SIMILAR PATTERNS OF AMINO ACIDS FOR 2EFJ_A_37TA502_1

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.
1hn0 CHONDROITIN ABC
LYASE I

(Proteus
vulgaris) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF09092
(Lyase_N)
PF09093
(Lyase_catalyt) 		5 LEU A  91
PHE A 215
ILE A 213
ILE A 210
ILE A 127
 None
 1.19A 2efjA-1hn0A:
undetectable		 2efjA-1hn0A:
17.80
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.
1spi FRUCTOSE
1,6-BISPHOSPHATASE

(Spinacia
oleracea) 		PF00316
(FBPase) 		5 LEU A 221
PHE A 210
ILE A 313
ILE A 226
TYR A 208
 None
 1.20A 2efjA-1spiA:
undetectable		 2efjA-1spiA:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ule GALECTIN-2

(Coprinopsis
cinerea) 		PF00337
(Gal-bind_lectin) 		5 LEU A 131
PHE A 132
ILE A  91
ILE A 102
ILE A  61
 None
 1.25A 2efjA-1uleA:
undetectable		 2efjA-1uleA:
17.66
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.
1vma CELL DIVISION
PROTEIN FTSY

(Thermotoga
maritima) 		PF00448
(SRP54)
PF02881
(SRP54_N) 		5 LEU A 291
PHE A 287
ILE A 267
ILE A 218
ILE A 255
 None
 1.32A 2efjA-1vmaA:
undetectable		 2efjA-1vmaA:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zcz BIFUNCTIONAL PURINE
BIOSYNTHESIS PROTEIN
PURH

(Thermotoga
maritima) 		PF01808
(AICARFT_IMPCHas)
PF02142
(MGS) 		5 LEU A  38
TRP A  26
ILE A  17
ILE A 124
ILE A   4
 None
 1.07A 2efjA-1zczA:
undetectable		 2efjA-1zczA:
22.31
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.
1zkc PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
LIKE 2

(Homo sapiens) 		PF00160
(Pro_isomerase) 		5 TYR A 316
LEU A 366
ILE A 330
ILE A 426
ILE A 428
 None
 1.36A 2efjA-1zkcA:
undetectable		 2efjA-1zkcA:
19.12
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.
1zrz PROTEIN KINASE C,
IOTA

(Homo sapiens) 		PF00069
(Pkinase)
PF00433
(Pkinase_C) 		5 LEU A 372
TYR A 410
TRP A 428
SER A 442
ILE A 465
 None
 1.34A 2efjA-1zrzA:
undetectable		 2efjA-1zrzA:
23.28
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.
2d5w PEPTIDE ABC
TRANSPORTER,
PEPTIDE-BINDING
PROTEIN

(Thermus
thermophilus) 		PF00496
(SBP_bac_5) 		5 LEU A 258
ILE A  32
SER A 271
ILE A  36
ILE A  10
 None
 1.48A 2efjA-2d5wA:
undetectable		 2efjA-2d5wA:
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.
2e3z BETA-GLUCOSIDASE

(Phanerochaete
chrysosporium) 		PF00232
(Glyco_hydro_1) 		5 LEU A 353
PHE A 296
ILE A 261
ILE A 202
TYR A 357
 None
 1.25A 2efjA-2e3zA:
undetectable		 2efjA-2e3zA:
20.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2eg5 XANTHOSINE
METHYLTRANSFERASE

(Coffea
canephora) 		PF03492
(Methyltransf_7) 		5 TYR A  18
TYR A 158
TRP A 162
ILE A 227
TYR A 321
 None
XTS  A 502 ( 4.9A)
XTS  A 502 (-4.5A)
None
XTS  A 502 (-4.6A)
 0.44A 2efjA-2eg5A:
47.8		 2efjA-2eg5A:
81.56
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.
2fwr DNA REPAIR PROTEIN
RAD25

(Archaeoglobus
fulgidus) 		PF04851
(ResIII)
PF16203
(ERCC3_RAD25_C) 		5 LEU A 102
ILE A 429
SER A 424
ILE A 418
ILE A 451
 None
 1.38A 2efjA-2fwrA:
undetectable		 2efjA-2fwrA:
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.
2p1a HYPOTHETICAL PROTEIN

(Bacillus cereus) 		no annotation 5 TYR A 111
HIS A 128
ILE A  50
ILE A 125
ILE A  57
 None
 1.25A 2efjA-2p1aA:
undetectable		 2efjA-2p1aA:
17.51
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.
2poe CYCLOPHILIN-LIKE
PROTEIN, PUTATIVE

(Cryptosporidium
parvum) 		PF00160
(Pro_isomerase) 		5 TYR A  53
LEU A 103
ILE A  67
ILE A 166
ILE A 168
 None
 1.28A 2efjA-2poeA:
undetectable		 2efjA-2poeA:
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.
2wbe BIPOLAR KINESIN
KRP-130

(Drosophila
melanogaster) 		PF00225
(Kinesin) 		5 LEU C 277
ILE C 317
ILE C   8
ILE C 284
TYR C  90
 None
 1.29A 2efjA-2wbeC:
undetectable		 2efjA-2wbeC:
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.
2y5w KINESIN HEAVY CHAIN

(Drosophila
melanogaster) 		PF00225
(Kinesin) 		5 LEU A 265
ILE A 306
ILE A  13
ILE A 272
TYR A  91
 None
 1.41A 2efjA-2y5wA:
undetectable		 2efjA-2y5wA:
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.
2yky BETA-TRANSAMINASE

(Mesorhizobium
sp. LUK) 		PF00202
(Aminotran_3) 		5 LEU A 341
HIS A  98
ILE A 332
ILE A 101
TYR A 333
 None
 1.36A 2efjA-2ykyA:
undetectable		 2efjA-2ykyA:
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.
3a79 TOLL-LIKE RECEPTOR
6, VARIABLE
LYMPHOCYTE RECEPTOR
B

(Eptatretus
burgeri;
Mus musculus) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		5 PHE B 328
ILE B 283
SER B 266
ILE B 259
ILE B 288
 None
 1.32A 2efjA-3a79B:
2.3		 2efjA-3a79B:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3htz ALANYL-TRNA
SYNTHETASE

(Aquifex
aeolicus) 		PF01411
(tRNA-synt_2c) 		5 LEU A 417
PHE A 413
ILE A 397
ILE A 363
TYR A 387
 None
 1.39A 2efjA-3htzA:
2.0		 2efjA-3htzA:
22.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3icq EXPORTIN-T

(Schizosaccharomyces
pombe) 		PF08389
(Xpo1) 		5 TYR T 147
PHE T 116
ILE T 222
ILE T 188
TYR T 120
 None
 1.49A 2efjA-3icqT:
undetectable		 2efjA-3icqT:
17.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3j7a 40S RIBOSOMAL
PROTEIN ES12

(Plasmodium
falciparum) 		PF01248
(Ribosomal_L7Ae) 		5 TYR R  68
ILE R  42
SER R 116
ILE R  46
ILE R  72
 None
 1.27A 2efjA-3j7aR:
undetectable		 2efjA-3j7aR:
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.
3jrt INTEGRON CASSETTE
PROTEIN VPC_CASS2

(Vibrio
paracholerae) 		no annotation 5 TYR A  64
ILE A  93
ILE A  99
ILE A 142
TYR A  89
 None
 1.22A 2efjA-3jrtA:
undetectable		 2efjA-3jrtA:
18.13
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.
3k6j PROTEIN F01G10.3,
CONFIRMED BY
TRANSCRIPT EVIDENCE

(Caenorhabditis
elegans) 		PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 PHE A 304
ILE A 247
SER A 233
ILE A 251
TYR A 229
 None
 1.20A 2efjA-3k6jA:
5.6		 2efjA-3k6jA:
21.34
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.
3kin KINESIN HEAVY CHAIN

(Rattus
norvegicus) 		PF00225
(Kinesin) 		5 LEU B 259
ILE B 300
ILE A   9
ILE B 266
TYR A  85
 None
 1.42A 2efjA-3kinB:
undetectable		 2efjA-3kinB:
15.00
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.
3kk7 PUTATIVE CELL
INVASION PROTEIN
WITH MAC/PERFORIN
DOMAIN

(Bacteroides
thetaiotaomicron) 		PF01823
(MACPF) 		5 TYR A 530
LEU A 425
ILE A 555
ILE A 506
TYR A 214
 None
 1.41A 2efjA-3kk7A:
undetectable		 2efjA-3kk7A:
22.12
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.
3l0o TRANSCRIPTION
TERMINATION FACTOR
RHO

(Thermotoga
maritima) 		PF00006
(ATP-synt_ab)
PF07497
(Rho_RNA_bind)
PF07498
(Rho_N) 		5 LEU A 249
ILE A 230
ILE A   8
ILE A 103
TYR A 128
 None
 1.24A 2efjA-3l0oA:
3.8		 2efjA-3l0oA:
22.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lwx NADH:UBIQUINONE
OXIDOREDUCTASE, NA
TRANSLOCATING, C
SUBUNIT

(Parabacteroides
distasonis) 		PF04205
(FMN_bind) 		5 TYR A 262
LEU A 160
ILE A  91
SER A  94
ILE A 112
 None
 1.41A 2efjA-3lwxA:
undetectable		 2efjA-3lwxA:
19.74
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.
3m07 PUTATIVE ALPHA
AMYLASE

(Salmonella
enterica) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		5 LEU A 304
PHE A 316
ILE A 278
ILE A 242
ILE A 266
 None
 1.19A 2efjA-3m07A:
undetectable		 2efjA-3m07A:
20.29
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.
3oum TOXOFLAVIN-DEGRADING
ENZYME

(Paenibacillus
polymyxa) 		PF00903
(Glyoxalase) 		5 TYR A  21
ILE A 139
ILE A   4
ILE A  46
TYR A  59
 None
 0.94A 2efjA-3oumA:
undetectable		 2efjA-3oumA:
21.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pqd L-LACTATE
DEHYDROGENASE

(Bacillus
subtilis) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 LEU A  24
ILE A 243
ILE A 144
ILE A  76
TYR A  20
 None
 1.46A 2efjA-3pqdA:
4.7		 2efjA-3pqdA:
23.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qbz DDK KINASE
REGULATORY SUBUNIT
DBF4

(Saccharomyces
cerevisiae) 		PF08630
(Dfp1_Him1_M) 		5 LEU A 214
PHE A 210
ILE A 172
SER A 124
ILE A 119
 None
 1.33A 2efjA-3qbzA:
undetectable		 2efjA-3qbzA:
17.45
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.
3qjp PUTATIVE
UNCHARACTERIZED
PROTEIN PH0350

(Pyrococcus
horikoshii) 		PF01881
(Cas_Cas6) 		5 TYR A 220
LEU A 129
ILE A  79
ILE A  87
TYR A  78
 None
 1.48A 2efjA-3qjpA:
undetectable		 2efjA-3qjpA:
21.93
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.
3qqv GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE

(Corynebacterium
glutamicum) 		PF00348
(polyprenyl_synt) 		5 LEU A 345
TYR A 245
ILE A 221
SER A 368
ILE A  65
 None
None
None
None
DMA  A 383 (-4.7A)
 1.35A 2efjA-3qqvA:
undetectable		 2efjA-3qqvA:
22.15
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.
3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE

(Mycobacterium
marinum) 		PF13561
(adh_short_C2) 		5 LEU A 233
TYR A 230
ILE A  23
ILE A 196
ILE A 248
 None
 1.25A 2efjA-3r1iA:
4.4		 2efjA-3r1iA:
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.
3tal DNA DOUBLE-STRAND
BREAK REPAIR PROTEIN
NURA

(Pyrococcus
furiosus) 		PF09376
(NurA) 		5 LEU A 169
PHE A 165
HIS A 271
ILE A  96
ILE A 190
 None
 1.40A 2efjA-3talA:
undetectable		 2efjA-3talA:
22.77
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.
3v3t CELL DIVISION GTPASE
FTSZ, DIVERGED

(Clostridium
botulinum) 		PF00091
(Tubulin) 		5 TYR A  28
PHE A 177
ILE A 213
ILE A 279
TYR A 160
 None
 1.48A 2efjA-3v3tA:
undetectable		 2efjA-3v3tA:
22.12
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.
4aur LEOA

(Escherichia
coli) 		PF00350
(Dynamin_N) 		5 LEU A 206
PHE A 174
ILE A 141
ILE A 135
ILE A 158
 None
 1.47A 2efjA-4aurA:
undetectable		 2efjA-4aurA:
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.
4bn2 KINESIN-LIKE PROTEIN
KIF15

(Homo sapiens) 		PF00225
(Kinesin) 		5 LEU A 278
ILE A 322
ILE A  13
ILE A 285
TYR A  94
 None
 1.39A 2efjA-4bn2A:
undetectable		 2efjA-4bn2A:
21.05
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.
4d86 POLY [ADP-RIBOSE]
POLYMERASE 14

(Homo sapiens) 		PF01661
(Macro) 		5 LEU A 859
ILE A 921
SER A 904
ILE A 918
ILE A 878
 None
 1.30A 2efjA-4d86A:
undetectable		 2efjA-4d86A:
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.
4exl PHOSPHATE-BINDING
PROTEIN PSTS 1

(Streptococcus
pneumoniae) 		PF12849
(PBP_like_2) 		5 LEU A 110
ILE A 197
ILE A 131
ILE A 168
TYR A 199
 None
 1.21A 2efjA-4exlA:
undetectable		 2efjA-4exlA:
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.
4gib BETA-PHOSPHOGLUCOMUT
ASE

(Clostridioides
difficile) 		PF13419
(HAD_2) 		5 TYR A  80
TYR A  21
TRP A  24
ILE A  35
ILE A  55
 None
 1.33A 2efjA-4gibA:
2.1		 2efjA-4gibA:
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.
4ilg A1 CISTRON-SPLICING
FACTOR AAR2

(Saccharomyces
cerevisiae) 		PF05282
(AAR2) 		5 TYR A 313
HIS A 244
TRP A 289
ILE A 247
ILE A 272
 None
 1.26A 2efjA-4ilgA:
undetectable		 2efjA-4ilgA:
21.31
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.
4k3j HEPATOCYTE GROWTH
FACTOR BETA CHAIN

(Homo sapiens) 		PF01403
(Sema)
PF01437
(PSI) 		5 LEU B 238
ILE B 247
ILE B 279
ILE B 235
TYR B 291
 None
 1.46A 2efjA-4k3jB:
undetectable		 2efjA-4k3jB:
21.45
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.
4o6z SERINE
HYDROXYMETHYLTRANSFE
RASE

(Plasmodium
falciparum) 		PF00464
(SHMT) 		5 LEU A 147
PHE A 148
SER A 264
ILE A 247
TYR A 110
 None
 1.02A 2efjA-4o6zA:
1.9		 2efjA-4o6zA:
21.30
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.
4pqh GLUTATHIONE
TRANSFERASE LAMBDA1

(Populus
trichocarpa) 		PF13410
(GST_C_2)
PF13417
(GST_N_3) 		5 LEU A 122
PHE A 164
ILE A 179
ILE A 194
TYR A 175
 None
 1.47A 2efjA-4pqhA:
undetectable		 2efjA-4pqhA:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rmx PHI92_GP150

(Enterobacteria
phage phi92) 		no annotation 5 LEU A 402
TYR A 376
ILE A 362
ILE A 381
ILE A 425
 None
 1.27A 2efjA-4rmxA:
undetectable		 2efjA-4rmxA:
22.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4txv CYTOCHROME C OXIDASE
SUBUNIT 2

(Bradyrhizobium
diazoefficiens) 		PF00116
(COX2) 		5 PHE B 156
ILE B 135
ILE B 183
ILE B 244
TYR B 146
 None
 1.38A 2efjA-4txvB:
undetectable		 2efjA-4txvB:
18.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w9z CYTOCHROME C OXIDASE
SUBUNIT 2

(Bradyrhizobium
diazoefficiens) 		PF00116
(COX2) 		5 PHE A 156
ILE A 135
ILE A 183
ILE A 244
TYR A 146
 None
 1.36A 2efjA-4w9zA:
undetectable		 2efjA-4w9zA:
14.73
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.
4xcq TUBZ

(Clostridium
phage c-st) 		PF00091
(Tubulin) 		5 TYR A  28
PHE A 177
ILE A 213
ILE A 279
TYR A 160
 None
 1.49A 2efjA-4xcqA:
2.7		 2efjA-4xcqA:
22.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xeh KETOL-ACID
REDUCTOISOMERASE

(Ignisphaera
aggregans) 		PF01450
(IlvC)
PF07991
(IlvN) 		5 TYR A 141
LEU A  12
ILE A  20
ILE A  22
ILE A 172
 None
 1.16A 2efjA-4xehA:
3.1		 2efjA-4xehA:
23.19
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.
4xq6 DIHYDROOROTATE
DEHYDROGENASE
(QUINONE)

(Mycobacterium
tuberculosis) 		PF01180
(DHO_dh) 		5 LEU A  64
PHE A  83
HIS A 329
ILE A 328
ILE A 332
 None
 1.42A 2efjA-4xq6A:
undetectable		 2efjA-4xq6A:
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.
5aa5 NIFE-HYDROGENASE
LARGE SUBUNIT, HOFG

(Cupriavidus
necator) 		PF00374
(NiFeSe_Hases) 		5 TYR C 285
LEU C 312
HIS C 351
ILE C 319
SER C 505
 None
 1.30A 2efjA-5aa5C:
undetectable		 2efjA-5aa5C:
23.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ayn SOLUTE CARRIER
FAMILY 39
(IRON-REGULATED
TRANSPORTER)

(Bdellovibrio
bacteriovorus) 		PF06963
(FPN1) 		5 LEU A 253
TRP A 423
ILE A 247
ILE A 243
TYR A 250
 None
 1.34A 2efjA-5aynA:
undetectable		 2efjA-5aynA:
20.56
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.
5erb POLYKETIDE SYNTHASE

(Bacillus
amyloliquefaciens) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 LEU A 373
TYR A 269
HIS A 267
ILE A 601
TYR A 490
 None
 1.23A 2efjA-5erbA:
2.4		 2efjA-5erbA:
20.58
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.
5knm LEUKOCYTE
IMMUNOGLOBULIN-LIKE
RECEPTOR SUBFAMILY B
MEMBER 1

(Homo sapiens) 		PF13895
(Ig_2) 		5 HIS D  69
TRP D  46
ILE D  65
ILE D  62
TYR D  73
 None
 1.45A 2efjA-5knmD:
undetectable		 2efjA-5knmD:
23.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lac 3CL PROTEASE

(Alphamesonivirus
1) 		PF17222
(Peptidase_C107) 		5 PHE A  50
ILE A  45
ILE A  43
ILE A  80
TYR A  61
 None
 1.40A 2efjA-5lacA:
undetectable		 2efjA-5lacA:
22.11
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.
5n9q INACTIVE POLY
[ADP-RIBOSE]
POLYMERASE RCD1

(Arabidopsis
thaliana) 		no annotation 5 LEU A 536
PHE A 546
ILE A 529
ILE A 517
TYR A 533
 None
 1.46A 2efjA-5n9qA:
undetectable		 2efjA-5n9qA:
14.64
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.
5t2s DDK KINASE
REGULATORY SUBUNIT
DBF4,SERINE/THREONIN
E-PROTEIN KINASE
RAD53

(Saccharomyces
cerevisiae) 		PF00498
(FHA)
PF08630
(Dfp1_Him1_M) 		5 LEU A 214
PHE A 210
ILE A 172
SER A 124
ILE A 119
 None
 1.32A 2efjA-5t2sA:
undetectable		 2efjA-5t2sA:
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.
5vfd BETA-LACTAMASE

(Acinetobacter
baumannii) 		PF00905
(Transpeptidase) 		5 TYR A  45
ILE A 274
ILE A  57
ILE A  42
TYR A  66
 None
 1.34A 2efjA-5vfdA:
undetectable		 2efjA-5vfdA:
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.
5wzk PUMILIO HOMOLOG 23

(Arabidopsis
thaliana) 		no annotation 5 LEU A 141
ILE A 157
SER A 160
ILE A 204
ILE A 167
 None
 1.31A 2efjA-5wzkA:
undetectable		 2efjA-5wzkA:
23.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xne -

(-) 		no annotation 5 LEU B 210
PHE B 136
ILE B  53
ILE B 130
TYR B 208
 None
 1.28A 2efjA-5xneB:
undetectable		 2efjA-5xneB:
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.
5yk7 MAINTENANCE OF
MITOCHONDRIAL
MORPHOLOGY PROTEIN 1
MITOCHONDRIAL
DISTRIBUTION AND
MORPHOLOGY PROTEIN
12

(Saccharomyces
cerevisiae;
Zygosaccharomyces
rouxii) 		no annotation 5 LEU A 258
TYR A 261
ILE B 119
ILE B  59
ILE A 400
 None
 1.40A 2efjA-5yk7A:
undetectable		 2efjA-5yk7A:
12.13
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.
6arx ACETYLCHOLINESTERASE

(Anopheles
gambiae) 		no annotation 5 TYR A 535
LEU A 690
TYR A 558
HIS A 559
ILE A 446
 None
 1.01A 2efjA-6arxA:
undetectable		 2efjA-6arxA:
11.48
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.
6c8s LOGANIC ACID
O-METHYLTRANSFERASE

(Catharanthus
roseus) 		no annotation 5 TYR A  31
TYR A 159
HIS A 162
TRP A 163
ILE A 320
 SAH  A 401 (-4.5A)
None
None
None
None
 0.44A 2efjA-6c8sA:
36.6		 2efjA-6c8sA:
11.32