SIMILAR PATTERNS OF AMINO ACIDS FOR 1QKN_A_RALA600_2

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.
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