SIMILAR PATTERNS OF AMINO ACIDS FOR 1FE2_A_LAXA700_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.
1avb ARCELIN-1

(Phaseolus
vulgaris) 		PF00139
(Lectin_legB) 		5 VAL A 186
PHE A  69
VAL A 156
ILE A  54
LEU A 167
 None
 1.21A 1fe2A-1avbA:
undetectable		 1fe2A-1avbA:
15.60
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.
1e91 PAIRED AMPHIPATHIC
HELIX PROTEIN SIN3B

(Mus musculus) 		PF02671
(PAH) 		5 PHE A  76
VAL A  58
TYR A  13
VAL A  14
LEU A  32
 None
 1.06A 1fe2A-1e91A:
undetectable		 1fe2A-1e91A:
11.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ebv PROSTAGLANDIN H2
SYNTHASE

(Ovis aries) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		10 VAL A 116
ARG A 120
PHE A 205
VAL A 228
VAL A 344
TYR A 348
VAL A 349
ASN A 375
ILE A 523
LEU A 531
 None
SCL  A 700 (-3.9A)
OAS  A 530 ( 4.7A)
None
None
None
SCL  A 700 ( 4.6A)
None
SCL  A 700 (-3.4A)
OAS  A 530 (-4.1A)
 0.30A 1fe2A-1ebvA:
61.4		 1fe2A-1ebvA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ebv PROSTAGLANDIN H2
SYNTHASE

(Ovis aries) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		5 VAL A 116
ARG A 120
PHE A 209
ILE A 523
LEU A 531
 None
SCL  A 700 (-3.9A)
None
SCL  A 700 (-3.4A)
OAS  A 530 (-4.1A)
 1.19A 1fe2A-1ebvA:
61.4		 1fe2A-1ebvA:
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.
1g1e SIN3A

(Mus musculus) 		PF02671
(PAH) 		5 PHE B 376
VAL B 358
TYR B 310
VAL B 311
LEU B 329
 None
 1.04A 1fe2A-1g1eB:
undetectable		 1fe2A-1g1eB:
11.47
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.
1kr1 HEVAMINE A

(Hevea
brasiliensis) 		PF00704
(Glyco_hydro_18) 		5 TYR A 190
VAL A 230
ASN A 203
ILE A 236
LEU A 216
 None
 1.24A 1fe2A-1kr1A:
0.0		 1fe2A-1kr1A:
19.43
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.
1mdf 2,3-DIHYDROXYBENZOAT
E-AMP LIGASE

(Bacillus
subtilis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 VAL A 217
ARG A 341
VAL A 318
VAL A 305
VAL A 329
 None
SO4  A 996 (-4.4A)
None
None
None
 1.14A 1fe2A-1mdfA:
0.0		 1fe2A-1mdfA:
21.14
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.
1pox PYRUVATE OXIDASE

(Lactobacillus
plantarum) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 PHE A 472
VAL A 376
VAL A 470
ASN A 381
ILE A 414
 None
 1.17A 1fe2A-1poxA:
0.0		 1fe2A-1poxA:
20.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1q9c SON OF SEVENLESS
PROTEIN

(Homo sapiens) 		PF00125
(Histone) 		5 VAL A  30
TYR A  47
VAL A  48
ILE A 137
LEU A 142
 None
 1.03A 1fe2A-1q9cA:
undetectable		 1fe2A-1q9cA:
14.51
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.
1qot CHITIN BINDING
LECTIN, UEA-II

(Ulex europaeus) 		PF00139
(Lectin_legB) 		5 VAL A 200
PHE A  73
VAL A 170
ILE A  58
LEU A 181
 None
 1.21A 1fe2A-1qotA:
undetectable		 1fe2A-1qotA:
16.17
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.
1sp8 4-HYDROXYPHENYLPYRUV
ATE DIOXYGENASE

(Zea mays) 		PF00903
(Glyoxalase) 		5 VAL A 270
VAL A 181
VAL A 138
ASN A 275
LEU A 272
 None
 1.10A 1fe2A-1sp8A:
0.0		 1fe2A-1sp8A:
22.47
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.
1sy6 T-CELL SURFACE
GLYCOPROTEIN CD3
GAMMA/EPSILON CHAIN

(Homo sapiens) 		PF16680
(Ig_4)
PF16681
(Ig_5) 		5 PHE A 172
VAL A 130
VAL A 123
ASN A 147
LEU A 197
 None
 1.24A 1fe2A-1sy6A:
0.0		 1fe2A-1sy6A:
14.41
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.
1udq RIBONUCLEASE PH

(Aquifex
aeolicus) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		5 VAL A  14
VAL A 164
VAL A 162
ILE A 229
LEU A  11
 None
 1.00A 1fe2A-1udqA:
0.0		 1fe2A-1udqA:
17.22
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.
1ve3 HYPOTHETICAL PROTEIN
PH0226

(Pyrococcus
horikoshii) 		PF13649
(Methyltransf_25) 		5 VAL A 124
VAL A  64
VAL A  66
ILE A  68
LEU A  97
 None
None
None
SAM  A 302 (-3.7A)
None
 1.01A 1fe2A-1ve3A:
undetectable		 1fe2A-1ve3A:
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.
1wu2 MOLYBDOPTERIN
BIOSYNTHESIS MOEA
PROTEIN

(Pyrococcus
horikoshii) 		PF00994
(MoCF_biosynth)
PF03453
(MoeA_N)
PF03454
(MoeA_C) 		5 VAL A 319
VAL A 254
VAL A 185
ASN A 308
LEU A 315
 None
 1.18A 1fe2A-1wu2A:
undetectable		 1fe2A-1wu2A:
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.
1xiw T-CELL SURFACE
GLYCOPROTEIN CD3
EPSILON CHAIN

(Homo sapiens) 		PF16681
(Ig_5) 		5 PHE A  66
VAL A  24
VAL A  17
ASN A  41
LEU A  91
 None
 1.23A 1fe2A-1xiwA:
undetectable		 1fe2A-1xiwA:
11.43
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.
1ytu HYPOTHETICAL PROTEIN
AF1318

(Archaeoglobus
fulgidus) 		PF02171
(Piwi) 		5 VAL A 253
VAL A 246
VAL A 234
ILE A 267
LEU A 251
 None
 1.08A 1fe2A-1ytuA:
undetectable		 1fe2A-1ytuA:
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.
1yy3 S-ADENOSYLMETHIONINE
:TRNA
RIBOSYLTRANSFERASE-I
SOMERASE

(Bacillus
subtilis) 		PF02547
(Queuosine_synth) 		5 VAL A 242
ARG A 243
VAL A  57
ILE A 291
LEU A 239
 None
 1.21A 1fe2A-1yy3A:
undetectable		 1fe2A-1yy3A:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b30 PVIVAX HYPOTHETICAL
PROTEIN

(Plasmodium
vivax) 		PF08282
(Hydrolase_3) 		5 VAL A 296
PHE A  79
VAL A  46
VAL A  64
LEU A 293
 None
 1.07A 1fe2A-2b30A:
undetectable		 1fe2A-2b30A:
18.88
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.
2b39 C3

(Bos taurus) 		PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl) 		5 ARG A1049
PHE A 221
VAL A 223
VAL A 144
ASN A 199
 None
 1.17A 1fe2A-2b39A:
undetectable		 1fe2A-2b39A:
15.88
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.
2bec CALCINEURIN B
HOMOLOGOUS PROTEIN 2

(Homo sapiens) 		PF13202
(EF-hand_5)
PF13499
(EF-hand_7) 		5 ARG A  30
VAL A  78
VAL A  86
ILE A 194
LEU A  31
 None
 1.13A 1fe2A-2becA:
undetectable		 1fe2A-2becA:
15.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e1m L-GLUTAMATE OXIDASE

(Streptomyces
sp. X-119-6) 		PF01593
(Amino_oxidase) 		5 VAL A 384
PHE B 419
VAL C 640
VAL B 415
VAL B 413
 None
 1.20A 1fe2A-2e1mA:
undetectable		 1fe2A-2e1mA:
20.21
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.
2his CELLULOMONAS FIMI
FAMILY 10
BETA-1,4-GLYCANASE

(Cellulomonas
fimi) 		PF00331
(Glyco_hydro_10) 		5 PHE A 202
VAL A 173
VAL A 200
VAL A 227
ASN A 181
 None
 1.12A 1fe2A-2hisA:
undetectable		 1fe2A-2hisA:
19.10
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.
2l4q THIOREDOXIN

(Mycobacterium
tuberculosis) 		PF00085
(Thioredoxin) 		5 VAL A 111
PHE A  17
VAL A  21
ILE A  50
LEU A  85
 None
 0.97A 1fe2A-2l4qA:
undetectable		 1fe2A-2l4qA:
12.43
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.
2p0y HYPOTHETICAL PROTEIN
LP_0780

(Lactobacillus
plantarum) 		PF01933
(UPF0052) 		5 VAL A 117
VAL A  40
ASN A 122
ILE A  13
LEU A  71
 None
 1.19A 1fe2A-2p0yA:
undetectable		 1fe2A-2p0yA:
20.75
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.
2p17 PIRIN-LIKE PROTEIN

(Geobacillus
kaustophilus) 		PF02678
(Pirin)
PF05726
(Pirin_C) 		5 ARG A 236
VAL A 167
VAL A  63
VAL A  88
LEU A 238
 None
 1.22A 1fe2A-2p17A:
undetectable		 1fe2A-2p17A:
18.26
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.
2p28 INTEGRIN BETA-2

(Homo sapiens) 		PF17205
(PSI_integrin)
no annotation 		5 PHE A  93
VAL B 391
VAL B 417
VAL B 419
LEU B 356
 None
 1.21A 1fe2A-2p28A:
undetectable		 1fe2A-2p28A:
10.81
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.
2qgx UBIQUITIN-CONJUGATIN
G ENZYME E2 Q1

(Homo sapiens) 		PF00179
(UQ_con) 		5 PHE A  72
VAL A 122
VAL A  85
VAL A  87
LEU A 130
 None
 0.96A 1fe2A-2qgxA:
undetectable		 1fe2A-2qgxA:
14.46
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.
2xa7 ADAPTOR-RELATED
PROTEIN COMPLEX 2,
ALPHA 2 SUBUNIT

(Rattus
norvegicus) 		PF01602
(Adaptin_N) 		5 VAL A 483
VAL A 425
VAL A 461
VAL A 465
LEU A 447
 None
 1.01A 1fe2A-2xa7A:
undetectable		 1fe2A-2xa7A:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zo6 CYAN-EMITTING
GFP-LIKE PROTEIN,
KUSABIRA-CYAN (KCY)

(Verrillofungia
concinna) 		PF01353
(GFP) 		5 VAL A  60
VAL A  25
ASN A 133
ILE A  40
LEU A  57
 None
 1.19A 1fe2A-2zo6A:
undetectable		 1fe2A-2zo6A:
17.58
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.
2zo7 CYAN/GREEN-EMITTING
GFP-LIKE PROTEIN,
KUSABIRA-CYAN MUTANT
(KCY-R1)

(Verrillofungia
concinna) 		PF01353
(GFP) 		5 VAL A  61
VAL A  26
ASN A 134
ILE A  41
LEU A  58
 None
None
None
GYS  A  64 ( 4.8A)
None
 1.21A 1fe2A-2zo7A:
undetectable		 1fe2A-2zo7A:
16.81
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.
3agx DNAJ HOMOLOG
SUBFAMILY B MEMBER 1

(Homo sapiens) 		PF01556
(DnaJ_C) 		5 PHE A 285
VAL A 283
VAL A 273
ILE A 246
LEU A 314
 None
 1.03A 1fe2A-3agxA:
undetectable		 1fe2A-3agxA:
14.78
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.
3aii GLUTAMYL-TRNA
SYNTHETASE

(Methanothermobacter
thermautotrophicus) 		PF00749
(tRNA-synt_1c)
PF03950
(tRNA-synt_1c_C) 		5 VAL A 166
ARG A 171
PHE A 317
VAL A 290
VAL A 287
 None
 1.08A 1fe2A-3aiiA:
undetectable		 1fe2A-3aiiA:
22.67
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.
3aiz DNA POLYMERASE
SLIDING CLAMP B

(Sulfurisphaera
tokodaii) 		PF00705
(PCNA_N)
PF02747
(PCNA_C) 		5 PHE A 242
VAL A 211
VAL A  48
ILE A  35
LEU A  16
 None
 1.27A 1fe2A-3aizA:
undetectable		 1fe2A-3aizA:
17.26
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.
3cmg PUTATIVE
BETA-GALACTOSIDASE

(Bacteroides
fragilis) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		5 PHE A 106
VAL A 150
VAL A 177
ILE A 181
LEU A  91
 None
 1.04A 1fe2A-3cmgA:
undetectable		 1fe2A-3cmgA:
22.61
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.
3ec3 PROTEIN
DISULFIDE-ISOMERASE
A4

(Rattus
norvegicus) 		PF13848
(Thioredoxin_6) 		5 VAL A 500
VAL A 472
TYR A 417
VAL A 415
LEU A 496
 None
 1.03A 1fe2A-3ec3A:
undetectable		 1fe2A-3ec3A:
19.16
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.
3gf8 PUTATIVE
POLYSACCHARIDE
BINDING PROTEINS
(DUF1812)

(Bacteroides
thetaiotaomicron) 		PF08842
(Mfa2) 		5 VAL A  64
PHE A  53
VAL A  57
VAL A  39
LEU A  62
 None
 1.20A 1fe2A-3gf8A:
undetectable		 1fe2A-3gf8A:
19.10
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.
3gux PUTATIVE
ZN-DEPENDENT
EXOPEPTIDASE

(Bacteroides
vulgatus) 		PF04389
(Peptidase_M28) 		5 PHE A 232
VAL A 322
VAL A 326
ILE A 119
LEU A 157
 None
 1.27A 1fe2A-3guxA:
undetectable		 1fe2A-3guxA:
18.21
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.
3gzt OUTER CAPSID
GLYCOPROTEIN VP7

(Rotavirus A) 		PF00434
(VP7) 		5 VAL B 116
VAL B 295
VAL B 299
ILE B 307
LEU B  83
 None
 0.96A 1fe2A-3gztB:
undetectable		 1fe2A-3gztB:
17.48
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.
3i3v PROBABLE SECRETED
SOLUTE-BINDING
LIPOPROTEIN

(Streptomyces
coelicolor) 		PF01547
(SBP_bac_1) 		5 VAL A  62
VAL A  44
VAL A  99
ILE A 332
LEU A 339
 None
 1.24A 1fe2A-3i3vA:
undetectable		 1fe2A-3i3vA:
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.
3ksy SON OF SEVENLESS
HOMOLOG 1

(Homo sapiens) 		PF00125
(Histone)
PF00169
(PH)
PF00617
(RasGEF)
PF00618
(RasGEF_N)
PF00621
(RhoGEF) 		5 VAL A  30
TYR A  47
VAL A  48
ILE A 137
LEU A 142
 None
 1.05A 1fe2A-3ksyA:
undetectable		 1fe2A-3ksyA:
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.
3mi9 CELL DIVISION
PROTEIN KINASE 9

(Homo sapiens) 		PF00069
(Pkinase) 		5 VAL A  79
PHE A  59
VAL A  50
ILE A  82
LEU A  70
 None
 1.21A 1fe2A-3mi9A:
undetectable		 1fe2A-3mi9A:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nm1 THIAMINE
BIOSYNTHETIC
BIFUNCTIONAL ENZYME

([Candida]
glabrata) 		PF02110
(HK)
PF02581
(TMP-TENI) 		5 VAL A 489
VAL A 405
TYR A 409
ASN A 369
ILE A 337
 None
 1.25A 1fe2A-3nm1A:
undetectable		 1fe2A-3nm1A:
21.82
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.
3ogz UDP-SUGAR
PYROPHOSPHORYLASE

(Leishmania
major) 		PF01704
(UDPGP) 		5 PHE A 268
VAL A 227
VAL A 118
VAL A 116
LEU A 254
 None
 1.12A 1fe2A-3ogzA:
undetectable		 1fe2A-3ogzA:
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.
3qfh EPIDERMIN LEADER
PEPTIDE PROCESSING
SERINE PROTEASE EPIP

(Staphylococcus
aureus) 		PF00082
(Peptidase_S8) 		5 VAL A 226
VAL A 316
ASN A  87
ILE A 274
LEU A 223
 None
 1.03A 1fe2A-3qfhA:
undetectable		 1fe2A-3qfhA:
21.33
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.
3qmw THIOESTERASE

(Streptomyces
coelicolor) 		PF00975
(Thioesterase) 		5 PHE A  38
VAL A 116
VAL A  64
VAL A  62
LEU A  97
 None
 1.16A 1fe2A-3qmwA:
undetectable		 1fe2A-3qmwA:
17.90
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.
3riq TAILSPIKE PROTEIN

(Salmonella
virus 9NA) 		PF09251
(PhageP22-tail) 		5 PHE A 323
VAL A 308
VAL A 350
VAL A 378
ILE A 442
 None
 1.15A 1fe2A-3riqA:
undetectable		 1fe2A-3riqA:
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.
3s6k ACETYLGLUTAMATE
KINASE

(Xanthomonas
campestris) 		PF00696
(AA_kinase)
PF04768
(NAT) 		6 VAL A  52
VAL A 177
VAL A  76
ASN A 130
ILE A 211
LEU A  60
 None
 1.33A 1fe2A-3s6kA:
undetectable		 1fe2A-3s6kA:
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.
3t1i DOUBLE-STRAND BREAK
REPAIR PROTEIN
MRE11A

(Homo sapiens) 		PF00149
(Metallophos)
PF04152
(Mre11_DNA_bind) 		5 PHE A 153
VAL A 215
VAL A 150
ILE A 143
LEU A  61
 None
 0.89A 1fe2A-3t1iA:
undetectable		 1fe2A-3t1iA:
22.76
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.
3u7g BIFUNCTIONAL
POLYNUCLEOTIDE
PHOSPHATASE/KINASE

(Mus musculus) 		PF08645
(PNK3P)
PF13671
(AAA_33) 		5 PHE A 231
VAL A 250
VAL A 235
VAL A 238
LEU A 175
 None
 1.14A 1fe2A-3u7gA:
undetectable		 1fe2A-3u7gA:
21.17
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.
3uy4 PANTOTHENATE
SYNTHETASE

(Campylobacter
jejuni) 		PF02569
(Pantoate_ligase) 		5 PHE A 135
VAL A 156
VAL A 143
TYR A  26
VAL A  27
 None
 1.21A 1fe2A-3uy4A:
undetectable		 1fe2A-3uy4A:
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.
3wrv TM-1 PROTEIN

(Solanum
lycopersicum) 		PF06792
(UPF0261) 		5 PHE A 106
VAL A  51
VAL A  53
ILE A  96
LEU A 131
 None
 1.27A 1fe2A-3wrvA:
undetectable		 1fe2A-3wrvA:
15.08
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.
3x17 ENDOGLUCANASE

(uncultured
bacterium) 		no annotation 5 VAL B 498
VAL B 137
TYR B 134
VAL B 133
ILE B 130
 None
 1.09A 1fe2A-3x17B:
undetectable		 1fe2A-3x17B:
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.
4cw9 THIOREDOXIN

(Entamoeba
histolytica) 		PF00085
(Thioredoxin) 		5 PHE A  26
VAL A  56
VAL A  54
ILE A  51
LEU A  15
 None
 1.17A 1fe2A-4cw9A:
undetectable		 1fe2A-4cw9A:
10.24
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.
4dpk MALONYL-COA/SUCCINYL
-COA REDUCTASE

(Sulfurisphaera
tokodaii) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		5 VAL A 233
PHE A 272
ASN A 127
ILE A 176
LEU A 218
 None
 1.25A 1fe2A-4dpkA:
undetectable		 1fe2A-4dpkA:
23.86
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.
4ese FMN-DEPENDENT
NADH-AZOREDUCTASE

(Yersinia pestis) 		PF02525
(Flavodoxin_2) 		5 VAL A 172
VAL A  40
VAL A  26
ILE A 177
LEU A 138
 None
 1.13A 1fe2A-4eseA:
undetectable		 1fe2A-4eseA:
16.70
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.
4gz8 SEMAPHORIN-3A

(Mus musculus) 		PF01403
(Sema) 		5 PHE A 483
VAL A 482
VAL A 458
ILE A 434
LEU A 501
 None
 1.11A 1fe2A-4gz8A:
undetectable		 1fe2A-4gz8A:
18.85
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.
4h8q IRON
TRANSPORT-ASSOCIATED
DOMAIN PROTEIN

(Bacillus
anthracis) 		PF05031
(NEAT) 		5 VAL A  84
VAL A 101
VAL A  99
ILE A 116
LEU A  50
 None
HEM  A 201 (-4.8A)
HEM  A 201 (-4.5A)
None
None
 1.09A 1fe2A-4h8qA:
undetectable		 1fe2A-4h8qA:
11.44
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.
4hpk COLLAGENASE

(Hathewaya
histolytica) 		PF04151
(PPC) 		5 VAL A1006
PHE A 952
VAL A 954
VAL A 993
LEU A1004
 None
 1.22A 1fe2A-4hpkA:
undetectable		 1fe2A-4hpkA:
10.86
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.
4l5t INTERFERON-ACTIVABLE
PROTEIN 202

(Mus musculus) 		PF02760
(HIN) 		6 VAL A 368
VAL A 406
VAL A 399
VAL A 397
ILE A 356
LEU A 416
 None
 1.46A 1fe2A-4l5tA:
undetectable		 1fe2A-4l5tA:
14.93
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.
4nen INTEGRIN BETA-2

(Homo sapiens) 		PF00362
(Integrin_beta)
PF07965
(Integrin_B_tail)
PF17205
(PSI_integrin) 		5 PHE B  93
VAL B 391
VAL B 417
VAL B 419
LEU B 356
 None
 1.23A 1fe2A-4nenB:
undetectable		 1fe2A-4nenB:
22.57
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.
4nre ARACHIDONATE
15-LIPOXYGENASE B

(Homo sapiens) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		5 VAL A  64
PHE A  45
VAL A   8
VAL A   6
LEU A  67
 None
 1.26A 1fe2A-4nreA:
1.1		 1fe2A-4nreA:
22.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2

(Mus musculus) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		9 VAL A 117
ARG A 121
PHE A 206
VAL A 229
VAL A 345
TYR A 349
VAL A 350
ASN A 376
LEU A 532
 BOG  A 604 (-3.9A)
BOG  A 604 ( 3.7A)
None
None
None
None
IBP  A 601 (-4.3A)
EDO  A 616 (-4.4A)
IBP  A 601 ( 4.9A)
 0.41A 1fe2A-4ph9A:
58.4		 1fe2A-4ph9A:
63.51
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.
4piv FATTY ACID SYNTHASE

(Homo sapiens) 		PF08242
(Methyltransf_12)
PF08659
(KR) 		5 ARG A1468
VAL A1453
ASN A1234
ILE A1413
LEU A1469
 None
 1.12A 1fe2A-4pivA:
undetectable		 1fe2A-4pivA:
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.
4qam X-LINKED RETINITIS
PIGMENTOSA GTPASE
REGULATOR-INTERACTIN
G PROTEIN 1

(Homo sapiens) 		no annotation 5 VAL B1265
VAL B1133
VAL B1142
VAL B1144
LEU B1263
 None
 1.27A 1fe2A-4qamB:
undetectable		 1fe2A-4qamB:
16.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qdh VARIABLE LYMPHOCYTE
RECEPTOR B,
TOLL-LIKE RECEPTOR 9
CHIMERA

(Eptatretus
burgeri;
Mus musculus) 		PF01462
(LRRNT)
PF11921
(DUF3439)
PF13306
(LRR_5)
PF13855
(LRR_8) 		5 VAL A 288
VAL A 345
VAL A 296
ASN A 364
LEU A 312
 None
 1.23A 1fe2A-4qdhA:
undetectable		 1fe2A-4qdhA:
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.
4qyr AT-LESS POLYKETIDE
SYNTHASE

(Streptomyces
platensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 VAL A2781
VAL A2971
VAL A2800
ILE A2725
LEU A2718
 None
 1.04A 1fe2A-4qyrA:
undetectable		 1fe2A-4qyrA:
21.33
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.
4r9p RE28239P

(Drosophila
melanogaster) 		PF03166
(MH2) 		5 PHE A  98
VAL A  62
VAL A  60
ILE A  56
LEU A  79
 None
 1.24A 1fe2A-4r9pA:
undetectable		 1fe2A-4r9pA:
17.79
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.
4rjk ACETOLACTATE
SYNTHASE

(Bacillus
subtilis) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 VAL A 388
ARG A 385
VAL A 545
VAL A 448
LEU A 384
 None
 1.12A 1fe2A-4rjkA:
undetectable		 1fe2A-4rjkA:
21.65
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.
4xgt FRQ-INTERACTING RNA
HELICASE

(Neurospora
crassa) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF08148
(DSHCT)
PF13234
(rRNA_proc-arch) 		5 VAL A1009
VAL A 920
ASN A 959
ILE A 927
LEU A 951
 None
 1.19A 1fe2A-4xgtA:
0.2		 1fe2A-4xgtA:
19.78
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.
4xnu INTEGRAL MEMBRANE
PROTEIN-DOPAMINE
TRANSPORTER

(Drosophila
melanogaster) 		PF00209
(SNF) 		5 PHE A 452
TYR A 247
VAL A 246
ILE A 127
LEU A 419
 None
 1.26A 1fe2A-4xnuA:
undetectable		 1fe2A-4xnuA:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xpr ALPHA-GLUCOSIDASE

(Pseudopedobacter
saltans) 		PF01055
(Glyco_hydro_31)
PF17137
(DUF5110) 		5 VAL A 194
PHE A  71
VAL A 203
VAL A 201
LEU A  89
 None
 1.03A 1fe2A-4xprA:
undetectable		 1fe2A-4xprA:
21.96
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.
4zi8 PROTEIN PCDHGC3

(Mus musculus) 		PF00028
(Cadherin)
PF08266
(Cadherin_2) 		5 VAL A 134
PHE A  46
VAL A  76
VAL A  95
ILE A  98
 None
 1.13A 1fe2A-4zi8A:
undetectable		 1fe2A-4zi8A:
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.
4zzp CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Dictyostelium
purpureum) 		PF00840
(Glyco_hydro_7) 		5 PHE A 273
TYR A 309
VAL A 287
ASN A 140
LEU A 143
 None
 0.90A 1fe2A-4zzpA:
undetectable		 1fe2A-4zzpA:
20.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a8j VWA2

(Sulfolobus
acidocaldarius) 		PF00092
(VWA) 		5 PHE A 215
VAL A 221
VAL A  27
VAL A   6
ILE A 269
 None
 1.27A 1fe2A-5a8jA:
undetectable		 1fe2A-5a8jA:
21.78
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.
5abj VP3

(Enterovirus A) 		PF00073
(Rhv) 		5 ARG C 178
VAL C  55
VAL C 117
VAL C 169
ILE C 172
 None
 1.19A 1fe2A-5abjC:
undetectable		 1fe2A-5abjC:
18.15
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.
5ag9 GINGIPAIN R2

(Porphyromonas
gingivalis) 		PF03785
(Peptidase_C25_C) 		5 VAL A 600
VAL A 660
VAL A 658
ASN A 633
ILE A 655
 None
 1.25A 1fe2A-5ag9A:
undetectable		 1fe2A-5ag9A:
14.87
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.
5e6v INTEGRIN BETA-2

(Homo sapiens) 		PF17205
(PSI_integrin) 		5 PHE A  93
VAL A 391
VAL A 417
VAL A 419
LEU A 356
 None
 1.20A 1fe2A-5e6vA:
undetectable		 1fe2A-5e6vA:
15.80
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.
5e6w INTEGRIN BETA-2

(Homo sapiens) 		PF17205
(PSI_integrin) 		5 PHE A  93
VAL A 391
VAL A 417
VAL A 419
LEU A 356
 None
 1.23A 1fe2A-5e6wA:
undetectable		 1fe2A-5e6wA:
20.86
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.
5ej1 PUTATIVE CELLULOSE
SYNTHASE

(Rhodobacter
sphaeroides) 		PF03170
(BcsB) 		5 VAL B 448
VAL B 440
VAL B 376
VAL B 378
LEU B 446
 None
 1.23A 1fe2A-5ej1B:
undetectable		 1fe2A-5ej1B:
20.42
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.
5h5b THYMIDYLATE KINASE

(Aquifex
aeolicus) 		no annotation 5 VAL B 169
VAL B 133
VAL B 155
TYR B  98
LEU B 128
 None
 1.17A 1fe2A-5h5bB:
undetectable		 1fe2A-5h5bB:
17.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hjb PROTEIN AF-9

(Homo sapiens) 		PF03366
(YEATS) 		5 VAL A   9
PHE A  53
VAL A  34
VAL A  87
LEU A  11
 None
 1.05A 1fe2A-5hjbA:
undetectable		 1fe2A-5hjbA:
11.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ikr PROSTAGLANDIN G/H
SYNTHASE 2

(Homo sapiens) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		9 VAL A 116
ARG A 120
PHE A 205
VAL A 228
VAL A 344
TYR A 348
VAL A 349
ASN A 375
LEU A 531
 None
ID8  A 601 ( 4.4A)
None
None
None
None
ID8  A 601 (-3.9A)
None
ID8  A 601 (-3.5A)
 0.40A 1fe2A-5ikrA:
58.1		 1fe2A-5ikrA:
63.88
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.
5iku COLLAGENASE

(Hathewaya
histolytica) 		PF04151
(PPC) 		5 VAL A1006
PHE A 952
VAL A 954
VAL A 993
LEU A1004
 None
 1.24A 1fe2A-5ikuA:
undetectable		 1fe2A-5ikuA:
17.63
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.
5l9w ACETOPHENONE
CARBOXYLASE DELTA
SUBUNIT
ACETOPHENONE
CARBOXYLASE GAMMA
SUBUNIT

(Aromatoleum
aromaticum) 		PF01968
(Hydantoinase_A)
PF02538
(Hydantoinase_B)
PF05378
(Hydant_A_N) 		5 VAL B 153
PHE A 577
VAL A 544
VAL A 484
VAL A 486
 None
 1.17A 1fe2A-5l9wB:
0.0		 1fe2A-5l9wB:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mdh MALATE DEHYDROGENASE

(Sus scrofa) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 VAL A   6
VAL A   8
ASN A  25
ILE A  15
LEU A  20
 None
None
None
NAD  A 334 (-3.4A)
None
 0.94A 1fe2A-5mdhA:
undetectable		 1fe2A-5mdhA:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n29 CTP SYNTHASE

(Trypanosoma
brucei) 		PF00117
(GATase) 		5 VAL A 493
PHE A 388
VAL A 344
VAL A 418
VAL A 546
 None
None
None
8JB  A 419 ( 3.0A)
None
 1.27A 1fe2A-5n29A:
undetectable		 1fe2A-5n29A:
17.50
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.
5n38 E3 UBIQUITIN-PROTEIN
LIGASE PARKIN,E3
UBIQUITIN-PROTEIN
LIGASE PARKIN

(Homo sapiens) 		PF00240
(ubiquitin)
PF01485
(IBR) 		5 VAL A  56
VAL A  36
VAL A   5
ILE A   2
LEU A  26
 None
 1.14A 1fe2A-5n38A:
undetectable		 1fe2A-5n38A:
18.74
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.
5oc1 ARYL-ALCOHOL OXIDASE

(Pleurotus
eryngii) 		no annotation 5 VAL A 518
VAL A 249
VAL A   8
ILE A 425
LEU A 281
 None
None
FAD  A 602 ( 4.9A)
None
None
 1.18A 1fe2A-5oc1A:
undetectable		 1fe2A-5oc1A:
22.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tu0 LMO2125 PROTEIN

(Listeria
monocytogenes) 		PF13416
(SBP_bac_8) 		5 VAL A 113
VAL A  52
VAL A  42
ASN A 329
LEU A 321
 None
 1.16A 1fe2A-5tu0A:
undetectable		 1fe2A-5tu0A:
20.57
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.
5u8s DNA REPLICATION
LICENSING FACTOR
MCM4

(Saccharomyces
cerevisiae) 		PF00493
(MCM)
PF14551
(MCM_N)
PF17207
(MCM_OB) 		5 VAL 4 628
VAL 4 708
VAL 4 536
ILE 4 562
LEU 4 672
 None
 1.27A 1fe2A-5u8s4:
undetectable		 1fe2A-5u8s4:
20.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ulv MALATE DEHYDROGENASE

(Methylobacterium
extorquens) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 VAL A 116
VAL A  81
VAL A  99
VAL A 103
ILE A  69
 None
 1.09A 1fe2A-5ulvA:
undetectable		 1fe2A-5ulvA:
20.24
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.
5uz8 CADHERIN-23

(Mus musculus) 		no annotation 5 PHE A2379
VAL A2470
VAL A2472
ILE A2398
LEU A2418
 None
 1.10A 1fe2A-5uz8A:
undetectable		 1fe2A-5uz8A:
8.07
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.
5wqs BETA-AMYLASE

(Ipomoea batatas) 		no annotation 5 VAL A  36
PHE A 162
VAL A  55
VAL A  53
LEU A  76
 None
 1.16A 1fe2A-5wqsA:
0.0		 1fe2A-5wqsA:
8.91
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.
5xx9 BACTERIOFERRITIN

(Streptomyces
coelicolor) 		no annotation 5 VAL A   7
VAL A  57
VAL A 119
ILE A 105
LEU A  11
 None
 1.27A 1fe2A-5xx9A:
undetectable		 1fe2A-5xx9A:
8.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y8v YEATS
DOMAIN-CONTAINING
PROTEIN 4

(Homo sapiens) 		no annotation 5 VAL B 112
VAL B  49
TYR B  50
VAL B  51
LEU B 114
 None
 1.25A 1fe2A-5y8vB:
undetectable		 1fe2A-5y8vB:
10.22
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.
6b4j NUCLEOPORIN GLE1

(Homo sapiens) 		no annotation 5 VAL B 464
PHE B 484
VAL B 505
VAL B 430
LEU B 451
 None
 1.11A 1fe2A-6b4jB:
undetectable		 1fe2A-6b4jB:
9.85
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.
6bs7 ADENYLOSUCCINATE
SYNTHETASE

(Legionella
pneumophila) 		no annotation 5 VAL A   5
TYR A 262
VAL A 263
ILE A 320
LEU A   8
 None
 1.11A 1fe2A-6bs7A:
undetectable		 1fe2A-6bs7A:
7.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cim V(D)J
RECOMBINATION-ACTIVA
TING PROTEIN 2

(Mus musculus) 		no annotation 5 VAL B 182
TYR B 146
VAL B 145
ILE B 142
LEU B 184
 None
 1.18A 1fe2A-6cimB:
undetectable		 1fe2A-6cimB:
10.09
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.
6glc E3 UBIQUITIN-PROTEIN
LIGASE PARKIN

(Homo sapiens) 		no annotation 5 VAL A  56
VAL A  36
VAL A   5
ILE A   2
LEU A  26
 None
None
None
GOL  A 507 ( 4.9A)
None
 1.09A 1fe2A-6glcA:
undetectable		 1fe2A-6glcA:
11.54