SIMILAR PATTERNS OF AMINO ACIDS FOR 1FE2_A_LAXA700

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
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1coy CHOLESTEROL OXIDASE

(Brevibacterium
sterolicum) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 LEU A 453
PHE A 388
GLY A 315
SER A 295
GLY A 293
 None
None
None
None
FAD  A 510 ( 4.3A)
 0.97A 1fe2A-1coyA:
0.0		 1fe2A-1coyA:
23.32
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.
1e9y UREASE SUBUNIT ALPHA
UREASE SUBUNIT BETA

(Helicobacter
pylori) 		PF00449
(Urease_alpha)
PF00547
(Urease_gamma)
PF00699
(Urease_beta)
PF01979
(Amidohydro_1) 		5 LEU A 106
GLY A 109
ALA B 440
GLY B 443
LEU B 562
 None
 1.11A 1fe2A-1e9yA:
0.0		 1fe2A-1e9yA:
18.43
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) 		11 PHE A 209
LEU A 352
TYR A 355
PHE A 381
TYR A 385
TRP A 387
PHE A 518
GLY A 526
ALA A 527
GLY A 533
LEU A 534
 None
SCL  A 700 ( 4.8A)
SCL  A 700 (-4.3A)
OAS  A 530 ( 4.7A)
None
None
None
SCL  A 700 ( 4.0A)
SCL  A 700 (-2.9A)
OAS  A 530 ( 4.0A)
OAS  A 530 ( 3.3A)
 0.34A 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) 		7 PHE A 210
LEU A 352
TYR A 355
PHE A 381
PHE A 518
GLY A 526
ALA A 527
 HEM  A 601 (-4.7A)
SCL  A 700 ( 4.8A)
SCL  A 700 (-4.3A)
OAS  A 530 ( 4.7A)
None
SCL  A 700 ( 4.0A)
SCL  A 700 (-2.9A)
 1.46A 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.
1fpw CALCIUM-BINDING
PROTEIN NCS-1

(Saccharomyces
cerevisiae) 		PF13499
(EF-hand_7)
PF13833
(EF-hand_8) 		5 LEU A  68
TYR A 108
PHE A  64
GLY A 188
GLY A  95
 None
 1.01A 1fe2A-1fpwA:
undetectable		 1fe2A-1fpwA:
17.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jd3 CHORISMATE LYASE

(Escherichia
coli) 		PF04345
(Chor_lyase) 		5 TYR A 164
GLY A 136
ALA A 135
GLY A 132
LEU A  11
 None
 1.07A 1fe2A-1jd3A:
undetectable		 1fe2A-1jd3A:
17.85
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.
1jkm BREFELDIN A ESTERASE

(Bacillus
subtilis) 		PF07859
(Abhydrolase_3) 		5 LEU A 268
TYR A 272
GLY A 126
SER A 202
LEU A 310
 None
 1.12A 1fe2A-1jkmA:
0.0		 1fe2A-1jkmA:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nug PROTEIN-GLUTAMINE
GLUTAMYLTRANSFERASE
E

(Homo sapiens) 		PF00868
(Transglut_N)
PF00927
(Transglut_C)
PF01841
(Transglut_core) 		5 LEU A 185
PHE A 134
GLY A 287
GLY A 216
LEU A 219
 CL  A 701 (-4.3A)
None
None
None
None
 0.99A 1fe2A-1nugA:
0.0		 1fe2A-1nugA:
20.63
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.
1o5h FORMIMINOTETRAHYDROF
OLATE CYCLODEAMINASE

(Thermotoga
maritima) 		PF04961
(FTCD_C) 		5 GLY A  25
ALA A  26
SER A  29
GLY A  32
LEU A  73
 None
 0.92A 1fe2A-1o5hA:
undetectable		 1fe2A-1o5hA:
14.63
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.
1qgp PROTEIN (DOUBLE
STRANDED RNA
ADENOSINE DEAMINASE)

(Homo sapiens) 		PF02295
(z-alpha) 		5 LEU A 185
TYR A 177
ALA A 158
GLY A 163
LEU A 165
 None
 1.11A 1fe2A-1qgpA:
undetectable		 1fe2A-1qgpA:
10.60
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.
1qjs HEMOPEXIN

(Oryctolagus
cuniculus) 		PF00045
(Hemopexin) 		5 PHE A 113
PHE A  78
TYR A  86
GLY A 135
LEU A 149
 None
 1.09A 1fe2A-1qjsA:
0.0		 1fe2A-1qjsA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u60 PROBABLE GLUTAMINASE
YBAS

(Escherichia
coli) 		PF04960
(Glutaminase) 		5 LEU A 212
GLY A 258
ALA A 268
GLY A 265
LEU A 205
 None
 1.02A 1fe2A-1u60A:
undetectable		 1fe2A-1u60A:
20.10
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.
1u7g PROBABLE AMMONIUM
TRANSPORTER

(Escherichia
coli) 		PF00909
(Ammonium_transp) 		5 LEU A 114
GLY A  27
ALA A  29
GLY A  34
LEU A  35
 NH3  A 403 ( 4.6A)
None
None
None
None
 1.05A 1fe2A-1u7gA:
undetectable		 1fe2A-1u7gA:
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.
1us8 DNA DOUBLE-STRAND
BREAK REPAIR RAD50
ATPASE

(Pyrococcus
furiosus) 		no annotation 5 LEU B 810
PHE B 759
TYR B 843
ALA B 752
GLY B 801
 None
 1.05A 1fe2A-1us8B:
undetectable		 1fe2A-1us8B:
14.20
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.
1v3t LEUKOTRIENE B4
12-HYDROXYDEHYDROGEN
ASE/PROSTAGLANDIN
15-KETO REDUCTASE

(Cavia porcellus) 		PF00107
(ADH_zinc_N)
PF16884
(ADH_N_2) 		5 TYR A 181
GLY A 152
ALA A 153
SER A 156
GLY A 159
 None
NAP  A1350 (-3.3A)
NAP  A1350 (-3.4A)
None
None
 0.92A 1fe2A-1v3tA:
undetectable		 1fe2A-1v3tA:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v8b ADENOSYLHOMOCYSTEINA
SE

(Plasmodium
falciparum) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		5 GLY A 271
ALA A 273
SER A 275
GLY A 278
LEU A 279
 None
 1.06A 1fe2A-1v8bA:
0.0		 1fe2A-1v8bA:
20.14
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.
1w85 PYRUVATE
DEHYDROGENASE E1
COMPONENT, ALPHA
SUBUNIT
PYRUVATE
DEHYDROGENASE E1
COMPONENT, BETA
SUBUNIT

(Geobacillus
stearothermophilus) 		PF00676
(E1_dh)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 PHE A 197
LEU B  69
PHE B  26
GLY B  64
LEU A  99
 None
 1.10A 1fe2A-1w85A:
0.0		 1fe2A-1w85A:
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.
1wsu SELENOCYSTEINE-SPECI
FIC ELONGATION
FACTOR

(Moorella
thermoacetica) 		PF09107
(SelB-wing_3) 		5 LEU A 610
PHE A 593
GLY A 594
ALA A 596
LEU A 602
 G  E  23 ( 4.6A)
None
None
G  E  23 ( 3.6A)
None
 1.11A 1fe2A-1wsuA:
undetectable		 1fe2A-1wsuA:
11.95
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.
1yni SUCCINYLARGININE
DIHYDROLASE

(Escherichia
coli) 		PF04996
(AstB) 		5 LEU A  46
TYR A 402
GLY A  10
GLY A 362
LEU A 353
 None
 1.05A 1fe2A-1yniA:
undetectable		 1fe2A-1yniA:
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.
2bng MB2760

(Mycobacterium
tuberculosis) 		PF07858
(LEH) 		5 LEU A  28
TYR A  46
TRP A 120
PHE A  24
ALA A  61
 None
 1.00A 1fe2A-2bngA:
undetectable		 1fe2A-2bngA:
14.76
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.
2gk9 PHOSPHATIDYLINOSITOL
-4-PHOSPHATE
5-KINASE, TYPE II,
GAMMA

(Homo sapiens) 		PF01504
(PIP5K) 		6 LEU A 126
TYR A 189
GLY A  54
ALA A  56
SER A  58
LEU A  62
 None
 1.10A 1fe2A-2gk9A:
undetectable		 1fe2A-2gk9A:
21.75
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.
2iyf OLEANDOMYCIN
GLYCOSYLTRANSFERASE

(Streptomyces
antibioticus) 		PF00201
(UDPGT) 		5 GLY A 307
ALA A 308
SER A 311
GLY A 314
LEU A 315
 UDP  A1401 ( 3.9A)
UDP  A1401 (-4.3A)
None
None
None
 0.63A 1fe2A-2iyfA:
undetectable		 1fe2A-2iyfA:
20.97
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.
2mxz L-ALANYL-D-GLUTAMATE
PEPTIDASE

(Escherichia
virus T5) 		PF13539
(Peptidase_M15_4) 		5 PHE A   5
LEU A 108
PHE A  35
PHE A 110
ALA A  96
 None
 1.02A 1fe2A-2mxzA:
undetectable		 1fe2A-2mxzA:
13.46
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.
2o0x 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE

(Mycobacterium
tuberculosis) 		PF00275
(EPSP_synthase) 		5 TRP A 419
PHE A 415
GLY A 390
ALA A 389
LEU A 319
 None
 1.02A 1fe2A-2o0xA:
undetectable		 1fe2A-2o0xA:
22.56
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.
2qae DIHYDROLIPOYL
DEHYDROGENASE

(Trypanosoma
cruzi) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 LEU A 187
PHE A 233
GLY A 223
ALA A 224
GLY A 397
 None
 1.00A 1fe2A-2qaeA:
undetectable		 1fe2A-2qaeA:
21.03
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.
2r79 PERIPLASMIC BINDING
PROTEIN

(Pseudomonas
aeruginosa) 		PF01497
(Peripla_BP_2) 		5 LEU A 113
GLY A  34
ALA A  33
SER A  32
GLY A  52
 None
 1.03A 1fe2A-2r79A:
undetectable		 1fe2A-2r79A:
19.20
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.
2rau PUTATIVE ESTERASE

(Sulfolobus
solfataricus) 		PF12146
(Hydrolase_4) 		5 TYR A 332
PHE A 271
GLY A  57
SER A 151
GLY A 178
 UNL  A 359 (-4.4A)
UNL  A 359 (-4.8A)
UNL  A 359 ( 4.1A)
PEG  A 360 (-3.2A)
None
 1.12A 1fe2A-2rauA:
undetectable		 1fe2A-2rauA:
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.
2rjt BETA-KETOACYL-ACP
SYNTHASE II

(Streptococcus
pneumoniae) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 LEU A  28
GLY A  18
SER A  15
GLY A 234
LEU A 338
 None
 1.14A 1fe2A-2rjtA:
undetectable		 1fe2A-2rjtA:
21.21
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.
2uv8 FATTY ACID SYNTHASE
SUBUNIT BETA (FAS1)

(Saccharomyces
cerevisiae) 		PF00698
(Acyl_transf_1)
PF01575
(MaoC_dehydratas)
PF08354
(DUF1729)
PF13452
(MaoC_dehydrat_N)
PF16073
(SAT) 		5 LEU G 502
TYR G 249
PHE G 496
GLY G 269
ALA G 270
 None
 1.07A 1fe2A-2uv8G:
undetectable		 1fe2A-2uv8G:
14.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2uz0 TRIBUTYRIN ESTERASE

(Streptococcus
pneumoniae) 		PF00756
(Esterase) 		5 TYR A 163
GLY A  44
SER A 120
GLY A 144
LEU A 204
 None
GOL  A1259 (-3.2A)
GOL  A1259 (-2.9A)
None
None
 1.12A 1fe2A-2uz0A:
undetectable		 1fe2A-2uz0A:
19.69
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.
2w1p
AQUAPORIN PIP2-7 7

(Komagataella
pastoris) 		PF00230
(MIP) 		5 LEU A  85
GLY A 220
ALA A 221
GLY A 171
LEU A 174
 None
 1.03A 1fe2A-2w1pA:
undetectable		 1fe2A-2w1pA:
19.79
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.
2w4g MYOSIN HEAVY CHAIN,
SKELETAL MUSCLE,
ADULT

(Gallus gallus) 		PF00063
(Myosin_head)
PF02736
(Myosin_N) 		5 PHE M 475
LEU M 603
TYR M 611
GLY M 427
ALA M 430
 None
 1.10A 1fe2A-2w4gM:
0.0		 1fe2A-2w4gM:
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.
2wan PULLULANASE

(Bacillus
acidopullulyticus) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 TYR A 436
PHE A 814
GLY A 482
GLY A 547
LEU A 541
 None
 1.08A 1fe2A-2wanA:
undetectable		 1fe2A-2wanA:
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.
2x40 BETA-GLUCOSIDASE

(Thermotoga
neapolitana) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 LEU A 116
GLY A 159
ALA A 160
SER A 205
GLY A 237
 GOL  A1726 ( 4.8A)
None
None
None
None
 1.10A 1fe2A-2x40A:
undetectable		 1fe2A-2x40A:
20.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2y05 PROSTAGLANDIN
REDUCTASE 1

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF16884
(ADH_N_2) 		5 TYR A 181
GLY A 152
ALA A 153
SER A 156
GLY A 159
 None
NAP  A 701 (-3.1A)
NAP  A 701 (-3.3A)
None
None
 0.98A 1fe2A-2y05A:
undetectable		 1fe2A-2y05A:
20.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z67 O-PHOSPHOSERYL-TRNA(
SEC) SELENIUM
TRANSFERASE

(Methanococcus
maripaludis) 		PF05889
(SepSecS) 		5 TYR A 257
ALA A 249
SER A 275
GLY A 287
LEU A 288
 None
PLP  A1001 (-3.4A)
None
None
None
 1.00A 1fe2A-2z67A:
undetectable		 1fe2A-2z67A:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3crn RESPONSE REGULATOR
RECEIVER DOMAIN
PROTEIN, CHEY-LIKE

(Methanospirillum
hungatei) 		PF00072
(Response_reg) 		5 PHE A  51
PHE A  90
GLY A  60
GLY A  37
LEU A  38
 None
None
PHD  A  52 ( 3.3A)
None
None
 0.97A 1fe2A-3crnA:
undetectable		 1fe2A-3crnA:
12.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cuo UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR YGAV

(Escherichia
coli) 		PF01022
(HTH_5) 		5 GLY A  42
ALA A  41
SER A  40
GLY A  38
LEU A  78
 None
 0.94A 1fe2A-3cuoA:
undetectable		 1fe2A-3cuoA:
9.79
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.
3dmc NTF2-LIKE PROTEIN

(Trichormus
variabilis) 		PF12680
(SnoaL_2) 		5 PHE A  63
PHE A  32
GLY A  16
GLY A  23
LEU A  24
 None
 1.09A 1fe2A-3dmcA:
undetectable		 1fe2A-3dmcA:
13.56
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.
3dsm UNCHARACTERIZED
PROTEIN BACUNI_02894

(Bacteroides
uniformis) 		no annotation 5 PHE A 322
LEU A 286
GLY A 329
ALA A 330
LEU A  18
 None
 1.06A 1fe2A-3dsmA:
undetectable		 1fe2A-3dsmA:
19.14
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.
3gaz ALCOHOL
DEHYDROGENASE
SUPERFAMILY PROTEIN

(Novosphingobium
aromaticivorans) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 PHE A 281
LEU A  47
TYR A 315
GLY A  97
GLY A  93
 None
 1.07A 1fe2A-3gazA:
undetectable		 1fe2A-3gazA:
19.80
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.
3hol TBPB

(Actinobacillus
pleuropneumoniae) 		PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A) 		5 LEU A 253
PHE A 257
PHE A 280
GLY A 256
GLY A 223
 None
 1.12A 1fe2A-3holA:
undetectable		 1fe2A-3holA:
20.92
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.
3kq5 HYPOTHETICAL
CYTOSOLIC PROTEIN

(Coxiella
burnetii) 		PF07515
(TraI_2_C) 		5 PHE A 132
LEU A 287
PHE A 293
GLY A 315
GLY A 325
 None
 1.10A 1fe2A-3kq5A:
undetectable		 1fe2A-3kq5A:
21.48
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.
3llk SULFHYDRYL OXIDASE 1

(Homo sapiens) 		PF04777
(Evr1_Alr) 		5 PHE A 403
LEU A 330
PHE A 371
GLY A 317
GLY A 448
 None
 1.13A 1fe2A-3llkA:
undetectable		 1fe2A-3llkA:
17.25
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.
3md2 MATRIX PROTEIN 1

(Influenza A
virus) 		PF00598
(Flu_M1) 		5 GLY A 122
ALA A 123
SER A 126
GLY A 129
LEU A 130
 None
 0.85A 1fe2A-3md2A:
undetectable		 1fe2A-3md2A:
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.
3n0w ABC BRANCHED CHAIN
AMINO ACID FAMILY
TRANSPORTER,
PERIPLASMIC LIGAND
BINDING PROTEIN

(Paraburkholderia
xenovorans) 		PF13458
(Peripla_BP_6) 		5 LEU A  53
PHE A 287
GLY A 306
GLY A  30
LEU A  69
 None
 1.12A 1fe2A-3n0wA:
undetectable		 1fe2A-3n0wA:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n9t PNPC

(Pseudomonas
putida) 		PF00775
(Dioxygenase_C)
PF04444
(Dioxygenase_N) 		5 TYR A 259
PHE A 221
GLY A 134
GLY A 271
LEU A 272
 None
 1.13A 1fe2A-3n9tA:
undetectable		 1fe2A-3n9tA:
18.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nd0 SLL0855 PROTEIN

(Synechocystis
sp. PCC 6803) 		PF00654
(Voltage_CLC) 		5 LEU A 290
GLY A 138
ALA A 137
SER A 134
GLY A 131
 None
 0.94A 1fe2A-3nd0A:
undetectable		 1fe2A-3nd0A:
23.81
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.
3oce FUMARATE LYASE:DELTA
CRYSTALLIN

(Brucella
abortus) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 PHE A 203
LEU A 305
GLY A 184
GLY A 197
LEU A 196
 None
None
None
EDO  A 475 ( 4.3A)
None
 1.08A 1fe2A-3oceA:
undetectable		 1fe2A-3oceA:
23.55
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.
3pdi NITROGENASE MOFE
COFACTOR
BIOSYNTHESIS PROTEIN
NIFN

(Azotobacter
vinelandii) 		PF00148
(Oxidored_nitro) 		5 PHE B 146
GLY B  23
ALA B  25
GLY B  30
LEU B  31
 None
 1.13A 1fe2A-3pdiB:
undetectable		 1fe2A-3pdiB:
23.16
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.
3pqu TRANSFERRIN BINDING
PROTEIN B

(Actinobacillus
suis) 		PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A) 		5 LEU A 302
PHE A 306
PHE A 329
GLY A 305
GLY A 279
 None
 1.14A 1fe2A-3pquA:
undetectable		 1fe2A-3pquA:
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.
3su8 PLEXIN-B1

(Homo sapiens) 		PF08337
(Plexin_cytopl) 		5 LEU X1640
PHE X1577
GLY X2083
ALA X2084
LEU X1603
 None
 0.82A 1fe2A-3su8X:
undetectable		 1fe2A-3su8X:
22.32
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.
3t58 SULFHYDRYL OXIDASE 1

(Mus musculus) 		PF00085
(Thioredoxin)
PF04777
(Evr1_Alr) 		5 PHE A 406
LEU A 333
PHE A 374
GLY A 320
GLY A 451
 None
 1.11A 1fe2A-3t58A:
0.1		 1fe2A-3t58A:
19.97
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.
3wme ATP-BINDING
CASSETTE, SUB-FAMILY
B, MEMBER 1

(Cyanidioschyzon
merolae) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane) 		5 LEU A 130
PHE A 173
ALA A 178
SER A 180
LEU A 184
 None
 1.14A 1fe2A-3wmeA:
undetectable		 1fe2A-3wmeA:
21.63
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.
3wo8 BETA-N-ACETYLGLUCOSA
MINIDASE

(Thermotoga
maritima) 		PF00933
(Glyco_hydro_3) 		5 LEU A 198
GLY A 143
ALA A 144
GLY A 149
LEU A 151
 None
 1.06A 1fe2A-3wo8A:
undetectable		 1fe2A-3wo8A:
21.27
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.
4b7x PROBABLE
OXIDOREDUCTASE

(Pseudomonas
aeruginosa) 		PF00107
(ADH_zinc_N)
PF16884
(ADH_N_2) 		5 LEU A  98
PHE A 111
GLY A 106
GLY A  32
LEU A  31
 None
 0.96A 1fe2A-4b7xA:
undetectable		 1fe2A-4b7xA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4co6 NUCLEOPROTEIN

(Nipah
henipavirus) 		PF00973
(Paramyxo_ncap) 		5 LEU A 297
TYR A 301
GLY A 266
GLY A 274
LEU A 275
 None
 1.01A 1fe2A-4co6A:
undetectable		 1fe2A-4co6A:
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.
4dws CHI2

(Yersinia
entomophaga) 		PF00704
(Glyco_hydro_18) 		5 LEU A 201
PHE A 269
TYR A 273
PHE A 198
GLY A 220
 None
 1.06A 1fe2A-4dwsA:
undetectable		 1fe2A-4dwsA:
22.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fym OROTATE
PHOSPHORIBOSYLTRANSF
ERASE

(Plasmodium
falciparum) 		PF00156
(Pribosyltran) 		5 PHE A  98
LEU A 116
GLY A 137
GLY A 101
LEU A 103
 None
 1.10A 1fe2A-4fymA:
undetectable		 1fe2A-4fymA:
15.97
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.
4h2h MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Salipiger
bermudensis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 LEU A 353
GLY A  47
ALA A 106
GLY A 271
LEU A 272
 None
 1.11A 1fe2A-4h2hA:
undetectable		 1fe2A-4h2hA:
21.03
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.
4hyd PUTATIVE
UNCHARACTERIZED
PROTEIN

(Methanoculleus
marisnigri) 		PF06550
(SPP) 		5 PHE A 214
ALA A 136
SER A 135
GLY A 219
LEU A 221
 None
 1.13A 1fe2A-4hydA:
undetectable		 1fe2A-4hydA:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i1d ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN

(Bradyrhizobium
diazoefficiens) 		PF13416
(SBP_bac_8) 		5 PHE A 261
TYR A 134
PHE A 315
ALA A 335
GLY A 266
 ACT  A 416 (-4.0A)
None
None
None
None
 1.00A 1fe2A-4i1dA:
undetectable		 1fe2A-4i1dA:
18.63
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.
4iq4 NON-HAEM
BROMOPEROXIDASE
BPO-A2, MATRIX
PROTEIN 1

(Influenza A
virus;
Kitasatospora
aureofaciens) 		PF00561
(Abhydrolase_1)
PF00598
(Flu_M1) 		5 GLY A 405
ALA A 406
SER A 409
GLY A 412
LEU A 413
 None
 0.87A 1fe2A-4iq4A:
undetectable		 1fe2A-4iq4A:
22.08
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.
4maa PUTATIVE
BRANCHED-CHAIN AMINO
ACID ABC
TRANSPORTER,
PERIPLASMIC AMINO
ACID-BINDING PROTEIN

(Pseudomonas
protegens) 		PF13458
(Peripla_BP_6) 		5 LEU A 182
TYR A 176
GLY A 128
ALA A 129
GLY A 134
 None
None
GOL  A 503 (-3.7A)
None
None
 1.06A 1fe2A-4maaA:
undetectable		 1fe2A-4maaA:
21.21
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.
4mh0 RAS-RELATED PROTEIN
RAP-1B

(Homo sapiens) 		PF00071
(Ras) 		5 TYR R  40
GLY R  60
ALA R  59
GLY R  10
LEU R   9
 None
None
SO4  R 201 (-3.3A)
None
None
 1.01A 1fe2A-4mh0R:
undetectable		 1fe2A-4mh0R:
16.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nz0 GENOME POLYPROTEIN

(Cardiovirus A) 		PF00680
(RdRP_1) 		5 PHE A 262
GLY A 192
ALA A 195
SER A 196
GLY A 101
 None
 1.07A 1fe2A-4nz0A:
undetectable		 1fe2A-4nz0A:
21.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o01 BACTERIOPHYTOCHROME

(Deinococcus
radiodurans) 		PF00360
(PHY)
PF01590
(GAF)
PF08446
(PAS_2) 		5 LEU A 273
PHE A 170
ALA A 225
GLY A  39
LEU A 253
 None
 1.09A 1fe2A-4o01A:
undetectable		 1fe2A-4o01A:
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.
4p2l SULFHYDRYL OXIDASE 1

(Rattus
norvegicus) 		PF00085
(Thioredoxin)
PF04777
(Evr1_Alr) 		5 PHE A 406
LEU A 333
PHE A 374
GLY A 320
GLY A 451
 None
 1.11A 1fe2A-4p2lA:
0.0		 1fe2A-4p2lA:
21.03
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.
4pcl O-METHYLTRANSFERASE
FAMILY PROTEIN

(Anaplasma
phagocytophilum) 		PF01596
(Methyltransf_3) 		5 GLY A  68
ALA A  71
SER A  70
GLY A  45
LEU A  48
 None
None
SAM  A 301 (-2.9A)
None
None
 0.91A 1fe2A-4pclA:
undetectable		 1fe2A-4pclA:
16.88
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) 		6 PHE A 206
TYR A 386
TRP A 388
GLY A 527
ALA A 528
SER A 531
 None
IBP  A 601 (-4.8A)
None
IBP  A 601 (-3.9A)
IBP  A 601 (-3.4A)
IBP  A 601 ( 3.3A)
 1.29A 1fe2A-4ph9A:
58.4		 1fe2A-4ph9A:
63.51
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) 		11 PHE A 210
LEU A 353
PHE A 382
TYR A 386
TRP A 388
PHE A 519
GLY A 527
ALA A 528
SER A 531
GLY A 534
LEU A 535
 EDO  A 616 (-3.5A)
IBP  A 601 ( 4.7A)
None
IBP  A 601 (-4.8A)
None
None
IBP  A 601 (-3.9A)
IBP  A 601 (-3.4A)
IBP  A 601 ( 3.3A)
EDO  A 616 (-3.0A)
EDO  A 616 ( 4.4A)
 0.64A 1fe2A-4ph9A:
58.4		 1fe2A-4ph9A:
63.51
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) 		11 PHE A 210
LEU A 353
TYR A 356
PHE A 382
TYR A 386
TRP A 388
GLY A 527
ALA A 528
SER A 531
GLY A 534
LEU A 535
 EDO  A 616 (-3.5A)
IBP  A 601 ( 4.7A)
IBP  A 601 (-4.5A)
None
IBP  A 601 (-4.8A)
None
IBP  A 601 (-3.9A)
IBP  A 601 (-3.4A)
IBP  A 601 ( 3.3A)
EDO  A 616 (-3.0A)
EDO  A 616 ( 4.4A)
 0.37A 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.
4pve POLLEN ALLERGEN PHL
P 4.0202

(Phleum pratense) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 LEU A 183
ALA A 217
SER A 125
GLY A 126
LEU A 106
 None
None
FAD  A 601 (-3.4A)
None
FAD  A 601 (-4.8A)
 1.00A 1fe2A-4pveA:
undetectable		 1fe2A-4pveA:
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.
4qav 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Neisseria
meningitidis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 LEU A  28
GLY A  18
SER A  15
GLY A 236
LEU A 341
 None
 1.12A 1fe2A-4qavA:
undetectable		 1fe2A-4qavA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qs9 HEXOKINASE-1

(Arabidopsis
thaliana) 		PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2) 		5 LEU A 442
GLY A 406
ALA A 407
SER A 410
GLY A 413
 None
 0.77A 1fe2A-4qs9A:
undetectable		 1fe2A-4qs9A:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r89 UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		PF08774
(VRR_NUC) 		5 LEU A 474
GLY A 388
SER A 392
GLY A 395
LEU A 396
 None
 1.13A 1fe2A-4r89A:
undetectable		 1fe2A-4r89A:
22.63
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.
4roe TRANSCRIPTION FACTOR
IIIB 50 KDA SUBUNIT

(Homo sapiens) 		no annotation 5 LEU A 123
PHE A 149
GLY A 136
ALA A 137
LEU A 172
 None
 1.08A 1fe2A-4roeA:
undetectable		 1fe2A-4roeA:
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.
4u9c LACTOFERRIN-BINDING
PROTEIN B

(Neisseria
meningitidis) 		PF01298
(TbpB_B_D)
PF17484
(TbpB_A) 		5 LEU A 312
PHE A 316
PHE A 339
GLY A 315
GLY A 279
 None
 1.12A 1fe2A-4u9cA:
undetectable		 1fe2A-4u9cA:
19.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xqk LLABIII

(Lactococcus
lactis) 		PF00271
(Helicase_C)
PF02384
(N6_Mtase)
PF04851
(ResIII)
PF13156
(Mrr_cat_2) 		5 PHE A 997
LEU A 777
PHE A 752
PHE A 814
ALA A 770
 None
 1.01A 1fe2A-4xqkA:
undetectable		 1fe2A-4xqkA:
14.92
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.
4ye5 PEPTIDOGLYCAN
SYNTHETASE
PENICILLIN-BINDING
PROTEIN 3

(Bifidobacterium
adolescentis) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		5 PHE A 509
TYR A 506
GLY A 570
ALA A 569
GLY A 565
 None
 0.83A 1fe2A-4ye5A:
undetectable		 1fe2A-4ye5A:
20.80
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.
4zbg ACETYLTRANSFERASE

(Brucella
abortus) 		PF13527
(Acetyltransf_9) 		5 PHE A 124
PHE A  22
GLY A  79
ALA A  62
GLY A 100
 None
ACO  A 201 (-3.5A)
ACO  A 201 (-3.6A)
None
None
 1.06A 1fe2A-4zbgA:
undetectable		 1fe2A-4zbgA:
13.86
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.
4zdn AT-LESS POLYKETIDE
SYNTHASE

(Streptomyces
platensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 LEU A 731
GLY A 752
ALA A 751
GLY A 559
LEU A 557
 None
 1.04A 1fe2A-4zdnA:
undetectable		 1fe2A-4zdnA:
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.
5b2g ENDOLYSIN,CLAUDIN-4

(Escherichia
virus T4;
Homo sapiens) 		PF00822
(PMP22_Claudin)
PF00959
(Phage_lysozyme) 		5 GLY A1330
ALA A1332
SER A1334
GLY A1292
LEU A1338
 None
 1.12A 1fe2A-5b2gA:
undetectable		 1fe2A-5b2gA:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bp1 MYCOCEROSIC ACID
SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 LEU A 250
ALA A 106
SER A 110
GLY A 111
LEU A 112
 None
 1.14A 1fe2A-5bp1A:
undetectable		 1fe2A-5bp1A:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5chc DMSO REDUCTASE
FAMILY TYPE II
ENZYME,
MOLYBDOPTERIN
SUBUNIT

(Azospira oryzae) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		5 PHE A 534
LEU A 649
PHE A 638
GLY A 158
GLY A 150
 None
 0.91A 1fe2A-5chcA:
undetectable		 1fe2A-5chcA:
20.83
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.
5cqe MATRIX PROTEIN 1

(Influenza A
virus) 		PF00598
(Flu_M1) 		5 GLY A 122
ALA A 123
SER A 126
GLY A 129
LEU A 130
 None
 0.94A 1fe2A-5cqeA:
undetectable		 1fe2A-5cqeA:
16.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cyr RNA-DEPENDENT RNA
POLYMERASE

(Thosea asigna
virus) 		no annotation 5 PHE B 479
PHE B 370
PHE B 512
GLY B 350
SER B 451
 None
 1.01A 1fe2A-5cyrB:
undetectable		 1fe2A-5cyrB:
20.38
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.
5ey7 FRUCTOKINASE

(Vibrio cholerae) 		PF00294
(PfkB) 		5 LEU A 318
PHE A 268
GLY A 299
ALA A 300
GLY A 239
 None
 1.14A 1fe2A-5ey7A:
undetectable		 1fe2A-5ey7A:
19.26
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.
5ffj ENDONUCLEASE AND
METHYLASE LLAGI

(Lactococcus
lactis) 		PF00271
(Helicase_C)
PF02384
(N6_Mtase)
PF04851
(ResIII) 		6 PHE A 997
LEU A 777
PHE A 752
PHE A 814
ALA A 770
LEU A 947
 None
 1.46A 1fe2A-5ffjA:
undetectable		 1fe2A-5ffjA:
17.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5go6 PUTATIVE SECRETED
PROTEIN

(Streptomyces
avermitilis) 		PF04203
(Sortase) 		5 LEU A 109
PHE A 137
ALA A 125
GLY A 119
LEU A 118
 None
 1.10A 1fe2A-5go6A:
undetectable		 1fe2A-5go6A:
16.26
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.
5hif RECONSTRUCTED
LACTONASE ANCESTOR,
ANC1-MPH

(synthetic
construct) 		PF00753
(Lactamase_B) 		5 LEU A 147
GLY A 165
ALA A 168
GLY A 122
LEU A 123
 None
 1.13A 1fe2A-5hifA:
undetectable		 1fe2A-5hifA:
20.08
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 PHE A 209
LEU A 352
PHE A 381
TYR A 385
TRP A 387
PHE A 518
GLY A 526
GLY A 533
LEU A 534
 None
ID8  A 601 (-4.1A)
None
ID8  A 601 ( 3.5A)
COH  A 602 (-4.5A)
None
ID8  A 601 (-3.5A)
None
None
 0.93A 1fe2A-5ikrA:
58.1		 1fe2A-5ikrA:
63.88
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) 		11 PHE A 209
LEU A 352
TYR A 355
PHE A 381
TYR A 385
TRP A 387
GLY A 526
ALA A 527
SER A 530
GLY A 533
LEU A 534
 None
ID8  A 601 (-4.1A)
ID8  A 601 (-3.8A)
None
ID8  A 601 ( 3.5A)
COH  A 602 (-4.5A)
ID8  A 601 (-3.5A)
ID8  A 601 (-3.5A)
ID8  A 601 (-2.7A)
None
None
 0.76A 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.
5ip9 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB2

(Saccharomyces
cerevisiae) 		PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5) 		5 LEU B 361
PHE B 581
GLY B 584
GLY B 588
LEU B 566
 None
 0.93A 1fe2A-5ip9B:
undetectable		 1fe2A-5ip9B:
18.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5olt -

(-) 		no annotation 5 PHE A 425
LEU A 245
PHE A 264
TRP A 261
ALA A 470
 None
 1.06A 1fe2A-5oltA:
undetectable		 1fe2A-5oltA:
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.
5oon UNDECAPRENYL-DIPHOSP
HATASE

(Escherichia
coli) 		no annotation 5 GLY A 176
ALA A 177
SER A 180
GLY A 182
LEU A 184
 None
 0.90A 1fe2A-5oonA:
undetectable		 1fe2A-5oonA:
8.33
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.
5xog DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA

(Komagataella
phaffii) 		PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5) 		5 LEU B 354
PHE B 574
GLY B 577
GLY B 581
LEU B 559
 None
 1.06A 1fe2A-5xogB:
0.0		 1fe2A-5xogB:
17.69
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.
5y79 PUTATIVE HEXOSE
PHOSPHATE
TRANSLOCATOR

(Galdieria
sulphuraria) 		PF03151
(TPT) 		5 PHE A 272
GLY A 211
ALA A 212
SER A 215
LEU A 219
 OLC  A 507 (-4.8A)
None
None
None
None
 1.08A 1fe2A-5y79A:
undetectable		 1fe2A-5y79A:
19.79
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.
5yhp COLD ACTIVE PROLINE
IMINOPEPTIDASE

(Glaciozyma
antarctica) 		no annotation 5 TYR A  29
GLY A  47
ALA A  48
GLY A 113
LEU A  40
 None
 1.12A 1fe2A-5yhpA:
undetectable		 1fe2A-5yhpA:
19.56
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.
6bar ROD SHAPE
DETERMINING PROTEIN
RODA

(Thermus
thermophilus) 		no annotation 5 LEU A 109
PHE A 104
ALA A 341
GLY A 347
LEU A 348
 None
OLC  A 402 (-4.6A)
OLC  A 402 (-3.7A)
None
None
 0.97A 1fe2A-6barA:
undetectable		 1fe2A-6barA:
10.42