SIMILAR PATTERNS OF AMINO ACIDS FOR 5IL1_A_SAMA601

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.
1cby DELTA-ENDOTOXIN CYTB

(Bacillus
thuringiensis) 		PF01338
(Bac_thur_toxin) 		5 ILE A  83
PRO A 188
LEU A 220
PHE A  64
GLY A  66
 None
 1.02A 5il1A-1cbyA:
undetectable		 5il1A-1cbyA:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dct PROTEIN
(MODIFICATION
METHYLASE HAEIII)

(Haemophilus
influenzae) 		PF00145
(DNA_methylase) 		5 ASP A  50
ILE A  51
PRO A  70
LEU A  90
PHE A   7
 None
 1.01A 5il1A-1dctA:
0.9		 5il1A-1dctA:
22.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hfu LACCASE 1

(Coprinopsis
cinerea) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 ASP A 213
ILE A 212
ARG A 259
ARG A 283
ASN A 188
 None
 1.12A 5il1A-1hfuA:
undetectable		 5il1A-1hfuA:
18.92
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.
1im8 YECO

(Haemophilus
influenzae) 		PF13649
(Methyltransf_25) 		5 ASP A 116
ILE A 117
ARG A 118
LEU A 137
GLY A  63
 SAI  A 302 (-3.1A)
SAI  A 302 (-4.1A)
SAI  A 302 ( 4.5A)
None
SAI  A 302 (-3.8A)
 1.07A 5il1A-1im8A:
undetectable		 5il1A-1im8A:
19.62
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.
1l1j HEAT SHOCK PROTEASE
HTRA

(Thermotoga
maritima) 		PF13365
(Trypsin_2) 		5 LEU A 246
SER A 148
GLU A 216
PHE A 145
ASN A 212
 None
 1.18A 5il1A-1l1jA:
undetectable		 5il1A-1l1jA:
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.
1oe5 SINGLE-STRAND
SELECTIVE
MONOFUNCTIONAL
URACIL DNA
GLYCOSYLASE

(Xenopus laevis) 		no annotation 5 ILE A 222
LEU A 270
PHE A  92
ASN A 174
GLY A 223
 None
None
None
URA  A1282 (-3.0A)
None
 1.26A 5il1A-1oe5A:
undetectable		 5il1A-1oe5A:
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.
1ugk SYNAPTOTAGMIN IV

(Homo sapiens) 		PF00168
(C2) 		5 ILE A  96
PRO A  35
LEU A  34
SER A   5
GLY A 109
 None
 1.32A 5il1A-1ugkA:
undetectable		 5il1A-1ugkA:
17.92
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.
2dpm PROTEIN
(ADENINE-SPECIFIC
METHYLTRANSFERASE
DPNII 1)

(Streptococcus
pneumoniae) 		PF02086
(MethyltransfD12) 		5 ASP A 177
PRO A 196
LYS A  21
GLU A  41
PHE A  43
 SAM  A 300 (-4.1A)
SAM  A 300 ( 4.1A)
SAM  A 300 (-4.8A)
None
SAM  A 300 (-4.2A)
 1.22A 5il1A-2dpmA:
undetectable		 5il1A-2dpmA:
19.32
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.
2fpg SUCCINYL-COA LIGASE
[GDP-FORMING]
ALPHA-CHAIN,
MITOCHONDRIAL

(Sus scrofa) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		5 ILE A 128
ARG A 126
SER A 181
LYS A 153
GLY A 185
 None
 0.99A 5il1A-2fpgA:
0.4		 5il1A-2fpgA:
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.
2h36 HYPOTHETICAL PROTEIN
SIFV0014

(Sulfolobus
islandicus
filamentous
virus) 		PF07118
(DUF1374) 		5 ILE X 100
LEU X  55
SER X  62
GLU X  88
PHE X  89
 None
 1.22A 5il1A-2h36X:
undetectable		 5il1A-2h36X:
18.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hne L-FUCONATE
DEHYDRATASE

(Xanthomonas
campestris) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 PRO A  15
SER A  33
PHE A 422
ARG A  13
GLY A 427
 None
 1.35A 5il1A-2hneA:
undetectable		 5il1A-2hneA:
19.30
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.
2i9k MODIFICATION
METHYLASE HHAI

(Haemophilus
haemolyticus) 		PF00145
(DNA_methylase) 		5 ASP A  60
ILE A  61
PRO A  80
LEU A 100
PHE A  18
 SAH  A 328 (-3.6A)
SAH  A 328 (-4.3A)
SAH  A 328 (-4.0A)
SAH  A 328 ( 4.9A)
SAH  A 328 (-4.9A)
 0.87A 5il1A-2i9kA:
4.9		 5il1A-2i9kA:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2j3m PROLYL-TRNA
SYNTHETASE

(Enterococcus
faecalis) 		PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon)
PF04073
(tRNA_edit) 		5 ILE A 278
PRO A 378
PHE A 376
ASN A 337
GLY A 334
 None
 1.20A 5il1A-2j3mA:
undetectable		 5il1A-2j3mA:
16.40
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.
2j8x URACIL-DNA
GLYCOSYLASE

(Human
gammaherpesvirus
4) 		PF03167
(UDG) 		5 ASP A 252
ARG A 254
PRO A 127
GLU A 121
ASN A 234
 None
 1.24A 5il1A-2j8xA:
undetectable		 5il1A-2j8xA:
21.89
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.
2k2q SURFACTIN SYNTHETASE
THIOESTERASE SUBUNIT

(Bacillus
subtilis) 		PF00975
(Thioesterase) 		5 PRO B 158
LEU B 188
SER B 162
ARG B 161
GLY B 199
 None
 1.07A 5il1A-2k2qB:
undetectable		 5il1A-2k2qB:
23.17
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.
2lqt COILED-COIL-HELIX-CO
ILED-COIL-HELIX
DOMAIN-CONTAINING
PROTEIN 7

(Homo sapiens) 		no annotation 5 ILE A  54
ARG A  73
PRO A  84
PHE A  50
ARG A  49
 None
 1.26A 5il1A-2lqtA:
undetectable		 5il1A-2lqtA:
19.40
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.
2nx9 OXALOACETATE
DECARBOXYLASE 2,
SUBUNIT ALPHA

(Vibrio cholerae) 		PF00682
(HMGL-like)
PF02436
(PYC_OADA) 		5 ILE A 328
ARG A 332
PRO A 301
LEU A 340
GLU A 309
 None
 1.17A 5il1A-2nx9A:
undetectable		 5il1A-2nx9A:
19.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o69 IRON-UTILIZATION
PERIPLASMIC PROTEIN

(Haemophilus
influenzae) 		PF01547
(SBP_bac_1) 		5 ASP A   1
ILE A  26
GLU A  23
PHE A  20
GLY A  25
 None
 1.37A 5il1A-2o69A:
undetectable		 5il1A-2o69A:
17.61
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.
2qip PROTEIN OF UNKNOWN
FUNCTION VPA0982

(Vibrio
parahaemolyticus) 		PF01936
(NYN) 		5 ASP A  92
LEU A 111
SER A  47
GLU A 101
GLY A  94
 None
 1.30A 5il1A-2qipA:
undetectable		 5il1A-2qipA:
20.59
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.
2qq8 TBC1 DOMAIN FAMILY
MEMBER 14

(Homo sapiens) 		PF00566
(RabGAP-TBC) 		5 ILE A 464
LEU A 504
SER A 477
PHE A 465
GLY A 469
 None
 1.34A 5il1A-2qq8A:
undetectable		 5il1A-2qq8A:
19.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rci TYPE-2BA CYTOLYTIC
DELTA-ENDOTOXIN

(Bacillus
thuringiensis) 		PF01338
(Bac_thur_toxin) 		5 ILE A  83
PRO A 188
LEU A 220
PHE A  64
GLY A  66
 ILE  A  83 ( 0.7A)
PRO  A 188 ( 1.1A)
LEU  A 220 ( 0.6A)
PHE  A  64 ( 1.3A)
GLY  A  66 ( 0.0A)
 0.91A 5il1A-2rciA:
undetectable		 5il1A-2rciA:
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.
2we8 XANTHINE
DEHYDROGENASE

(Mycolicibacterium
smegmatis) 		PF02625
(XdhC_CoxI)
PF13478
(XdhC_C) 		5 ASP A 270
ILE A 269
PRO A 296
GLU A 265
GLY A 267
 None
 1.35A 5il1A-2we8A:
1.8		 5il1A-2we8A:
18.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wtb FATTY ACID
MULTIFUNCTIONAL
PROTEIN (ATMFP2)

(Arabidopsis
thaliana) 		PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 ILE A 445
GLU A 414
PHE A 410
ARG A 438
GLY A 436
 None
 1.29A 5il1A-2wtbA:
undetectable		 5il1A-2wtbA:
14.90
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.
2xj9 MIPZ

(Caulobacter
vibrioides) 		PF09140
(MipZ) 		5 ASP A 236
PRO A  69
GLU A  53
PHE A  52
ARG A  56
 None
 1.27A 5il1A-2xj9A:
undetectable		 5il1A-2xj9A:
22.34
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.
2z5d UBIQUITIN-CONJUGATIN
G ENZYME E2 H

(Homo sapiens) 		PF00179
(UQ_con) 		5 ILE A  98
LEU A 128
PHE A  89
ARG A  73
GLY A 103
 None
 1.32A 5il1A-2z5dA:
undetectable		 5il1A-2z5dA:
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.
2z63 TOLL-LIKE RECEPTOR
4, VARIABLE
LYMPHOCYTE RECEPTOR
B

(Eptatretus
burgeri;
Homo sapiens) 		PF11921
(DUF3439)
PF13516
(LRR_6)
PF13855
(LRR_8) 		5 LEU A 404
SER A 416
GLU A 369
PHE A 396
GLY A 397
 None
 1.33A 5il1A-2z63A:
undetectable		 5il1A-2z63A:
17.97
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.
2z95 GDP-D-MANNOSE
DEHYDRATASE

(Aquifex
aeolicus) 		PF16363
(GDP_Man_Dehyd) 		5 ILE A 288
LEU A 199
GLU A 269
ARG A 254
GLY A 279
 None
 1.23A 5il1A-2z95A:
undetectable		 5il1A-2z95A:
21.59
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.
2zqp PREPROTEIN
TRANSLOCASE SECY
SUBUNIT

(Thermus
thermophilus) 		PF00344
(SecY) 		5 ILE Y 314
PRO Y 284
PHE Y 304
ASN Y 302
GLY Y 311
 None
 1.24A 5il1A-2zqpY:
undetectable		 5il1A-2zqpY:
19.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ak1 SUPEROXIDE DISMUTASE
[MN/FE]

(Aeropyrum
pernix) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		5 ILE A 104
LEU A 133
GLU A 112
PHE A 114
GLY A 110
 None
 1.29A 5il1A-3ak1A:
undetectable		 5il1A-3ak1A:
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.
3ayx MEMBRANE-BOUND
HYDROGENASE LARGE
SUBUNIT

(Hydrogenovibrio
marinus) 		PF00374
(NiFeSe_Hases) 		5 ILE A 182
ARG A  26
PRO A 134
LEU A 129
GLY A 181
 None
 1.23A 5il1A-3ayxA:
undetectable		 5il1A-3ayxA:
15.85
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.
3ccq 50S RIBOSOMAL
PROTEIN L4P

(Haloarcula
marismortui) 		PF00573
(Ribosomal_L4) 		5 ASP C  29
ILE C  31
ARG C  27
GLU C 221
GLY C  32
 None
None
G  0 657 ( 3.3A)
None
None
 1.29A 5il1A-3ccqC:
undetectable		 5il1A-3ccqC:
21.77
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.
3cg1 UPF0100 PROTEIN
PF0080

(Pyrococcus
furiosus) 		PF13531
(SBP_bac_11) 		5 PRO A  46
LEU A  43
GLU A 317
PHE A 316
GLY A 312
 None
 1.31A 5il1A-3cg1A:
undetectable		 5il1A-3cg1A:
23.84
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.
3co8 ALANINE RACEMASE

(Oenococcus oeni) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		5 ILE A 333
SER A  17
GLU A  12
PHE A 246
GLY A 334
 None
 1.37A 5il1A-3co8A:
undetectable		 5il1A-3co8A:
21.56
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.
3eb0 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Cryptosporidium
parvum) 		PF00069
(Pkinase) 		5 ASP A 224
ILE A 157
LEU A 183
GLU A 360
GLY A 155
 None
 1.36A 5il1A-3eb0A:
undetectable		 5il1A-3eb0A:
18.64
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.
3fxi TOLL-LIKE RECEPTOR 4

(Homo sapiens) 		PF13516
(LRR_6)
PF13855
(LRR_8) 		5 LEU A 404
SER A 416
GLU A 369
PHE A 396
GLY A 397
 None
 1.35A 5il1A-3fxiA:
undetectable		 5il1A-3fxiA:
15.46
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.
3gux PUTATIVE
ZN-DEPENDENT
EXOPEPTIDASE

(Bacteroides
vulgatus) 		PF04389
(Peptidase_M28) 		5 ASP A 174
ILE A 119
ARG A 118
GLU A 245
GLY A 219
 None
 1.34A 5il1A-3guxA:
2.0		 5il1A-3guxA:
19.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hhd FATTY ACID SYNTHASE

(Homo sapiens) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 ILE A 800
LEU A 815
SER A 509
PHE A 796
GLY A 799
 None
 1.37A 5il1A-3hhdA:
undetectable		 5il1A-3hhdA:
12.66
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.
3htz ALANYL-TRNA
SYNTHETASE

(Aquifex
aeolicus) 		PF01411
(tRNA-synt_2c) 		5 ILE A 225
LEU A 118
GLU A 191
ASN A 194
GLY A 221
 None
 1.29A 5il1A-3htzA:
undetectable		 5il1A-3htzA:
19.46
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.
3k5j SUPPRESSOR OF FUSED
FAMILY PROTEIN

(Neisseria
gonorrhoeae) 		PF05076
(SUFU) 		5 ILE A 167
LEU A 140
GLU A 164
PHE A 162
GLY A 166
 None
 1.37A 5il1A-3k5jA:
undetectable		 5il1A-3k5jA:
22.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kxy EXOENZYME S
SYNTHESIS PROTEIN C

(Pseudomonas
aeruginosa) 		PF05932
(CesT) 		5 ILE A  18
LEU A  33
GLU A  13
PHE A  14
GLY A  16
 None
 1.27A 5il1A-3kxyA:
undetectable		 5il1A-3kxyA:
21.56
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.
3m5u PHOSPHOSERINE
AMINOTRANSFERASE

(Campylobacter
jejuni) 		PF00266
(Aminotran_5) 		5 LEU A 338
SER A 296
PHE A   6
ARG A 331
GLY A 320
 None
 1.36A 5il1A-3m5uA:
undetectable		 5il1A-3m5uA:
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.
3m62 UBIQUITIN
CONJUGATION FACTOR
E4

(Saccharomyces
cerevisiae) 		PF04564
(U-box)
PF10408
(Ufd2P_core) 		5 ILE A 120
LEU A 102
GLU A  58
PHE A  57
GLY A 119
 None
 1.25A 5il1A-3m62A:
undetectable		 5il1A-3m62A:
11.46
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.
3nhe UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 2

(Homo sapiens) 		PF00443
(UCH) 		5 ILE A 343
LEU A 282
GLU A 360
PHE A 361
ARG A 363
 None
 1.18A 5il1A-3nheA:
undetectable		 5il1A-3nheA:
17.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o6x GLUTAMINE SYNTHETASE

(Bacteroides
fragilis) 		PF00120
(Gln-synt_C)
PF12437
(GSIII_N) 		5 ASP A 231
ARG A 229
LEU A 725
SER A 339
GLY A 236
 None
 1.27A 5il1A-3o6xA:
undetectable		 5il1A-3o6xA:
15.14
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.
3one ADENOSYLHOMOCYSTEINA
SE

(Lupinus luteus) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		5 ILE A 387
LEU A 360
PHE A 380
ASN A 384
GLY A 386
 None
 1.12A 5il1A-3oneA:
undetectable		 5il1A-3oneA:
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.
3oqc UFM1-SPECIFIC
PROTEASE 2

(Mus musculus) 		PF07910
(Peptidase_C78) 		5 ASP A 143
ILE A   7
ARG A   6
SER A  52
ARG A  48
 None
 1.36A 5il1A-3oqcA:
undetectable		 5il1A-3oqcA:
18.56
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.
3pic CIP2

(Trichoderma
reesei) 		no annotation 5 ILE A 103
PRO A 351
LEU A 105
SER A 356
PHE A 118
 None
 1.36A 5il1A-3picA:
undetectable		 5il1A-3picA:
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.
3qxi ENOYL-COA HYDRATASE
ECHA1

(Mycobacterium
marinum) 		PF00378
(ECH_1) 		5 PRO A  96
LEU A 100
GLU A  93
PHE A  91
GLY A  90
 None
 1.19A 5il1A-3qxiA:
undetectable		 5il1A-3qxiA:
23.88
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.
3r2i EXOTOXIN 5

(Staphylococcus
aureus) 		PF02876
(Stap_Strp_tox_C)
PF09199
(SSL_OB) 		5 ASP A 169
ILE A 172
ARG A 173
LEU A 206
ASN A 226
 None
 0.89A 5il1A-3r2iA:
undetectable		 5il1A-3r2iA:
21.59
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.
3r2t PUTATIVE
UNCHARACTERIZED
PROTEIN

(Staphylococcus
aureus) 		PF02876
(Stap_Strp_tox_C)
PF09199
(SSL_OB) 		5 ASP A 169
ILE A 172
ARG A 173
LEU A 206
ASN A 226
 None
 0.91A 5il1A-3r2tA:
undetectable		 5il1A-3r2tA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rcz DNA REPAIR PROTEIN
RAD60
SUMO-CONJUGATING
ENZYME UBC9

(Schizosaccharomyces
pombe;
Schizosaccharomyces
pombe) 		PF11976
(Rad60-SLD)
PF00179
(UQ_con) 		5 ILE B  45
PRO B  21
SER A 402
PHE B  24
GLY B  44
 None
 1.24A 5il1A-3rczB:
undetectable		 5il1A-3rczB:
18.89
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.
3rg1 CD180 MOLECULE

(Bos taurus) 		PF00560
(LRR_1)
PF13855
(LRR_8) 		5 ILE A 143
PRO A 171
LEU A 148
PHE A 170
ASN A 165
 None
 1.19A 5il1A-3rg1A:
undetectable		 5il1A-3rg1A:
16.00
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.
3s4d LACTOSE
PHOSPHORYLASE

(Cellulomonas
uda) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		5 LEU A 527
SER A 518
GLU A 593
PHE A 597
GLY A 596
 None
 1.37A 5il1A-3s4dA:
undetectable		 5il1A-3s4dA:
13.41
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.
3tma METHYLTRANSFERASE

(Thermus
thermophilus) 		PF01170
(UPF0020)
PF02926
(THUMP) 		5 ASP A 243
PRO A 262
LEU A 276
PHE A 192
ARG A 221
 None
 1.22A 5il1A-3tmaA:
1.6		 5il1A-3tmaA:
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.
3u1t DMMA HALOALKANE
DEHALOGENASE

(unidentified) 		PF00561
(Abhydrolase_1) 		5 ILE A 130
PRO A 102
LEU A  73
SER A 110
GLY A 128
 None
 1.33A 5il1A-3u1tA:
undetectable		 5il1A-3u1tA:
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.
3vom PUTATIVE
PHOSPHOSERINE
AMINOTRANSFERASE

(Mycobacterium
tuberculosis) 		PF00266
(Aminotran_5) 		5 ASP A 316
ARG A 346
LEU A 344
SER A 179
LYS A 200
 None
None
None
PLP  A 401 ( 3.9A)
PLP  A 401 (-2.6A)
 1.09A 5il1A-3vomA:
undetectable		 5il1A-3vomA:
16.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w21 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Burkholderia
ambifaria) 		no annotation 5 ILE A 127
LEU A 170
GLU A 134
PHE A 135
ASN A 104
 None
 1.24A 5il1A-3w21A:
undetectable		 5il1A-3w21A:
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.
4ab4 XENOBIOTIC REDUCTASE
B

(Pseudomonas
putida) 		PF00724
(Oxidored_FMN) 		5 ASP A 268
ILE A 270
ARG A 229
SER A 186
GLU A 242
 None
 1.34A 5il1A-4ab4A:
undetectable		 5il1A-4ab4A:
20.45
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.
4ewp 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Micrococcus
luteus) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 ARG A 256
LEU A 289
PHE A 285
ARG A 280
ASN A 278
 None
 1.23A 5il1A-4ewpA:
undetectable		 5il1A-4ewpA:
18.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gek TRNA
(CMO5U34)-METHYLTRAN
SFERASE

(Escherichia
coli) 		PF13649
(Methyltransf_25) 		5 ASP A 117
ILE A 118
ARG A 119
LEU A 138
GLY A  64
 GEK  A 302 (-3.2A)
GEK  A 302 (-3.8A)
None
None
GEK  A 302 (-3.7A)
 1.02A 5il1A-4gekA:
4.1		 5il1A-4gekA:
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.
4gl8 OLIGOPEPTIDE ABC
TRANSPORTER OPPAIV

(Borreliella
burgdorferi) 		PF00496
(SBP_bac_5) 		5 ILE A 240
PRO A 209
SER A 103
GLU A 224
PHE A 210
 None
 1.24A 5il1A-4gl8A:
undetectable		 5il1A-4gl8A:
16.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hzp BIFUNCTIONAL
METHYLMALONYL-COA:AC
P
ACYLTRANSFERASE/DECA
RBOXYLASE

(Streptomyces
atroolivaceus) 		no annotation 5 ASP A 255
ARG A  69
PRO A 128
GLU A  75
GLY A  73
 None
SO4  A 404 (-3.0A)
None
None
None
 1.17A 5il1A-4hzpA:
undetectable		 5il1A-4hzpA:
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.
4iig BETA-GLUCOSIDASE 1

(Aspergillus
aculeatus) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 ARG A 604
PRO A 553
LEU A 524
SER A 596
GLY A 149
 None
 1.36A 5il1A-4iigA:
undetectable		 5il1A-4iigA:
13.38
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.
4l0o CYSTATHIONINE
GAMMA-SYNTHASE

(Helicobacter
pylori) 		no annotation 5 ILE H 242
PRO H 176
LEU H  62
SER H 294
GLY H 198
 None
 1.28A 5il1A-4l0oH:
1.5		 5il1A-4l0oH:
20.05
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.
4mo0 PROTEIN TRANSLATION
FACTOR SUI1 HOMOLOG

(Methanocaldococcus
jannaschii) 		PF01253
(SUI1) 		5 ILE A  27
SER A  49
PHE A  46
ASN A  73
GLY A  45
 None
 1.35A 5il1A-4mo0A:
undetectable		 5il1A-4mo0A:
18.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p7h MYOSIN-7,GREEN
FLUORESCENT PROTEIN

(Aequorea
victoria;
Homo sapiens) 		PF00063
(Myosin_head)
PF01353
(GFP)
PF02736
(Myosin_N) 		5 PRO A 876
LEU A 794
GLU A 902
PHE A 901
GLY A 903
 None
 1.36A 5il1A-4p7hA:
undetectable		 5il1A-4p7hA:
12.17
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.
4q2w PUTATIVE
ENDO-BETA-N-ACETYLGL
UCOSAMINIDASE

(Streptococcus
pneumoniae) 		PF01832
(Glucosaminidase) 		5 ILE A 229
LEU A 162
GLU A 173
PHE A 169
ASN A 179
 None
None
GOL  A 303 ( 4.9A)
None
None
 1.35A 5il1A-4q2wA:
undetectable		 5il1A-4q2wA:
19.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qg5 PUTATIVE
PHOSPHOGLUCOMUTASE

(Leishmania
major) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 PRO A 261
SER A 118
GLU A 397
PHE A 400
GLY A 401
 None
MG  A 601 (-1.9A)
None
None
None
 1.36A 5il1A-4qg5A:
undetectable		 5il1A-4qg5A:
15.50
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.
4qi7 CELLOBIOSE
DEHYDROGENASE

(Neurospora
crassa) 		PF00732
(GMC_oxred_N)
PF00734
(CBM_1)
PF05199
(GMC_oxred_C)
PF16010
(CDH-cyt) 		5 ASP A 711
ARG A 713
LEU A 521
SER A 738
GLY A 708
 None
 1.37A 5il1A-4qi7A:
undetectable		 5il1A-4qi7A:
13.64
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.
4rns PCP DEGRADATION
TRANSCRIPTIONAL
ACTIVATION PROTEIN

(Sphingobium
chlorophenolicum) 		PF03466
(LysR_substrate) 		5 ILE A 273
ARG A 168
GLU A 209
ASN A 205
GLY A 153
 None
 1.33A 5il1A-4rnsA:
undetectable		 5il1A-4rnsA:
22.04
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.
4upe NICKEL-DEPENDENT
HYDROGENASE LARGE
SUBUNIT

(Desulfovibrio
fructosivorans) 		PF00374
(NiFeSe_Hases) 		5 ILE Q 178
ARG Q  23
LEU Q 125
PHE Q 179
GLY Q 177
 None
 1.34A 5il1A-4upeQ:
undetectable		 5il1A-4upeQ:
16.85
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.
4wep PUTATIVE
OSMOPROTECTANT
UPTAKE SYSTEM
SUBSTRATE-BINDING
PROTEIN OSMF

(Escherichia
coli) 		PF04069
(OpuAC) 		5 ILE A  43
PRO A 247
LEU A 264
GLU A  36
GLY A  41
 None
 1.18A 5il1A-4wepA:
undetectable		 5il1A-4wepA:
22.03
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.
5a89 RIBOFLAVIN
BIOSYNTHESIS PROTEIN
RIBF

(Corynebacterium
ammoniagenes) 		PF01687
(Flavokinase) 		5 ILE A 252
PRO A 220
GLU A 286
PHE A 287
GLY A 227
 None
 1.20A 5il1A-5a89A:
undetectable		 5il1A-5a89A:
21.53
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.
5aq6 METAL-BINDING
PROTEIN ZINT

(Escherichia
coli) 		PF09223
(ZinT) 		5 ASP A  81
ILE A  82
PRO A 136
SER A 133
GLU A  93
 None
None
None
None
ZN  A1196 (-2.9A)
 1.32A 5il1A-5aq6A:
undetectable		 5il1A-5aq6A:
19.37
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.
5dvj BINDING PROTEIN
COMPONENT OF ABC
SUGAR TRANSPORTER

(Pseudomonas
putida) 		PF01547
(SBP_bac_1) 		5 ILE A 266
PRO A 292
LEU A 169
GLU A 198
PHE A 291
 GOL  A 502 (-3.9A)
None
None
None
None
 1.25A 5il1A-5dvjA:
undetectable		 5il1A-5dvjA:
17.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5iic MALTOSE-BINDING
PERIPLASMIC
PROTEIN,VITELLINE
ENVELOPE SPERM LYSIN
RECEPTOR

(Escherichia
coli;
Haliotis
rufescens) 		PF11386
(VERL)
PF13416
(SBP_bac_8) 		5 ILE A4317
ARG A4323
LEU A4422
LYS A4011
GLU A4122
 None
None
None
None
MAL  A4501 (-3.8A)
 1.37A 5il1A-5iicA:
undetectable		 5il1A-5iicA:
18.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5il0 METTL3

(Homo sapiens) 		PF05063
(MT-A70) 		9 ASP A 377
ILE A 378
ARG A 379
LEU A 409
GLU A 532
PHE A 534
ARG A 536
ASN A 539
GLY A 548
 None
 1.09A 5il1A-5il0A:
32.6		 5il1A-5il0A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5il0 METTL3

(Homo sapiens) 		PF05063
(MT-A70) 		9 ASP A 377
ILE A 378
ARG A 379
PRO A 397
LEU A 409
GLU A 532
PHE A 534
ASN A 539
GLY A 548
 None
 0.42A 5il1A-5il0A:
32.6		 5il1A-5il0A:
100.00
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.
5j98 VP3

(Slow bee
paralysis virus) 		PF00073
(Rhv) 		5 ILE C 232
LEU C 145
GLU C 179
PHE C 135
GLY C 136
 None
 1.33A 5il1A-5j98C:
undetectable		 5il1A-5j98C:
18.89
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.
5jol PLASTIN-2

(Homo sapiens) 		PF13499
(EF-hand_7) 		5 ILE A  53
ARG A  49
LEU A  45
SER A   5
GLU A  73
 None
 1.24A 5il1A-5jolA:
undetectable		 5il1A-5jolA:
18.09
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.
5k7m N6-ADENOSINE-METHYLT
RANSFERASE SUBUNIT
METTL14

(Homo sapiens) 		PF05063
(MT-A70) 		6 ASP B 173
ILE B 174
PRO B 194
LYS B 326
PHE B 347
GLY B 361
 None
 0.68A 5il1A-5k7mB:
21.5		 5il1A-5k7mB:
25.08
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.
5l46 DIMETHYLGLYCINE
DEHYDROGENASE,
MITOCHONDRIAL

(Homo sapiens) 		PF01266
(DAO)
PF01571
(GCV_T)
PF08669
(GCV_T_C)
PF16350
(FAO_M) 		5 ILE A 169
LEU A 176
ARG A 136
ASN A 187
GLY A 184
 None
 1.33A 5il1A-5l46A:
undetectable		 5il1A-5l46A:
13.26
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.
5l6e N6-ADENOSINE-METHYLT
RANSFERASE SUBUNIT
METTL14

(Homo sapiens) 		PF05063
(MT-A70) 		6 ASP B 173
ILE B 174
PRO B 194
LYS B 326
PHE B 347
GLY B 361
 None
 1.19A 5il1A-5l6eB:
20.2		 5il1A-5l6eB:
25.95
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.
5mr7 GRAINYHEAD-LIKE
PROTEIN 2 HOMOLOG

(Homo sapiens) 		no annotation 5 ILE A 344
LEU A 280
GLU A 348
PHE A 357
GLY A 345
 None
 1.37A 5il1A-5mr7A:
undetectable		 5il1A-5mr7A:
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.
5n6u BETA-MANNOSIDASE

(Dictyoglomus
thermophilum) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		5 ASP A  85
ILE A  84
GLU A  80
ARG A 410
GLY A  83
 None
 1.15A 5il1A-5n6uA:
undetectable		 5il1A-5n6uA:
14.70
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.
5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1

(Homo sapiens) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		5 ILE A2016
LEU A2028
SER A4210
ARG A2037
GLY A1902
 None
 1.31A 5il1A-5nugA:
undetectable		 5il1A-5nugA:
3.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5tey N6-ADENOSINE-METHYLT
RANSFERASE 70 KDA
SUBUNIT

(Homo sapiens) 		PF05063
(MT-A70) 		10 ASP A 377
ILE A 378
ARG A 379
PRO A 397
LEU A 409
LYS A 513
GLU A 532
PHE A 534
ASN A 539
GLY A 548
 SAH  A 601 (-3.2A)
SAH  A 601 (-3.9A)
SAH  A 601 ( 4.7A)
SAH  A 601 (-4.3A)
None
SAH  A 601 (-4.9A)
SAH  A 601 ( 4.9A)
SAH  A 601 (-4.7A)
SAH  A 601 (-3.1A)
SAH  A 601 ( 3.8A)
 0.16A 5il1A-5teyA:
32.0		 5il1A-5teyA:
99.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5tey N6-ADENOSINE-METHYLT
RANSFERASE 70 KDA
SUBUNIT

(Homo sapiens) 		PF05063
(MT-A70) 		10 ASP A 377
ILE A 378
ARG A 379
PRO A 397
LEU A 409
SER A 511
LYS A 513
GLU A 532
PHE A 534
GLY A 548
 SAH  A 601 (-3.2A)
SAH  A 601 (-3.9A)
SAH  A 601 ( 4.7A)
SAH  A 601 (-4.3A)
None
SAH  A 601 (-4.6A)
SAH  A 601 (-4.9A)
SAH  A 601 ( 4.9A)
SAH  A 601 (-4.7A)
SAH  A 601 ( 3.8A)
 0.52A 5il1A-5teyA:
32.0		 5il1A-5teyA:
99.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5tey N6-ADENOSINE-METHYLT
RANSFERASE 70 KDA
SUBUNIT

(Homo sapiens) 		PF05063
(MT-A70) 		7 ILE A 378
PRO A 397
LEU A 409
GLU A 532
PHE A 534
ARG A 536
ASN A 539
 SAH  A 601 (-3.9A)
SAH  A 601 (-4.3A)
None
SAH  A 601 ( 4.9A)
SAH  A 601 (-4.7A)
SAH  A 601 (-3.7A)
SAH  A 601 (-3.1A)
 0.96A 5il1A-5teyA:
32.0		 5il1A-5teyA:
99.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5tey N6-ADENOSINE-METHYLT
RANSFERASE 70 KDA
SUBUNIT

(Homo sapiens) 		PF05063
(MT-A70) 		7 ILE A 378
PRO A 397
LEU A 409
SER A 511
GLU A 532
PHE A 534
ARG A 536
 SAH  A 601 (-3.9A)
SAH  A 601 (-4.3A)
None
SAH  A 601 (-4.6A)
SAH  A 601 ( 4.9A)
SAH  A 601 (-4.7A)
SAH  A 601 (-3.7A)
 1.16A 5il1A-5teyA:
32.0		 5il1A-5teyA:
99.53
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.
5tey N6-ADENOSINE-METHYLT
RANSFERASE SUBUNIT
METTL14

(Homo sapiens) 		PF05063
(MT-A70) 		6 ASP B 173
ILE B 174
PRO B 194
LYS B 326
PHE B 347
GLY B 361
 None
UNX  B 407 ( 4.2A)
None
None
None
None
 1.16A 5il1A-5teyB:
19.9		 5il1A-5teyB:
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.
5xag TUBULIN TYROSINE
LIGASE

(Gallus gallus) 		no annotation 5 LEU F 295
SER F  76
GLU F 331
ARG F  73
GLY F 334
 None
None
ACP  F 402 (-3.5A)
None
None
 1.30A 5il1A-5xagF:
undetectable		 5il1A-5xagF:
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.
5xd7 3,6-ANHYDRO-ALPHA-L-
GALACTONATE
CYCLOISOMERASE

(Vibrio sp. EJY3) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A 170
ARG A 172
LEU A 144
SER A 322
GLU A 224
 None
None
None
None
MG  A 402 (-3.3A)
 1.31A 5il1A-5xd7A:
undetectable		 5il1A-5xd7A:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xj6 GLYCEROL-3-PHOSPHATE
ACYLTRANSFERASE

(Aquifex
aeolicus) 		no annotation 5 ILE A 167
LEU A 163
SER A 124
PHE A 150
GLY A 170
 None
 1.37A 5il1A-5xj6A:
undetectable		 5il1A-5xj6A:
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.
6brr DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 3A

(Homo sapiens) 		no annotation 5 ASP A 686
ARG A 688
PRO A 709
LEU A 730
PHE A 640
 SAH  A1001 (-3.0A)
None
SAH  A1001 (-3.7A)
SAH  A1001 (-4.8A)
SAH  A1001 (-4.4A)
 0.79A 5il1A-6brrA:
undetectable		 5il1A-6brrA:
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.
6c6s -

(-) 		no annotation 5 ILE D  38
SER D 153
GLU D 158
ARG D 138
GLY D  41
 None
 1.30A 5il1A-6c6sD:
undetectable		 5il1A-6c6sD:
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.
6d6u GAMMA-AMINOBUTYRIC
ACID RECEPTOR
SUBUNIT
BETA-2,GAMMA-AMINOBU
TYRIC ACID RECEPTOR
SUBUNIT BETA-2
GAMMA-AMINOBUTYRIC
ACID RECEPTOR
SUBUNIT
ALPHA-1,GAMMA-AMINOB
UTYRIC ACID RECEPTOR
SUBUNIT ALPHA-1

(Homo sapiens;
Homo sapiens) 		no annotation
no annotation 		5 ASP A 163
ARG A  28
PRO A  94
ASN B 116
GLY A 158
 None
 1.33A 5il1A-6d6uA:
undetectable		 5il1A-6d6uA:
18.47
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.
6epd 26S PROTEASOME
SUBUNIT S5A

(Rattus
norvegicus) 		no annotation 5 ILE W  90
LEU W 124
SER W 115
PHE W  86
GLY W  89
 None
 1.21A 5il1A-6epdW:
undetectable		 5il1A-6epdW:
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.
6fd5 -

(-) 		no annotation 5 ASP A  65
ILE A  86
ARG A  87
LEU A  92
GLU A 141
 None
 1.01A 5il1A-6fd5A:
undetectable		 5il1A-6fd5A:
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.
6gct NEUTRAL AMINO ACID
TRANSPORTER B(0)

(Homo sapiens) 		no annotation 5 ILE A 340
LEU A 477
PHE A 336
ARG A 335
GLY A 339
 None
 1.32A 5il1A-6gctA:
undetectable		 5il1A-6gctA:
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.
2ong 4S-LIMONENE SYNTHASE

(Mentha spicata) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		4 ASP A 353
HIS A 579
ASN A  64
GLN A 582
 None
FPG  A 600 (-3.3A)
None
None
 1.35A 5il1A-2ongA:
undetectable		 5il1A-2ongA:
17.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qf5 CELL SHAPE
DETERMINING PROTEIN
MREC

(Streptococcus
pneumoniae) 		PF04085
(MreC) 		4 ASP A 201
HIS A 261
ASN A 171
GLN A 128
 None
 1.26A 5il1A-2qf5A:
0.0		 5il1A-2qf5A:
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.
3kl0 GLUCURONOXYLANASE
XYNC

(Bacillus
subtilis) 		PF17189
(Glyco_hydro_30C) 		4 ASP A  57
HIS A 117
ASN A 139
GLN A 138
 None
 1.28A 5il1A-3kl0A:
0.7		 5il1A-3kl0A:
19.62
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.
3t5o COMPLEMENT COMPONENT
C6

(Homo sapiens) 		PF00057
(Ldl_recept_a)
PF00084
(Sushi)
PF00090
(TSP_1)
PF01823
(MACPF) 		4 ASP A 315
HIS A 312
ASN A 174
GLN A 170
 None
 1.44A 5il1A-3t5oA:
0.0		 5il1A-3t5oA:
11.69
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.
4g76 PHOSPHODIESTERASE

(Pseudomonas
aeruginosa) 		PF14859
(Colicin_M) 		4 ASP A 135
HIS A 150
ASN A  98
GLN A  94
 None
 1.42A 5il1A-4g76A:
0.0		 5il1A-4g76A:
20.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h41 PUTATIVE
ALPHA-L-FUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF14488
(DUF4434)
PF17134
(DUF5109) 		4 ASP A  66
HIS A  70
ASN A 299
GLN A 269
 None
1PE  A 406 ( 2.7A)
UNL  A 401 ( 3.6A)
UNL  A 401 ( 3.7A)
 1.48A 5il1A-4h41A:
0.0		 5il1A-4h41A:
19.88
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.
4qaw XYN30D

(Paenibacillus
barcinonensis) 		PF03422
(CBM_6)
PF17189
(Glyco_hydro_30C) 		4 ASP A  56
HIS A 115
ASN A 137
GLN A 136
 None
 1.29A 5il1A-4qawA:
0.9		 5il1A-4qawA:
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.
4uq9 CARBOHYDRATE BINDING
FAMILY 6

(Ruminiclostridium
thermocellum) 		PF17189
(Glyco_hydro_30C) 		4 ASP A  53
HIS A 113
ASN A 135
GLN A 134
 None
 1.27A 5il1A-4uq9A:
1.0		 5il1A-4uq9A:
17.71