  A1101 (-3.6A)
ECV  A1101 (-4.1A)
ECV  A1101 (-4.0A)
 0.32A 1qknA-5mwpA:
24.6		 1qknA-5mwpA:
11.95
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.
5nfh METHIONYL-TRNA
SYNTHETASE, PUTATIVE

(Trypanosoma
brucei) 		no annotation 6 THR A 651
ALA A 652
LEU A 712
LEU A 713
ILE A 675
GLY A 705
 None
 1.48A 1qknA-5nfhA:
undetectable		 1qknA-5nfhA:
19.19
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.
5o9e PUTATIVE U3 SMALL
NUCLEOLAR
RIBONUCLEOPROTEIN
PUTATIVE U3 SMALL
NUCLEOLAR
RIBONUCLEOPROTEIN
PROTEIN

(Chaetomium
thermophilum) 		PF04427
(Brix)
no annotation 		6 LEU A 200
GLU B 505
LEU B 502
ILE A 268
GLY B 518
LEU B 517
 None
 1.22A 1qknA-5o9eA:
undetectable		 1qknA-5o9eA:
22.91
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.
5o9e PUTATIVE U3 SMALL
NUCLEOLAR
RIBONUCLEOPROTEIN
PUTATIVE U3 SMALL
NUCLEOLAR
RIBONUCLEOPROTEIN
PROTEIN

(Chaetomium
thermophilum) 		PF04427
(Brix)
no annotation 		6 LEU A 200
THR A 198
LEU B 502
ILE A 268
GLY B 518
LEU B 517
 None
 1.49A 1qknA-5o9eA:
undetectable		 1qknA-5o9eA:
22.91
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) 		11 LEU A 298
THR A 299
ALA A 302
GLU A 305
MET A 336
LEU A 339
LEU A 343
ARG A 346
ILE A 373
ILE A 376
GLY A 472
 EST  A 601 (-4.1A)
None
EST  A 601 ( 3.9A)
EST  A 601 (-2.4A)
EST  A 601 ( 3.7A)
EST  A 601 (-3.9A)
EST  A 601 ( 4.4A)
EST  A 601 (-4.1A)
None
EST  A 601 ( 4.4A)
EST  A 601 (-4.0A)
 0.59A 1qknA-5toaA:
31.1		 1qknA-5toaA:
89.41
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) 		11 LEU A 298
THR A 299
ALA A 302
GLU A 305
MET A 336
LEU A 339
LEU A 343
ARG A 346
ILE A 376
GLY A 472
LEU A 476
 EST  A 601 (-4.1A)
None
EST  A 601 ( 3.9A)
EST  A 601 (-2.4A)
EST  A 601 ( 3.7A)
EST  A 601 (-3.9A)
EST  A 601 ( 4.4A)
EST  A 601 (-4.1A)
EST  A 601 ( 4.4A)
EST  A 601 (-4.0A)
EST  A 601 (-3.5A)
 0.72A 1qknA-5toaA:
31.1		 1qknA-5toaA:
89.41
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) 		5 THR A 299
ALA A 302
GLU A 305
ARG A 346
ILE A 376
 None
EST  A 601 ( 3.9A)
EST  A 601 (-2.4A)
EST  A 601 (-4.1A)
EST  A 601 ( 4.4A)
 0.91A 1qknA-5toaA:
31.1		 1qknA-5toaA:
89.41
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.
5uak CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Homo sapiens) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane)
PF14396
(CFTR_R) 		5 LEU A1388
THR A1387
ILE A1289
GLY A1349
LEU A1353
 None
 1.01A 1qknA-5uakA:
2.2		 1qknA-5uakA:
10.96
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.
5x5t ALPHA-KETOGLUTARIC
SEMIALDEHYDE
DEHYDROGENASE

(Azospirillum
brasilense) 		PF00171
(Aldedh) 		5 ALA A 401
LEU A 294
ILE A 438
GLY A 414
LEU A 431
 None
 0.99A 1qknA-5x5tA:
undetectable		 1qknA-5x5tA:
19.67
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.
5zbk PUTATIVE CYTOKININ
RIBOSIDE
5'-MONOPHOSPHATE
PHOSPHORIBOHYDROLASE

(Pseudomonas
aeruginosa) 		no annotation 5 THR A 112
ALA A 115
GLU A 118
MET A  96
ILE A  66
 AMP  A 304 (-3.6A)
None
None
None
None
 0.95A 1qknA-5zbkA:
undetectable		 1qknA-5zbkA:
15.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5zov -

(-) 		no annotation 6 LEU A 165
THR A 162
ALA A 163
LEU A 114
ILE A 172
GLY A 171
 None
 1.44A 1qknA-5zovA:
undetectable		 1qknA-5zovA:
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.
6dw1 -

(-) 		no annotation 6 LEU E  59
THR E  58
ALA E 134
LEU E 210
ILE E 181
ILE E 188
 None
 1.31A 1qknA-6dw1E:
undetectable		 1qknA-6dw1E:
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.
1aei ANNEXIN XII

(Hydra vulgaris) 		PF00191
(Annexin) 		3 ASP A 278
LEU A 279
HIS A 255
 None
 0.78A 1qknA-1aeiA:
0.0		 1qknA-1aeiA:
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.
1aor ALDEHYDE FERREDOXIN
OXIDOREDUCTASE

(Pyrococcus
furiosus) 		PF01314
(AFOR_C)
PF02730
(AFOR_N) 		3 ASP A 365
LEU A 368
HIS A 412
 None
 0.65A 1qknA-1aorA:
undetectable		 1qknA-1aorA:
17.43
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.
1ddh MHC CLASS I H-2DD
HEAVY CHAIN

(Mus musculus) 		PF00129
(MHC_I)
PF07654
(C1-set) 		3 ASP A 102
LEU A 110
HIS A 263
 None
 0.78A 1qknA-1ddhA:
0.0		 1qknA-1ddhA:
21.28
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.
1fvf SEC1

(Doryteuthis
pealeii) 		PF00995
(Sec1) 		3 ASP A 231
LEU A 230
HIS A 462
 None
 0.70A 1qknA-1fvfA:
0.0		 1qknA-1fvfA:
18.54
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.
1gk2 HISTIDINE
AMMONIA-LYASE

(Pseudomonas
putida) 		PF00221
(Lyase_aromatic) 		3 ASP A 145
LEU A 149
HIS A  19
 None
 0.78A 1qknA-1gk2A:
1.6		 1qknA-1gk2A:
21.58
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.
1idt MINOR FMN-DEPENDENT
NITROREDUCTASE

(Escherichia
coli) 		PF00881
(Nitroreductase) 		3 ASP A  92
LEU A  95
HIS A 133
 None
 0.72A 1qknA-1idtA:
0.0		 1qknA-1idtA:
24.82
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.
1iqc DI-HEME PEROXIDASE

(Nitrosomonas
europaea) 		PF00034
(Cytochrom_C)
PF03150
(CCP_MauG) 		3 ASP A 157
LEU A 160
HIS A 187
 None
None
HEM  A 402 (-3.3A)
 0.74A 1qknA-1iqcA:
0.0		 1qknA-1iqcA:
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.
1j3b ATP-DEPENDENT
PHOSPHOENOLPYRUVATE
CARBOXYKINASE

(Thermus
thermophilus) 		PF01293
(PEPCK_ATP) 		3 ASP A 103
LEU A 104
HIS A  27
 None
 0.70A 1qknA-1j3bA:
0.0		 1qknA-1j3bA:
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.
1jdi L-RIBULOSE 5
PHOSPHATE
4-EPIMERASE

(Escherichia
coli) 		PF00596
(Aldolase_II) 		3 ASP A   4
LEU A   5
HIS A 185
 None
 0.72A 1qknA-1jdiA:
0.0		 1qknA-1jdiA:
22.30
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.
1o50 CBS
DOMAIN-CONTAINING
PREDICTED PROTEIN
TM0935

(Thermotoga
maritima) 		PF00571
(CBS) 		3 ASP A  28
LEU A  31
HIS A  63
 None
 0.72A 1qknA-1o50A:
undetectable		 1qknA-1o50A:
25.23
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.
1ovm INDOLE-3-PYRUVATE
DECARBOXYLASE

(Enterobacter
cloacae) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		3 ASP A 150
LEU A 153
HIS A  37
 None
 0.62A 1qknA-1ovmA:
undetectable		 1qknA-1ovmA:
17.77
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.
1rz6 CYTOCHROME C
PEROXIDASE

(Marinobacter
hydrocarbonoclasticus) 		PF00034
(Cytochrom_C)
PF03150
(CCP_MauG) 		3 ASP A 171
LEU A 174
HIS A 201
 None
None
HEM  A 402 (-3.2A)
 0.70A 1qknA-1rz6A:
undetectable		 1qknA-1rz6A:
21.73
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.
1vc9 NDX1

(Thermus
thermophilus) 		PF00293
(NUDIX) 		3 ASP A 113
LEU A 116
HIS A  32
 ATP  A1001 ( 4.9A)
None
ATP  A1001 ( 4.2A)
 0.64A 1qknA-1vc9A:
undetectable		 1qknA-1vc9A:
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.
1vzo RIBOSOMAL PROTEIN S6
KINASE ALPHA 5

(Homo sapiens) 		PF00069
(Pkinase) 		3 ASP A 132
LEU A 131
HIS A 107
 None
 0.77A 1qknA-1vzoA:
undetectable		 1qknA-1vzoA:
21.37
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.
1xdn RNA EDITING LIGASE
MP52

(Trypanosoma
brucei) 		PF09414
(RNA_ligase) 		3 ASP A 252
LEU A 255
HIS A 300
 None
 0.60A 1qknA-1xdnA:
undetectable		 1qknA-1xdnA:
21.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1y1u SIGNAL TRANSDUCER
AND ACTIVATOR OF
TRANSCRIPTION 5A

(Mus musculus) 		PF00017
(SH2)
PF01017
(STAT_alpha)
PF02864
(STAT_bind) 		3 ASP A 605
LEU A 606
HIS A 544
 None
 0.77A 1qknA-1y1uA:
undetectable		 1qknA-1y1uA:
19.48
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.
1zb1 BRO1 PROTEIN

(Saccharomyces
cerevisiae) 		PF03097
(BRO1) 		3 ASP A  48
LEU A  47
HIS A 111
 None
 0.67A 1qknA-1zb1A:
undetectable		 1qknA-1zb1A:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zoi ESTERASE

(Pseudomonas
putida) 		PF00561
(Abhydrolase_1) 		3 ASP A  39
LEU A  42
HIS A  60
 None
 0.77A 1qknA-1zoiA:
undetectable		 1qknA-1zoiA:
19.60
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.
1zzh CYTOCHROME C
PEROXIDASE

(Rhodobacter
capsulatus) 		PF00034
(Cytochrom_C)
PF03150
(CCP_MauG) 		3 ASP A 174
LEU A 177
HIS A 204
 None
None
HEC  A 803 (-3.3A)
 0.69A 1qknA-1zzhA:
undetectable		 1qknA-1zzhA:
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.
2a35 HYPOTHETICAL PROTEIN
PA4017

(Pseudomonas
aeruginosa) 		PF08732
(HIM1) 		3 ASP A  63
LEU A  62
HIS A  45
 None
 0.79A 1qknA-2a35A:
undetectable		 1qknA-2a35A:
25.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c1u DI-HAEM CYTOCHROME C
PEROXIDASE

(Paracoccus
pantotrophus) 		PF00034
(Cytochrom_C)
PF03150
(CCP_MauG) 		3 ASP A 185
LEU A 188
HIS A 215
 None
None
HEC  A 402 (-3.2A)
 0.62A 1qknA-2c1uA:
undetectable		 1qknA-2c1uA:
20.41
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.
2czr TBP-INTERACTING
PROTEIN

(Thermococcus
kodakarensis) 		PF15517
(TBPIP_N) 		3 ASP A  21
LEU A  19
HIS A 130
 None
 0.74A 1qknA-2czrA:
undetectable		 1qknA-2czrA:
20.76
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.
2d9j REGULATOR OF
G-PROTEIN SIGNALLING
7

(Homo sapiens) 		PF00615
(RGS) 		3 ASP A  20
LEU A  23
HIS A 110
 None
 0.66A 1qknA-2d9jA:
undetectable		 1qknA-2d9jA:
20.23
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.
2fiy PROTEIN FDHE HOMOLOG

(Pseudomonas
aeruginosa) 		PF04216
(FdhE) 		3 ASP A 293
LEU A 290
HIS A 233
 None
 0.69A 1qknA-2fiyA:
undetectable		 1qknA-2fiyA:
23.56
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.
2gca FOLYLPOLYGLUTAMATE
SYNTHASE

(Lactobacillus
casei) 		PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		3 ASP A 306
LEU A 309
HIS A 234
 None
 0.64A 1qknA-2gcaA:
undetectable		 1qknA-2gcaA:
21.23
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) 		3 ASP A 273
LEU A 276
HIS A 434
 OHT  A 500 (-3.1A)
OHT  A 500 (-4.9A)
OHT  A 500 ( 4.7A)
 0.43A 1qknA-2gpvA:
27.6		 1qknA-2gpvA:
33.60
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.
2hne L-FUCONATE
DEHYDRATASE

(Xanthomonas
campestris) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 ASP A  46
LEU A  47
HIS A 363
 None
 0.75A 1qknA-2hneA:
undetectable		 1qknA-2hneA:
19.33
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.
2hpa PROTEIN (ACID
PHOSPHATASE)

(Homo sapiens) 		PF00328
(His_Phos_2) 		3 ASP A1119
LEU A1116
HIS A1046
 None
 0.71A 1qknA-2hpaA:
undetectable		 1qknA-2hpaA:
22.90
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.
2inc TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT
TOUB PROTEIN

(Pseudomonas
stutzeri) 		PF02332
(Phenol_Hydrox)
PF04945
(YHS)
PF06234
(TmoB) 		3 ASP A 452
LEU A 455
HIS C  56
 None
 0.74A 1qknA-2incA:
1.9		 1qknA-2incA:
19.92
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.
2pbg 6-PHOSPHO-BETA-D-GAL
ACTOSIDASE

(Lactococcus
lactis) 		PF00232
(Glyco_hydro_1) 		3 ASP A  59
LEU A  60
HIS A 116
 None
 0.79A 1qknA-2pbgA:
undetectable		 1qknA-2pbgA:
20.28
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.
2pbk KSHV PROTEASE

(Human
gammaherpesvirus
8) 		PF00716
(Peptidase_S21) 		3 ASP A 216
LEU A 213
HIS A  46
 None
 0.71A 1qknA-2pbkA:
undetectable		 1qknA-2pbkA:
24.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2r01 NITROREDUCTASE
FAMILY PROTEIN

(Chlorobaculum
tepidum) 		PF00881
(Nitroreductase) 		3 ASP A  35
LEU A  38
HIS A  30
 None
 0.49A 1qknA-2r01A:
undetectable		 1qknA-2r01A:
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.
2r8r SENSOR PROTEIN

(Pseudomonas
syringae group
genomosp. 3) 		PF02702
(KdpD) 		3 ASP A  75
LEU A  78
HIS A  92
 None
 0.70A 1qknA-2r8rA:
undetectable		 1qknA-2r8rA:
24.19
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.
2x9o 15,16-DIHYDROBILIVER
DIN-FERREDOXIN
OXIDOREDUCTASE

(Synechococcus
sp. WH 8020) 		PF05996
(Fe_bilin_red) 		3 ASP A   3
LEU A   6
HIS A 214
 None
 0.77A 1qknA-2x9oA:
undetectable		 1qknA-2x9oA:
21.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xj6 ASCORBATE PEROXIDASE

(Glycine max) 		PF00141
(peroxidase) 		3 ASP A 155
LEU A 159
HIS A 116
 None
HEM  A1001 (-4.0A)
None
 0.74A 1qknA-2xj6A:
undetectable		 1qknA-2xj6A:
20.28
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.
3b0p TRNA-DIHYDROURIDINE
SYNTHASE

(Thermus
thermophilus) 		PF01207
(Dus) 		3 ASP A 306
LEU A 309
HIS A  18
 None
 0.76A 1qknA-3b0pA:
undetectable		 1qknA-3b0pA:
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.
3bzm MENAQUINONE-SPECIFIC
ISOCHORISMATE
SYNTHASE

(Escherichia
coli) 		PF00425
(Chorismate_bind) 		3 ASP A  91
LEU A  92
HIS A  14
 None
 0.74A 1qknA-3bzmA:
undetectable		 1qknA-3bzmA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e79 HIGH AFFINITY
TRANSPORT SYSTEM
PROTEIN P37

(Mycoplasma
hyorhinis) 		PF06646
(Mycoplasma_p37) 		3 ASP A 280
LEU A 277
HIS A 303
 None
 0.52A 1qknA-3e79A:
undetectable		 1qknA-3e79A:
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.
3fsg ALPHA/BETA
SUPERFAMILY
HYDROLASE

(Oenococcus oeni) 		PF12697
(Abhydrolase_6) 		3 ASP A 259
LEU A 262
HIS A  93
 None
 0.67A 1qknA-3fsgA:
undetectable		 1qknA-3fsgA:
22.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3glg DNA POLYMERASE III
SUBUNIT DELTA'

(Escherichia
coli) 		PF09115
(DNApol3-delta_C)
PF13177
(DNA_pol3_delta2) 		3 ASP E 314
LEU E 311
HIS E 333
 None
 0.69A 1qknA-3glgE:
undetectable		 1qknA-3glgE:
23.24
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.
3gn6 CT0912, ORFAN
PROTEIN WITH A
FERREDOXIN-LIKE
DOMAIN REPEAT

(Chlorobaculum
tepidum) 		no annotation 3 ASP A  26
LEU A  29
HIS A 141
 None
 0.79A 1qknA-3gn6A:
undetectable		 1qknA-3gn6A:
21.68
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.
3h04 UNCHARACTERIZED
PROTEIN

(Staphylococcus
aureus) 		PF07859
(Abhydrolase_3) 		3 ASP A  47
LEU A  48
HIS A 216
 None
 0.63A 1qknA-3h04A:
undetectable		 1qknA-3h04A:
20.95
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.
3h5q PYRIMIDINE-NUCLEOSID
E PHOSPHORYLASE

(Staphylococcus
aureus) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C) 		3 ASP A 267
LEU A 268
HIS A 116
 SO4  A 435 (-3.9A)
None
None
 0.77A 1qknA-3h5qA:
undetectable		 1qknA-3h5qA:
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.
3hag CAPSID PROTEIN

(Orthohepevirus
A) 		PF03014
(SP2) 		3 ASP A 515
LEU A 514
HIS A 604
 None
 0.53A 1qknA-3hagA:
undetectable		 1qknA-3hagA:
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.
3hkz DNA-DIRECTED RNA
POLYMERASE SUBUNIT
A'
DNA-DIRECTED RNA
POLYMERASE SUBUNIT B

(Sulfolobus
solfataricus) 		PF00562
(RNA_pol_Rpb2_6)
PF00623
(RNA_pol_Rpb1_2)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		3 ASP A 720
LEU A 719
HIS B 913
 None
 0.77A 1qknA-3hkzA:
undetectable		 1qknA-3hkzA:
15.28
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.
3hpf MUCONATE
CYCLOISOMERASE

(Oceanobacillus
iheyensis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 ASP A 172
LEU A 169
HIS A 196
 None
 0.67A 1qknA-3hpfA:
undetectable		 1qknA-3hpfA:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hq9 CYTOCHROME C551
PEROXIDASE

(Geobacter
sulfurreducens) 		PF00034
(Cytochrom_C)
PF03150
(CCP_MauG) 		3 ASP A 193
LEU A 196
HIS A 223
 None
None
HEM  A 401 (-3.2A)
 0.74A 1qknA-3hq9A:
undetectable		 1qknA-3hq9A:
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.
3hs0 COBRA VENOM FACTOR

(Naja kaouthia) 		PF01835
(A2M_N)
PF07703
(A2M_N_2) 		3 ASP A 157
LEU A 158
HIS A 183
 None
 0.73A 1qknA-3hs0A:
undetectable		 1qknA-3hs0A:
19.36
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.
3itw PROTEIN TIOX

(Micromonospora
sp. ML1) 		PF00903
(Glyoxalase) 		3 ASP A 108
LEU A 109
HIS A  37
 None
 0.54A 1qknA-3itwA:
undetectable		 1qknA-3itwA:
18.25
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.
3jb9 PRE-MRNA-PROCESSING
PROTEIN 45

(Schizosaccharomyces
pombe) 		PF02731
(SKIP_SNW) 		3 ASP M 123
LEU M 234
HIS M 113
 None
 0.75A 1qknA-3jb9M:
undetectable		 1qknA-3jb9M:
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.
3jro NUCLEOPORIN NUP84

(Saccharomyces
cerevisiae) 		PF04121
(Nup84_Nup100) 		3 ASP C  52
LEU C  53
HIS C 391
 None
 0.69A 1qknA-3jroC:
undetectable		 1qknA-3jroC:
22.51
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.
3kn5 RIBOSOMAL PROTEIN S6
KINASE ALPHA-5

(Homo sapiens) 		PF00069
(Pkinase) 		3 ASP A 426
LEU A 425
HIS A 485
 None
 0.79A 1qknA-3kn5A:
undetectable		 1qknA-3kn5A:
21.92
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.
3l3p IPAH9.8

(Shigella
flexneri) 		PF14496
(NEL) 		3 ASP A 291
LEU A 290
HIS A 279
 None
 0.74A 1qknA-3l3pA:
3.9		 1qknA-3l3pA:
23.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3max HISTONE DEACETYLASE
2

(Homo sapiens) 		PF00850
(Hist_deacetyl) 		3 ASP A 274
LEU A 276
HIS A  38
 None
LLX  A 400 (-4.3A)
None
 0.78A 1qknA-3maxA:
undetectable		 1qknA-3maxA:
20.22
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.
3myx UNCHARACTERIZED
PROTEIN PSPTO_0244

(Pseudomonas
syringae group
genomosp. 3) 		PF05899
(Cupin_3) 		3 ASP A 161
LEU A 166
HIS A  29
 None
 0.67A 1qknA-3myxA:
undetectable		 1qknA-3myxA:
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.
3nnm CURA

(Lyngbya
majuscula) 		PF05721
(PhyH) 		3 ASP A 166
LEU A 169
HIS A  99
 None
None
FMT  A 750 (-4.3A)
 0.69A 1qknA-3nnmA:
undetectable		 1qknA-3nnmA:
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.
3npi TETR FAMILY
REGULATORY PROTEIN

(Corynebacterium
diphtheriae) 		PF00440
(TetR_N) 		3 ASP A  24
LEU A  27
HIS A 103
 None
 0.71A 1qknA-3npiA:
undetectable		 1qknA-3npiA:
21.11
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.
3q3q ALKALINE PHOSPHATASE

(Sphingomonas
sp. BSAR-1) 		PF01663
(Phosphodiest) 		3 ASP A 399
LEU A 469
HIS A 346
 None
GOL  A8002 ( 4.8A)
ZN  A1559 ( 3.2A)
 0.59A 1qknA-3q3qA:
undetectable		 1qknA-3q3qA:
17.91
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.
3qi6 CYSTATHIONINE
GAMMA-SYNTHASE METB
(CGS)

(Mycobacterium
ulcerans) 		PF01053
(Cys_Met_Meta_PP) 		3 ASP A  91
LEU A  94
HIS A 352
 None
None
SO4  A 390 (-4.0A)
 0.66A 1qknA-3qi6A:
undetectable		 1qknA-3qi6A:
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.
3qpl HTH-TYPE
TRANSCRIPTIONAL
REGULATOR ETHR

(Mycobacterium
tuberculosis) 		PF00440
(TetR_N) 		3 ASP A  84
LEU A  87
HIS A 169
 None
 0.78A 1qknA-3qplA:
undetectable		 1qknA-3qplA:
20.79
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.
3qpx FAB C2507 HEAVY
CHAIN
FAB C2507 LIGHT
CHAIN

(Homo sapiens;
Rattus
norvegicus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 ASP L 121
LEU L 124
HIS H 227
 None
None
CD  H 239 ( 3.6A)
 0.79A 1qknA-3qpxL:
undetectable		 1qknA-3qpxL:
22.93
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.
3qtg PYRUVATE KINASE

(Pyrobaculum
aerophilum) 		PF00224
(PK)
PF02887
(PK_C) 		3 ASP A 307
LEU A 290
HIS A 275
 None
 0.68A 1qknA-3qtgA:
undetectable		 1qknA-3qtgA:
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.
3rgw MEMBRANE-BOUND
HYDROGENASE (NIFE)
LARGE SUBUNIT HOXG

(Cupriavidus
necator) 		PF00374
(NiFeSe_Hases) 		3 ASP L 117
LEU L 113
HIS L 603
 None
None
MG  L1005 (-3.4A)
 0.77A 1qknA-3rgwL:
undetectable		 1qknA-3rgwL:
18.97
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.
3rip GAMMA-TUBULIN
COMPLEX COMPONENT 4

(Homo sapiens) 		PF04130
(Spc97_Spc98) 		3 ASP A 561
LEU A 564
HIS A 463
 None
 0.70A 1qknA-3ripA:
undetectable		 1qknA-3ripA:
18.10
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.
3s6b METHIONINE
AMINOPEPTIDASE

(Plasmodium
falciparum) 		PF00557
(Peptidase_M24) 		3 ASP A 204
LEU A 205
HIS A 144
 FE  A 370 (-3.0A)
None
None
 0.68A 1qknA-3s6bA:
undetectable		 1qknA-3s6bA:
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.
3t02 PHOSPHONOACETATE
HYDROLASE

(Sinorhizobium
meliloti) 		PF01663
(Phosphodiest) 		3 ASP A  37
LEU A  36
HIS A  61
 None
 0.72A 1qknA-3t02A:
undetectable		 1qknA-3t02A:
19.31
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.
3uaq LBPB B-LOBE

(Moraxella bovis) 		PF01298
(TbpB_B_D)
PF17484
(TbpB_A) 		3 ASP A 182
LEU A  82
HIS A 236
 None
 0.79A 1qknA-3uaqA:
undetectable		 1qknA-3uaqA:
21.47
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.
3ugv ENOLASE

(alpha
proteobacterium
BAL199) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 ASP A 330
LEU A 333
HIS A 304
 None
None
MG  A 500 ( 4.9A)
 0.69A 1qknA-3ugvA:
undetectable		 1qknA-3ugvA:
20.26
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.
3vis ESTERASE

(Thermobifida
alba) 		PF12740
(Chlorophyllase2) 		3 ASP A 290
LEU A 242
HIS A 116
 None
 0.78A 1qknA-3visA:
undetectable		 1qknA-3visA:
21.36
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.
4amc GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		3 ASP A1750
LEU A1749
HIS A1692
 None
 0.63A 1qknA-4amcA:
undetectable		 1qknA-4amcA:
13.40
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.
4b3k BETA-GLUCOSIDASE

(Streptococcus
pyogenes) 		PF00232
(Glyco_hydro_1) 		3 ASP A  61
LEU A  62
HIS A 119
 None
 0.73A 1qknA-4b3kA:
undetectable		 1qknA-4b3kA:
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.
4bc7 ALKYLDIHYDROXYACETON
EPHOSPHATE SYNTHASE,
PEROXISOMAL

(Cavia porcellus) 		PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C) 		3 ASP A 516
LEU A 519
HIS A 617
 None
 0.63A 1qknA-4bc7A:
undetectable		 1qknA-4bc7A:
16.88
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.
4bkx HISTONE DEACETYLASE
1

(Homo sapiens) 		PF00850
(Hist_deacetyl) 		3 ASP B 269
LEU B 271
HIS B  33
 None
 0.79A 1qknA-4bkxB:
undetectable		 1qknA-4bkxB:
17.81
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.
4ckm SAS-6

(Leishmania
major) 		PF16531
(SAS-6_N) 		3 ASP A 179
LEU A 155
HIS A 148
 None
 0.71A 1qknA-4ckmA:
undetectable		 1qknA-4ckmA:
21.54
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.
4crm EUKARYOTIC PEPTIDE
CHAIN RELEASE FACTOR
SUBUNIT 1

(Saccharomyces
cerevisiae) 		PF03464
(eRF1_2)
PF03465
(eRF1_3) 		3 ASP X 240
LEU X 243
HIS X 167
 None
 0.79A 1qknA-4crmX:
undetectable		 1qknA-4crmX:
18.45
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.
4d72 GLYCOSIDE HYDROLASE

(Streptococcus
pneumoniae) 		PF08306
(Glyco_hydro_98M)
PF08307
(Glyco_hydro_98C) 		3 ASP A 657
LEU A 655
HIS A 530
 None
None
NAG  A2009 ( 4.4A)
 0.78A 1qknA-4d72A:
undetectable		 1qknA-4d72A:
17.33
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.
4dgq NON-HEME
CHLOROPEROXIDASE

(Burkholderia
cenocepacia) 		PF00561
(Abhydrolase_1) 		3 ASP A  39
LEU A  42
HIS A  60
 None
 0.77A 1qknA-4dgqA:
undetectable		 1qknA-4dgqA:
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.
4ezi UNCHARACTERIZED
PROTEIN

(Legionella
pneumophila) 		no annotation 3 ASP A 288
LEU A 291
HIS A 381
 None
 0.60A 1qknA-4eziA:
undetectable		 1qknA-4eziA:
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.
4fdd TRANSPORTIN-1

(Homo sapiens) 		PF03810
(IBN_N)
PF13513
(HEAT_EZ) 		3 ASP A 646
LEU A 647
HIS A 554
 None
 0.76A 1qknA-4fddA:
undetectable		 1qknA-4fddA:
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.
4fuk METHIONINE
AMINOPEPTIDASE

(Trypanosoma
brucei) 		PF00557
(Peptidase_M24) 		3 ASP A 222
LEU A 223
HIS A 162
 ZN  A 402 ( 2.3A)
None
None
 0.79A 1qknA-4fukA:
undetectable		 1qknA-4fukA:
21.37
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.
4g2r ACCD6,
CARBOXYLTRANSFERASE
BETA-SUBUNIT OF
ACYL-COA CARBOXYLASE

(Mycobacterium
tuberculosis) 		PF01039
(Carboxyl_trans) 		3 ASP A 433
LEU A 436
HIS A 231
 None
 0.37A 1qknA-4g2rA:
undetectable		 1qknA-4g2rA:
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.
4gxw ADENOSINE DEAMINASE

(Burkholderia
ambifaria) 		PF00962
(A_deaminase) 		3 ASP A  83
LEU A  87
HIS A 305
 None
 0.78A 1qknA-4gxwA:
undetectable		 1qknA-4gxwA:
19.02
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.
4hxx METHIONINE
AMINOPEPTIDASE 1

(Homo sapiens) 		PF00557
(Peptidase_M24) 		3 ASP A 240
LEU A 241
HIS A 180
 CO  A 402 ( 2.3A)
None
None
 0.79A 1qknA-4hxxA:
undetectable		 1qknA-4hxxA:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4isy CYSTEINE DESULFURASE

(Mycobacterium
tuberculosis) 		PF00266
(Aminotran_5) 		3 ASP A 310
LEU A 313
HIS A 101
 None
 0.72A 1qknA-4isyA:
undetectable		 1qknA-4isyA:
21.50
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.
4jrl PUTATIVE GLYCOSIDE
HYDROLASE

(Bacteroides
ovatus) 		PF13201
(PCMD) 		3 ASP A 333
LEU A 336
HIS A 322
 None
None
SO4  A 403 (-4.6A)
 0.78A 1qknA-4jrlA:
undetectable		 1qknA-4jrlA:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lxr PROTEIN TOLL

(Drosophila
melanogaster) 		PF00560
(LRR_1)
PF01462
(LRRNT)
PF13306
(LRR_5)
PF13855
(LRR_8) 		3 ASP A 336
LEU A 337
HIS A 262
 None
 0.70A 1qknA-4lxrA:
undetectable		 1qknA-4lxrA:
17.67
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.
4m9x CELL DEATH PROTEIN 4

(Caenorhabditis
elegans) 		PF00619
(CARD)
PF00931
(NB-ARC) 		3 ASP A 206
LEU A 209
HIS A 225
 None
 0.66A 1qknA-4m9xA:
undetectable		 1qknA-4m9xA:
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.
4mla CYTOKININ OXIDASE 2

(Zea mays) 		PF01565
(FAD_binding_4)
PF09265
(Cytokin-bind) 		3 ASP A 397
LEU A 395
HIS A 371
 None
GOL  A 609 (-4.4A)
None
 0.61A 1qknA-4mlaA:
undetectable		 1qknA-4mlaA:
20.20
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.
4nru RNA DEPENDENT RNA
POLYMERASE

(Norwalk virus) 		PF00680
(RdRP_1) 		3 ASP A 412
LEU A 415
HIS A 478
 None
 0.55A 1qknA-4nruA:
undetectable		 1qknA-4nruA:
17.62
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.
4pwv P450 MONOOXYGENASE

(Streptomyces
sp. Acta 2897) 		PF00067
(p450) 		3 ASP A 249
LEU A 246
HIS A 391
 None
 0.78A 1qknA-4pwvA:
2.6		 1qknA-4pwvA:
19.51
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.
4qa9 EPOXIDE HYDROLASE

(Streptomyces
carzinostaticus) 		PF06441
(EHN) 		3 ASP A 187
LEU A 183
HIS A  81
 None
 0.73A 1qknA-4qa9A:
undetectable		 1qknA-4qa9A:
21.72
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.
4qmd ENVOPLAKIN

(Homo sapiens) 		PF00681
(Plectin) 		3 ASP A1851
LEU A1850
HIS A1934
 None
 0.72A 1qknA-4qmdA:
undetectable		 1qknA-4qmdA:
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.
4r3z ARGININE--TRNA
LIGASE, CYTOPLASMIC

(Homo sapiens) 		PF00750
(tRNA-synt_1d)
PF03485
(Arg_tRNA_synt_N)
PF05746
(DALR_1) 		3 ASP B 507
LEU B 508
HIS B 438
 None
 0.78A 1qknA-4r3zB:
undetectable		 1qknA-4r3zB:
18.25
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.
4uzs BETA-GALACTOSIDASE

(Bifidobacterium
bifidum) 		PF02449
(Glyco_hydro_42)
PF08532
(Glyco_hydro_42M)
PF08533
(Glyco_hydro_42C) 		3 ASP A 353
LEU A  20
HIS A 644
 None
 0.72A 1qknA-4uzsA:
undetectable		 1qknA-4uzsA:
17.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w78 HYDRATASE CHSH2

(Mycobacterium
tuberculosis) 		no annotation 3 ASP B  55
LEU B  58
HIS B  35
 None
 0.69A 1qknA-4w78B:
undetectable		 1qknA-4w78B:
19.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wj7 MALCAVERNIN

(Homo sapiens) 		no annotation 3 ASP A 147
LEU A 152
HIS A  99
 None
 0.68A 1qknA-4wj7A:
undetectable		 1qknA-4wj7A:
24.53
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.
4xeq TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Desulfovibrio
vulgaris) 		PF03480
(DctP) 		3 ASP A 129
LEU A 132
HIS A 161
 None
 0.62A 1qknA-4xeqA:
undetectable		 1qknA-4xeqA:
23.69
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.
4y90 TRIOSEPHOSPHATE
ISOMERASE

(Deinococcus
radiodurans) 		PF00121
(TIM) 		3 ASP A  48
LEU A  49
HIS A  96
 None
None
CA  A 305 (-4.3A)
 0.74A 1qknA-4y90A:
undetectable		 1qknA-4y90A:
23.74
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.
4z42 UREASE SUBUNIT ALPHA

(Yersinia
enterocolitica) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		3 ASP C 122
LEU C  70
HIS C 128
 None
 0.74A 1qknA-4z42C:
undetectable		 1qknA-4z42C:
16.93
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.
4zpl PROTEIN PCDHB1

(Mus musculus) 		PF00028
(Cadherin)
PF08266
(Cadherin_2) 		3 ASP A  23
LEU A  24
HIS A  77
 None
 0.58A 1qknA-4zplA:
undetectable		 1qknA-4zplA:
23.10