SIMILAR PATTERNS OF AMINO ACIDS FOR 1KIJ_A_NOVA400_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.
1dqz PROTEIN (ANTIGEN
85-C)

(Mycobacterium
tuberculosis) 		PF00756
(Esterase) 		3 ASN A 118
PHE A  26
VAL A 113
 None
 0.80A 1kijA-1dqzA:
0.0		 1kijA-1dqzA:
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.
1fs5 GLUCOSAMINE-6-PHOSPH
ATE DEAMINASE

(Escherichia
coli) 		PF01182
(Glucosamine_iso) 		3 ASN A 147
PHE A 134
VAL A 188
 None
 0.77A 1kijA-1fs5A:
0.0		 1kijA-1fs5A:
23.02
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.
1hup MANNOSE-BINDING
PROTEIN

(Homo sapiens) 		PF00059
(Lectin_C) 		3 ASN A 212
PHE A 163
VAL A 214
 SO4  A 304 ( 3.2A)
None
None
 0.66A 1kijA-1hupA:
0.0		 1kijA-1hupA:
16.15
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.
1jdp ATRIAL NATRIURETIC
PEPTIDE CLEARANCE
RECEPTOR

(Homo sapiens) 		PF01094
(ANF_receptor) 		3 ASN A 310
PHE A 290
VAL A 313
 None
 0.82A 1kijA-1jdpA:
0.0		 1kijA-1jdpA:
22.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1js8 HEMOCYANIN

(Enteroctopus
dofleini) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		3 ASN A2879
PHE A2799
VAL A2867
 None
 0.82A 1kijA-1js8A:
0.0		 1kijA-1js8A:
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.
1jxk ALPHA-AMYLASE,
SALIVARY

(Homo sapiens) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C) 		3 ASN A  87
PHE A  79
VAL A 191
 None
 0.87A 1kijA-1jxkA:
0.0		 1kijA-1jxkA:
21.66
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.
1lcy HTRA2 SERINE
PROTEASE

(Homo sapiens) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		3 ASN A  63
PHE A  52
VAL A 187
 None
 0.72A 1kijA-1lcyA:
0.0		 1kijA-1lcyA:
24.10
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.
1ne7 GLUCOSAMINE-6-PHOSPH
ATE ISOMERASE

(Homo sapiens) 		PF01182
(Glucosamine_iso) 		3 ASN A 147
PHE A 134
VAL A 188
 None
 0.69A 1kijA-1ne7A:
0.0		 1kijA-1ne7A:
23.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ose PORCINE
ALPHA-AMYLASE

(Sus scrofa) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C) 		3 ASN A  87
PHE A  79
VAL A 191
 None
 0.84A 1kijA-1oseA:
undetectable		 1kijA-1oseA:
22.20
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.
1q14 HST2 PROTEIN

(Saccharomyces
cerevisiae) 		PF02146
(SIR2) 		3 ASN A 116
PHE A  96
VAL A  31
 None
 0.86A 1kijA-1q14A:
undetectable		 1kijA-1q14A:
22.38
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.
1q1a HST2 PROTEIN

(Saccharomyces
cerevisiae) 		PF02146
(SIR2) 		3 ASN A 116
PHE A  96
VAL A  31
 None
 0.82A 1kijA-1q1aA:
undetectable		 1kijA-1q1aA:
19.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qu4 ORNITHINE
DECARBOXYLASE

(Trypanosoma
brucei) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		3 ASN A 319
PHE A 326
VAL A 288
 None
 0.66A 1kijA-1qu4A:
undetectable		 1kijA-1qu4A:
24.52
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.
1rdk MANNOSE-BINDING
PROTEIN-C

(Rattus rattus) 		PF00059
(Lectin_C) 		3 ASN 1 210
PHE 1 161
VAL 1 212
 GAL  1   1 (-2.9A)
None
GAL  1   1 ( 4.9A)
 0.83A 1kijA-1rdk1:
undetectable		 1kijA-1rdk1:
12.82
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.
1uiy ENOYL-COA HYDRATASE

(Thermus
thermophilus) 		PF00378
(ECH_1) 		3 ASN A  76
PHE A 136
VAL A  68
 None
GOL  A 400 ( 4.1A)
None
 0.73A 1kijA-1uiyA:
undetectable		 1kijA-1uiyA:
23.93
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.
1wh0 UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 19

(Homo sapiens) 		PF04969
(CS) 		3 ASN A  22
PHE A  66
VAL A  20
 None
 0.85A 1kijA-1wh0A:
undetectable		 1kijA-1wh0A:
15.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xkt FATTY ACID SYNTHASE

(Homo sapiens) 		PF00975
(Thioesterase) 		3 ASN A2463
PHE A2315
VAL A2467
 None
 0.68A 1kijA-1xktA:
undetectable		 1kijA-1xktA:
22.73
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.
1xxl YCGJ PROTEIN

(Bacillus
subtilis) 		PF08241
(Methyltransf_11) 		3 ASN A 155
PHE A 111
VAL A  98
 None
 0.86A 1kijA-1xxlA:
undetectable		 1kijA-1xxlA:
20.51
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.
1zao RIO2 SERINE KINASE

(Archaeoglobus
fulgidus) 		PF01163
(RIO1)
PF09202
(Rio2_N) 		3 ASN A 194
PHE A 262
VAL A 198
 None
 0.86A 1kijA-1zaoA:
undetectable		 1kijA-1zaoA:
23.43
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.
2bsz ARYLAMINE
N-ACETYLTRANSFERASE
1

(Mesorhizobium
loti) 		PF00797
(Acetyltransf_2) 		3 ASN A  44
PHE A 264
VAL A 208
 None
 0.80A 1kijA-2bszA:
undetectable		 1kijA-2bszA:
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.
2bx6 XRP2 PROTEIN

(Homo sapiens) 		PF07986
(TBCC) 		3 ASN A 168
PHE A 340
VAL A 270
 None
 0.73A 1kijA-2bx6A:
undetectable		 1kijA-2bx6A:
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.
2cqd RNA-BINDING REGION
CONTAINING PROTEIN 1

(Homo sapiens) 		PF00076
(RRM_1) 		3 ASN A  84
PHE A  31
VAL A  15
 None
 0.87A 1kijA-2cqdA:
undetectable		 1kijA-2cqdA:
16.28
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.
2eje GENERAL
TRANSCRIPTION FACTOR
II-I

(Homo sapiens) 		PF02946
(GTF2I) 		3 ASN A  27
PHE A  69
VAL A  46
 None
 0.59A 1kijA-2ejeA:
undetectable		 1kijA-2ejeA:
17.15
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.
2ivf ETHYLBENZENE
DEHYDROGENASE
ALPHA-SUBUNIT

(Aromatoleum
aromaticum) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		3 ASN A 470
PHE A 251
VAL A 435
 None
 0.86A 1kijA-2ivfA:
undetectable		 1kijA-2ivfA:
19.91
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.
2ls8 C-TYPE LECTIN DOMAIN
FAMILY 4 MEMBER D

(Homo sapiens) 		PF00059
(Lectin_C) 		3 ASN A 114
PHE A  61
VAL A 116
 None
 0.81A 1kijA-2ls8A:
undetectable		 1kijA-2ls8A:
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.
2pnc COPPER AMINE
OXIDASE, LIVER
ISOZYME

(Bos taurus) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF02728
(Cu_amine_oxidN3) 		3 ASN A 286
PHE A 498
VAL A 288
 None
 0.86A 1kijA-2pncA:
undetectable		 1kijA-2pncA:
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.
2pnn TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 1

(Rattus
norvegicus) 		PF12796
(Ank_2) 		3 ASN A 301
PHE A 245
VAL A 294
 ASN  A 301 ( 0.6A)
PHE  A 245 ( 1.3A)
VAL  A 294 ( 0.5A)
 0.81A 1kijA-2pnnA:
undetectable		 1kijA-2pnnA:
21.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pro ALPHA-LYTIC PROTEASE

(Lysobacter
enzymogenes) 		PF02983
(Pro_Al_protease) 		3 ASN A  83
PHE A  44
VAL A  81
 None
 0.77A 1kijA-2proA:
undetectable		 1kijA-2proA:
18.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rkv TRICHOTHECENE
3-O-ACETYLTRANSFERAS
E

(Fusarium
graminearum) 		PF02458
(Transferase) 		3 ASN A 189
PHE A 180
VAL A  53
 None
 0.74A 1kijA-2rkvA:
undetectable		 1kijA-2rkvA:
22.18
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.
2y7l AGGLUTININ-LIKE ALS9
PROTEIN

(Candida
albicans) 		PF11766
(Candida_ALS_N) 		3 ASN A 276
PHE A 247
VAL A 185
 None
 0.86A 1kijA-2y7lA:
undetectable		 1kijA-2y7lA:
20.15
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.
3a55 PROTEIN-GLUTAMINASE

(Chryseobacterium
proteolyticum) 		no annotation 3 ASN A 272
PHE A 280
VAL A 294
 None
 0.86A 1kijA-3a55A:
undetectable		 1kijA-3a55A:
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.
3aly PUTATIVE
UNCHARACTERIZED
PROTEIN ST0753

(Sulfurisphaera
tokodaii) 		PF13456
(RVT_3) 		3 ASN A  49
PHE A   6
VAL A  80
 None
 0.78A 1kijA-3alyA:
undetectable		 1kijA-3alyA:
18.77
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.
3d3a BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF01301
(Glyco_hydro_35) 		3 ASN A  72
PHE A  28
VAL A  44
 None
 0.75A 1kijA-3d3aA:
undetectable		 1kijA-3d3aA:
22.33
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.
3dec BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		3 ASN A 383
PHE A 636
VAL A 348
 None
 0.86A 1kijA-3decA:
undetectable		 1kijA-3decA:
19.39
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.
3e15 GLUCOSE-6-PHOSPHATE
1-DEHYDROGENASE

(Plasmodium
vivax) 		PF01182
(Glucosamine_iso) 		3 ASN A 195
PHE A 172
VAL A 193
 None
 0.76A 1kijA-3e15A:
undetectable		 1kijA-3e15A:
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.
3gza PUTATIVE
ALPHA-L-FUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF01120
(Alpha_L_fucos) 		3 ASN A  69
PHE A 103
VAL A 118
 None
 0.80A 1kijA-3gzaA:
undetectable		 1kijA-3gzaA:
22.36
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.
3hn6 GLUCOSAMINE-6-PHOSPH
ATE DEAMINASE

(Borreliella
burgdorferi) 		PF01182
(Glucosamine_iso) 		3 ASN A 147
PHE A 134
VAL A 188
 None
 0.68A 1kijA-3hn6A:
undetectable		 1kijA-3hn6A:
23.95
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.
3ikb UNCHARACTERIZED
CONSERVED PROTEIN

(Streptococcus
mutans) 		PF03167
(UDG) 		3 ASN A  38
PHE A  74
VAL A  82
 None
 0.85A 1kijA-3ikbA:
undetectable		 1kijA-3ikbA:
17.95
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.
3kd3 PHOSPHOSERINE
PHOSPHOHYDROLASE-LIK
E PROTEIN

(Francisella
tularensis) 		PF12710
(HAD) 		3 ASN A 143
PHE A  50
VAL A 126
 None
 0.83A 1kijA-3kd3A:
undetectable		 1kijA-3kd3A:
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.
3ksm ABC-TYPE SUGAR
TRANSPORT SYSTEM,
PERIPLASMIC
COMPONENT

(Hahella
chejuensis) 		PF13407
(Peripla_BP_4) 		3 ASN A 275
PHE A 230
VAL A 277
 None
 0.85A 1kijA-3ksmA:
undetectable		 1kijA-3ksmA:
21.74
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.
3l2e GLYCOCYAMINE KINASE
ALPHA CHAIN

(Namalycastis
sp. ST01) 		PF00217
(ATP-gua_Ptrans)
PF02807
(ATP-gua_PtransN) 		3 ASN A 349
PHE A 264
VAL A 302
 None
 0.83A 1kijA-3l2eA:
undetectable		 1kijA-3l2eA:
23.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lm5 SERINE/THREONINE-PRO
TEIN KINASE 17B

(Homo sapiens) 		PF00069
(Pkinase) 		3 ASN A  95
PHE A 180
VAL A  93
 None
 0.83A 1kijA-3lm5A:
undetectable		 1kijA-3lm5A:
20.68
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.
3nnm CURA

(Lyngbya
majuscula) 		PF05721
(PhyH) 		3 ASN A 223
PHE A 220
VAL A 226
 None
 0.78A 1kijA-3nnmA:
undetectable		 1kijA-3nnmA:
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.
3odn DALLY-LIKE PROTEIN

(Drosophila
melanogaster) 		PF01153
(Glypican) 		3 ASN A 376
PHE A 217
VAL A 255
 None
 0.80A 1kijA-3odnA:
undetectable		 1kijA-3odnA:
20.30
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.
3pco PHENYLALANYL-TRNA
SYNTHETASE, ALPHA
SUBUNIT
PHENYLALANYL-TRNA
SYNTHETASE, BETA
CHAIN

(Escherichia
coli) 		PF01409
(tRNA-synt_2d)
PF01588
(tRNA_bind)
PF02912
(Phe_tRNA-synt_N)
PF03147
(FDX-ACB)
PF03483
(B3_4)
PF03484
(B5) 		3 ASN A 217
PHE A 293
VAL B 479
 None
 0.58A 1kijA-3pcoA:
undetectable		 1kijA-3pcoA:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pst PROTEIN DOA1

(Saccharomyces
cerevisiae) 		PF08324
(PUL)
PF09070
(PFU) 		3 ASN A 438
PHE A 417
VAL A 391
 None
 0.79A 1kijA-3pstA:
undetectable		 1kijA-3pstA:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qml 78 KDA
GLUCOSE-REGULATED
PROTEIN HOMOLOG

(Saccharomyces
cerevisiae) 		PF00012
(HSP70) 		3 ASN A 301
PHE A 290
VAL A 333
 None
 0.75A 1kijA-3qmlA:
undetectable		 1kijA-3qmlA:
26.33
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.
3qr1 PHOSPHOLIPASE C-BETA
(PLC-BETA)

(Doryteuthis
pealeii) 		PF00168
(C2)
PF00387
(PI-PLC-Y)
PF00388
(PI-PLC-X)
PF09279
(EF-hand_like) 		3 ASN A 126
PHE A  28
VAL A 129
 None
 0.76A 1kijA-3qr1A:
undetectable		 1kijA-3qr1A:
20.88
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.
3sdo NITRILOTRIACETATE
MONOOXYGENASE

(Burkholderia
pseudomallei) 		PF00296
(Bac_luciferase) 		3 ASN A  18
PHE A 399
VAL A 287
 None
 0.72A 1kijA-3sdoA:
undetectable		 1kijA-3sdoA:
22.83
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.
3slt SERINE PROTEASE ESPP

(Escherichia
coli) 		PF03797
(Autotransporter) 		3 ASN A1130
PHE A1096
VAL A1013
 None
 0.84A 1kijA-3sltA:
undetectable		 1kijA-3sltA:
22.38
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.
3sut BETA-HEXOSAMINIDASE

(Paenibacillus
sp. TS12) 		PF00728
(Glyco_hydro_20)
PF02838
(Glyco_hydro_20b) 		3 ASN A 343
PHE A 335
VAL A 349
 None
 0.80A 1kijA-3sutA:
undetectable		 1kijA-3sutA:
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.
3tp9 BETA-LACTAMASE AND
RHODANESE DOMAIN
PROTEIN

(Alicyclobacillus
acidocaldarius) 		PF00581
(Rhodanese)
PF00753
(Lactamase_B) 		3 ASN A 221
PHE A 232
VAL A 153
 None
 0.67A 1kijA-3tp9A:
undetectable		 1kijA-3tp9A:
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.
3tqq METHIONYL-TRNA
FORMYLTRANSFERASE

(Coxiella
burnetii) 		PF00551
(Formyl_trans_N)
PF02911
(Formyl_trans_C) 		3 ASN A 107
PHE A   7
VAL A  87
 None
 0.87A 1kijA-3tqqA:
undetectable		 1kijA-3tqqA:
21.95
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.
3u24 PUTATIVE LIPOPROTEIN

(Shewanella
oneidensis) 		PF05960
(DUF885) 		3 ASN A 195
PHE A 202
VAL A 140
 None
None
EDO  A 600 (-4.7A)
 0.64A 1kijA-3u24A:
undetectable		 1kijA-3u24A:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wh3 C-TYPE LECTIN DOMAIN
FAMILY 4 MEMBER E

(Homo sapiens) 		PF00059
(Lectin_C) 		3 ASN A 193
PHE A 138
VAL A 195
 CA  A 500 (-3.0A)
None
None
 0.75A 1kijA-3wh3A:
undetectable		 1kijA-3wh3A:
16.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3whd C-TYPE LECTIN DOMAIN
FAMILY 4 MEMBER D

(Homo sapiens) 		PF00059
(Lectin_C) 		3 ASN A 195
PHE A 142
VAL A 197
 CA  A 501 (-3.1A)
None
None
 0.59A 1kijA-3whdA:
undetectable		 1kijA-3whdA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4amc GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		3 ASN A1668
PHE A1707
VAL A1696
 None
 0.82A 1kijA-4amcA:
undetectable		 1kijA-4amcA:
15.77
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.
4axn CHITINASE C1

(Serratia
marcescens) 		PF00704
(Glyco_hydro_18) 		3 ASN A  93
PHE A  85
VAL A  99
 CA  A1329 (-3.1A)
None
None
 0.78A 1kijA-4axnA:
undetectable		 1kijA-4axnA:
22.20
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.
4bev COPPER EFFLUX ATPASE

(Legionella
pneumophila) 		PF00122
(E1-E2_ATPase)
PF00702
(Hydrolase) 		3 ASN A 112
PHE A 188
VAL A 167
 None
 0.82A 1kijA-4bevA:
undetectable		 1kijA-4bevA:
20.48
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.
4bhh NUCLEOPROTEIN

(California
encephalitis
orthobunyavirus) 		PF00952
(Bunya_nucleocap) 		3 ASN B  30
PHE B  65
VAL B  70
 None
 0.86A 1kijA-4bhhB:
undetectable		 1kijA-4bhhB:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4eco UNCHARACTERIZED
PROTEIN

(Bacteroides
eggerthii) 		no annotation 3 ASN A 551
PHE A 486
VAL A 524
 None
 0.78A 1kijA-4ecoA:
undetectable		 1kijA-4ecoA:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4eqv INVERTASE 2

(Saccharomyces
cerevisiae) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		3 ASN A 359
PHE A 506
VAL A 491
 None
 0.82A 1kijA-4eqvA:
undetectable		 1kijA-4eqvA:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fbo PSEUDOMONAS
FLUORESCENS
AGGLUTININ

(Pseudomonas
fluorescens) 		no annotation 3 ASN A  69
PHE A  47
VAL A 100
 None
 0.85A 1kijA-4fboA:
undetectable		 1kijA-4fboA:
17.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fln PROTEASE DO-LIKE 2,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		3 ASN A 157
PHE A 147
VAL A 282
 None
 0.66A 1kijA-4flnA:
undetectable		 1kijA-4flnA:
22.24
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.
4hbs PUTATIVE HYDROLASE

(Bacteroides
ovatus) 		PF16396
(DUF5005) 		3 ASN A 394
PHE A 417
VAL A  79
 None
 0.56A 1kijA-4hbsA:
undetectable		 1kijA-4hbsA:
21.10
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.
4ic5 PROTEASE DO-LIKE 5,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF13365
(Trypsin_2) 		3 ASN A 145
PHE A 134
VAL A 280
 None
 0.75A 1kijA-4ic5A:
undetectable		 1kijA-4ic5A:
23.31
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.
4ily CHITOSANASE

(Streptomyces
sp. SirexAA-E) 		PF01374
(Glyco_hydro_46) 		3 ASN A 124
PHE A 149
VAL A 114
 None
 0.86A 1kijA-4ilyA:
undetectable		 1kijA-4ilyA:
23.02
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.
4inn HP1028

(Helicobacter
pylori) 		PF09917
(DUF2147) 		3 ASN A 152
PHE A  39
VAL A 156
 None
 0.79A 1kijA-4innA:
undetectable		 1kijA-4innA:
19.39
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.
4lu1 MAF-LIKE PROTEIN
YCEF

(Escherichia
coli) 		PF02545
(Maf) 		3 ASN A  98
PHE A 151
VAL A 100
 None
 0.75A 1kijA-4lu1A:
undetectable		 1kijA-4lu1A:
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.
4m18 PULMONARY
SURFACTANT-ASSOCIATE
D PROTEIN D

(Homo sapiens) 		PF00059
(Lectin_C)
PF09006
(Surfac_D-trimer) 		3 ASN A 341
PHE A 292
VAL A 343
 MAN  A 406 ( 2.6A)
None
MAN  A 406 ( 4.7A)
 0.60A 1kijA-4m18A:
undetectable		 1kijA-4m18A:
17.28
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.
4p1l TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Chromohalobacter
salexigens) 		PF03480
(DctP) 		3 ASN A 298
PHE A 306
VAL A 165
 None
 0.86A 1kijA-4p1lA:
undetectable		 1kijA-4p1lA:
22.58
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.
4pcq POSSIBLE
TRANSCRIPTIONAL
REGULATORY PROTEIN
(PROBABLY
LRP/ASNC-FAMILY)

(Mycobacterium
tuberculosis) 		PF01037
(AsnC_trans_reg)
PF13412
(HTH_24) 		3 ASN A  51
PHE A  81
VAL A  69
 None
 0.70A 1kijA-4pcqA:
undetectable		 1kijA-4pcqA:
20.77
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.
4qlb PROBABLE GLYCOGEN
[STARCH] SYNTHASE

(Caenorhabditis
elegans) 		PF05693
(Glycogen_syn) 		3 ASN A 488
PHE A 325
VAL A 497
 None
 0.84A 1kijA-4qlbA:
undetectable		 1kijA-4qlbA:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qmk TYPE III SECRETION
SYSTEM EFFECTOR
PROTEIN EXOU

(Pseudomonas
fluorescens) 		PF01734
(Patatin) 		3 ASN A 153
PHE A 239
VAL A 246
 None
 0.85A 1kijA-4qmkA:
undetectable		 1kijA-4qmkA:
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.
4r1p L-ARABINOSE
ISOMERASE

(Geobacillus
kaustophilus) 		PF02610
(Arabinose_Isome)
PF11762
(Arabinose_Iso_C) 		3 ASN A 406
PHE A 451
VAL A 408
 None
 0.83A 1kijA-4r1pA:
undetectable		 1kijA-4r1pA:
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.
4r6i ANTHRAX TOXIN
EXPRESSION
TRANS-ACTING
POSITIVE REGULATOR

(Bacillus
anthracis) 		PF00874
(PRD)
PF05043
(Mga)
PF08279
(HTH_11) 		3 ASN A 327
PHE A 259
VAL A 154
 None
 0.79A 1kijA-4r6iA:
undetectable		 1kijA-4r6iA:
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.
4wuv 2-HYDROXYCYCLOHEXANE
CARBOXYL-COA
DEHYDROGENASE

(Haemophilus
influenzae) 		PF00106
(adh_short) 		3 ASN A  78
PHE A 151
VAL A  82
 None
 0.76A 1kijA-4wuvA:
undetectable		 1kijA-4wuvA:
22.68
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.
4xcv NADP-DEPENDENT
2-HYDROXYACID
DEHYDROGENASE

(Rhizobium etli) 		PF02826
(2-Hacid_dh_C) 		3 ASN A  33
PHE A 293
VAL A  18
 None
 0.85A 1kijA-4xcvA:
undetectable		 1kijA-4xcvA:
23.90
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.
4xoh DIVISION MAL FOUTUE
1 PROTEIN

(Schizosaccharomyces
pombe) 		no annotation 3 ASN C  40
PHE C  60
VAL C  34
 None
 0.82A 1kijA-4xohC:
undetectable		 1kijA-4xohC:
23.33
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.
4ymd COLLECTIN-11

(Homo sapiens) 		PF00059
(Lectin_C) 		3 ASN A 252
PHE A 202
VAL A 254
 MAN  A 302 ( 2.6A)
None
MAN  A 302 ( 4.7A)
 0.74A 1kijA-4ymdA:
undetectable		 1kijA-4ymdA:
18.41
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.
4zgz ANTIZYME INHIBITOR 1

(Homo sapiens) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		3 ASN A 317
PHE A 324
VAL A 285
 None
 0.63A 1kijA-4zgzA:
undetectable		 1kijA-4zgzA:
21.26
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.
5b1w C-TYPE LECTIN DOMAIN
FAMILY 4 MEMBER A

(Homo sapiens) 		PF00059
(Lectin_C) 		3 ASN A 218
PHE A 164
VAL A 220
 CA  A2002 (-3.0A)
None
None
 0.65A 1kijA-5b1wA:
undetectable		 1kijA-5b1wA:
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.
5bwa ORNITHINE
DECARBOXYLASE

(Homo sapiens) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		3 ASN A 319
PHE A 326
VAL A 288
 None
 0.61A 1kijA-5bwaA:
undetectable		 1kijA-5bwaA:
22.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5czz CRISPR-ASSOCIATED
ENDONUCLEASE CAS9

(Staphylococcus
aureus) 		PF13395
(HNH_4)
PF16592
(Cas9_REC) 		3 ASN A 968
PHE A 914
VAL A 981
 None
 0.78A 1kijA-5czzA:
undetectable		 1kijA-5czzA:
17.53
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.
5d6n ACYL-COA SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00501
(AMP-binding) 		3 ASN A   5
PHE A  15
VAL A 209
 None
 0.70A 1kijA-5d6nA:
undetectable		 1kijA-5d6nA:
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.
5dqs ELONGATION FACTOR
1-GAMMA

(Homo sapiens) 		PF00043
(GST_C)
PF02798
(GST_N) 		3 ASN A  12
PHE A  40
VAL A  58
 None
 0.75A 1kijA-5dqsA:
undetectable		 1kijA-5dqsA:
19.70
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.
5f8v AMINOTRANSFERASE,
CLASS V FAMILY
PROTEIN

(Trichomonas
vaginalis) 		PF00266
(Aminotran_5) 		3 ASN A 123
PHE A 151
VAL A 125
 None
 0.87A 1kijA-5f8vA:
undetectable		 1kijA-5f8vA:
23.91
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.
5ilb PROTEASE DO-LIKE 2,
CHLOROPLASTIC,PROTEA
SE DO-LIKE 9

(Arabidopsis
thaliana) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		3 ASN A 157
PHE A 147
VAL A 282
 None
 0.73A 1kijA-5ilbA:
undetectable		 1kijA-5ilbA:
23.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5itg SORBITOL
DEHYDROGENASE

(Gluconobacter
oxydans) 		PF01232
(Mannitol_dh)
PF08125
(Mannitol_dh_C) 		3 ASN A 194
PHE A  36
VAL A 228
 None
 0.82A 1kijA-5itgA:
undetectable		 1kijA-5itgA:
25.75
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.
5jym ANTIBODY SCFV TSP11

(Mus musculus) 		PF07686
(V-set) 		3 ASN B  56
PHE B  29
VAL B  72
 None
 0.84A 1kijA-5jymB:
undetectable		 1kijA-5jymB:
18.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tih CYRPA ANTIBODY FAB
HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 ASN H  56
PHE H  29
VAL H  72
 None
 0.84A 1kijA-5tihH:
undetectable		 1kijA-5tihH:
16.11
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.
5vgm DIHYDROOROTASE

(Vibrio cholerae) 		PF01979
(Amidohydro_1) 		3 ASN A 189
PHE A 182
VAL A 161
 None
 0.67A 1kijA-5vgmA:
undetectable		 1kijA-5vgmA:
23.13
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.
5vyb C-TYPE LECTIN DOMAIN
FAMILY 6 MEMBER A

(Homo sapiens) 		PF00059
(Lectin_C) 		3 ASN A 190
PHE A 137
VAL A 192
 MAN  A 302 ( 2.9A)
None
MAN  A 302 ( 4.6A)
 0.74A 1kijA-5vybA:
undetectable		 1kijA-5vybA:
16.80
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.
5yhq CAPSID PROTEIN VP3

(Enterovirus A) 		no annotation 3 ASN C 211
PHE C 157
VAL C  71
 None
 0.86A 1kijA-5yhqC:
undetectable		 1kijA-5yhqC:
21.35
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.
5yvs ALCOHOL
DEHYDROGENASE

(candidate
divison MSBL1
archaeon
SCGC-AAA259E19) 		no annotation 3 ASN A 383
PHE A 373
VAL A 387
 None
 0.82A 1kijA-5yvsA:
undetectable		 1kijA-5yvsA:
13.54
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.
6acd -

(-) 		no annotation 3 ASN A 119
PHE A 153
VAL A 124
 None
 0.84A 1kijA-6acdA:
undetectable		 1kijA-6acdA:
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.
6btm ALTERNATIVE COMPLEX
III SUBUNIT B

(Flavobacterium
johnsoniae) 		no annotation 3 ASN B 365
PHE B 239
VAL B 349
 None
 0.73A 1kijA-6btmB:
undetectable		 1kijA-6btmB:
13.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cn1 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Pseudomonas
putida) 		no annotation 3 ASN A 317
PHE A 335
VAL A 326
 None
 0.86A 1kijA-6cn1A:
undetectable		 1kijA-6cn1A:
12.12
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.
6eon BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		no annotation 3 ASN A  72
PHE A  28
VAL A  44
 None
 0.73A 1kijA-6eonA:
undetectable		 1kijA-6eonA:
19.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE

(Rhodothermus
marinus) 		no annotation 3 ASN B 605
PHE B 574
VAL B 701
 None
 0.82A 1kijA-6f0kB:
undetectable		 1kijA-6f0kB:
12.90