SIMILAR PATTERNS OF AMINO ACIDS FOR 2EIN_P_CHDP1271

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.
1d2i PROTEIN (RESTRICTION
ENDONUCLEASE BGLII)

(Bacillus
subtilis) 		PF09195
(Endonuc-BglII) 		4 LEU A 102
GLN A  95
LEU A 152
PHE A 161
 None
MG  A 601 ( 4.1A)
None
None
 0.99A 2einP-1d2iA:
undetectable
2einW-1d2iA:
0.0		 2einP-1d2iA:
19.62
2einW-1d2iA:
12.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1eco ERYTHROCRUORIN
(CARBONMONOXY)

(Chironomus
thummi) 		PF00042
(Globin) 		4 GLN A  10
PHE A  13
LEU A 125
PHE A 129
 None
 1.09A 2einP-1ecoA:
undetectable
2einW-1ecoA:
0.0		 2einP-1ecoA:
20.00
2einW-1ecoA:
15.44
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.
1f2r INHIBITOR OF
CASPASE-ACTIVATED
DNASE

(Mus musculus) 		PF02017
(CIDE-N) 		4 LEU I  23
GLN I  31
LEU I  42
PHE I  76
 None
 1.03A 2einP-1f2rI:
undetectable
2einW-1f2rI:
0.0		 2einP-1f2rI:
17.97
2einW-1f2rI:
19.00
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.
1gtk PORPHOBILINOGEN
DEAMINASE

(Escherichia
coli) 		PF01379
(Porphobil_deam)
PF03900
(Porphobil_deamC) 		4 LEU A 136
GLN A 133
LEU A 116
PHE A 108
 None
 1.00A 2einP-1gtkA:
undetectable
2einW-1gtkA:
0.0		 2einP-1gtkA:
21.18
2einW-1gtkA:
13.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jeq KU70

(Homo sapiens) 		PF02037
(SAP)
PF02735
(Ku)
PF03730
(Ku_C)
PF03731
(Ku_N) 		4 LEU A 434
GLN A 433
PHE A 432
LEU A 345
 None
 1.12A 2einP-1jeqA:
0.8
2einW-1jeqA:
0.0		 2einP-1jeqA:
18.07
2einW-1jeqA:
7.38
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.
1jkw CYCLIN H

(Homo sapiens) 		PF00134
(Cyclin_N)
PF16899
(Cyclin_C_2) 		4 ARG A 102
LEU A 106
PHE A 110
LEU A 129
 None
 0.84A 2einP-1jkwA:
undetectable
2einW-1jkwA:
0.0		 2einP-1jkwA:
20.52
2einW-1jkwA:
13.17
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.
1juv DIHYDROFOLATE
REDUCTASE

(Escherichia
virus T4) 		PF00186
(DHFR_1) 		4 LEU A  20
GLN A 159
PHE A  22
LEU A 165
 None
None
NDP  A 194 (-3.6A)
None
 0.97A 2einP-1juvA:
undetectable
2einW-1juvA:
0.0		 2einP-1juvA:
18.99
2einW-1juvA:
16.49
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.
1kfu M-CALPAIN LARGE
SUBUNIT

(Homo sapiens) 		PF00648
(Peptidase_C2)
PF01067
(Calpain_III)
PF13833
(EF-hand_8) 		4 LEU L  45
GLN L  47
PHE L  46
PHE L 131
 None
 1.12A 2einP-1kfuL:
undetectable
2einW-1kfuL:
0.0		 2einP-1kfuL:
16.26
2einW-1kfuL:
6.33
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.
1ko0 DIAMINOPIMELATE
DECARBOXYLASE

(Escherichia
coli) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		4 ARG A 111
LEU A 115
GLN A 116
LEU A  84
 None
 1.01A 2einP-1ko0A:
undetectable
2einW-1ko0A:
0.0		 2einP-1ko0A:
16.36
2einW-1ko0A:
8.81
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.
1pgr PROTEIN (G-CSF
RECEPTOR)

(Mus musculus) 		no annotation 4 LEU B 187
GLN B 188
LEU B 176
PHE B 174
 None
 1.05A 2einP-1pgrB:
undetectable
2einW-1pgrB:
undetectable		 2einP-1pgrB:
19.10
2einW-1pgrB:
13.02
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.
1q5n 3-CARBOXY-CIS,CIS-MU
CONATE
CYCLOISOMERASE

(Acinetobacter
calcoaceticus) 		PF00206
(Lyase_1)
PF10397
(ADSL_C) 		4 ARG A 120
LEU A 117
GLN A 118
LEU A 218
 None
 1.12A 2einP-1q5nA:
3.9
2einW-1q5nA:
undetectable		 2einP-1q5nA:
18.58
2einW-1q5nA:
9.21
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.
1qsa PROTEIN (SOLUBLE
LYTIC
TRANSGLYCOSYLASE
SLT70)

(Escherichia
coli) 		PF01464
(SLT)
PF14718
(SLT_L) 		4 LEU A 246
GLN A 245
LEU A 254
PHE A 222
 None
SO4  A 706 (-3.3A)
None
None
 0.99A 2einP-1qsaA:
0.9
2einW-1qsaA:
undetectable		 2einP-1qsaA:
17.26
2einW-1qsaA:
7.20
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.
1s5p NAD-DEPENDENT
DEACETYLASE

(Escherichia
coli) 		PF02146
(SIR2) 		4 LEU A 116
GLN A 117
LEU A 269
PHE A 265
 None
 1.12A 2einP-1s5pA:
undetectable
2einW-1s5pA:
undetectable		 2einP-1s5pA:
21.83
2einW-1s5pA:
15.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t9k PROBABLE
METHYLTHIORIBOSE-1-P
HOSPHATE ISOMERASE

(Thermotoga
maritima) 		PF01008
(IF-2B) 		4 LEU A  17
GLN A  20
LEU A  15
PHE A  59
 None
 1.10A 2einP-1t9kA:
undetectable
2einW-1t9kA:
undetectable		 2einP-1t9kA:
19.83
2einW-1t9kA:
13.62
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.
1tuz DIACYLGLYCEROL
KINASE ALPHA

(Homo sapiens) 		PF14513
(DAG_kinase_N) 		4 LEU A  74
GLN A  76
PHE A  75
LEU A  57
 None
 1.09A 2einP-1tuzA:
undetectable
2einW-1tuzA:
undetectable		 2einP-1tuzA:
16.86
2einW-1tuzA:
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.
2bec CALCINEURIN B
HOMOLOGOUS PROTEIN 2

(Homo sapiens) 		PF13202
(EF-hand_5)
PF13499
(EF-hand_7) 		4 ARG A 112
LEU A 116
PHE A 120
LEU A 181
 None
 0.96A 2einP-2becA:
undetectable
2einW-2becA:
undetectable		 2einP-2becA:
25.67
2einW-2becA:
12.38
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.
2cfm THERMOSTABLE DNA
LIGASE

(Pyrococcus
furiosus) 		PF01068
(DNA_ligase_A_M)
PF04675
(DNA_ligase_A_N)
PF04679
(DNA_ligase_A_C) 		4 LEU A 522
GLN A 511
PHE A 520
LEU A 428
 None
 0.96A 2einP-2cfmA:
undetectable
2einW-2cfmA:
undetectable		 2einP-2cfmA:
17.30
2einW-2cfmA:
7.20
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.
2fgc ACETOLACTATE
SYNTHASE, SMALL
SUBUNIT

(Thermotoga
maritima) 		PF01842
(ACT)
PF10369
(ALS_ss_C) 		4 LEU A 132
GLN A 131
PHE A 130
LEU A 166
 None
 1.03A 2einP-2fgcA:
undetectable
2einW-2fgcA:
undetectable		 2einP-2fgcA:
19.39
2einW-2fgcA:
13.30
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.
2kzb AUTOPHAGY-RELATED
PROTEIN 19

(Saccharomyces
cerevisiae) 		PF12744
(ATG19_autophagy) 		4 LEU A 277
GLN A 276
PHE A 278
LEU A 285
 None
 1.12A 2einP-2kzbA:
undetectable
2einW-2kzbA:
undetectable		 2einP-2kzbA:
16.48
2einW-2kzbA:
20.79
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.
2nqi CALPAIN-1 CATALYTIC
SUBUNIT

(Rattus
norvegicus) 		PF00648
(Peptidase_C2) 		4 LEU A  55
GLN A  57
PHE A  56
PHE A 141
 None
 1.12A 2einP-2nqiA:
undetectable
2einW-2nqiA:
undetectable		 2einP-2nqiA:
18.98
2einW-2nqiA:
10.85
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.
2nr4 CONSERVED
HYPOTHETICAL PROTEIN

(Methanosarcina
mazei) 		PF04289
(DUF447) 		4 LEU A  85
PHE A  86
LEU A  94
PHE A  99
 None
 1.05A 2einP-2nr4A:
2.4
2einW-2nr4A:
undetectable		 2einP-2nr4A:
22.61
2einW-2nr4A:
12.44
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.
2nyf NOSTOC PUNCTIFORME
PHENYLALANINE
AMMONIA LYASE

(Nostoc
punctiforme) 		PF00221
(Lyase_aromatic) 		4 ARG A 490
GLN A 485
PHE A 482
LEU A 257
 None
 1.12A 2einP-2nyfA:
3.3
2einW-2nyfA:
undetectable		 2einP-2nyfA:
17.96
2einW-2nyfA:
7.82
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.
2o36 THIMET
OLIGOPEPTIDASE

(Homo sapiens) 		PF01432
(Peptidase_M3) 		4 LEU A 564
GLN A 567
LEU A 601
PHE A 598
 None
 1.00A 2einP-2o36A:
3.4
2einW-2o36A:
undetectable		 2einP-2o36A:
17.45
2einW-2o36A:
7.26
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.
2o3e NEUROLYSIN

(Rattus
norvegicus) 		PF01432
(Peptidase_M3) 		4 LEU A 257
GLN A 258
LEU A 602
PHE A 599
 None
 0.92A 2einP-2o3eA:
5.0
2einW-2o3eA:
undetectable		 2einP-2o3eA:
17.94
2einW-2o3eA:
6.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oaa R.MVAI

(Kocuria varians) 		PF15515
(MvaI_BcnI) 		4 LEU A 156
GLN A 155
LEU A 190
PHE A 187
 None
 1.11A 2einP-2oaaA:
undetectable
2einW-2oaaA:
undetectable		 2einP-2oaaA:
20.00
2einW-2oaaA:
13.96
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.
2opt ACTII PROTEIN

(Streptomyces
coelicolor) 		PF00440
(TetR_N)
PF02909
(TetR_C) 		4 ARG A  75
LEU A  79
PHE A  83
LEU A  49
 None
 0.67A 2einP-2optA:
3.1
2einW-2optA:
undetectable		 2einP-2optA:
23.19
2einW-2optA:
12.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q2r GLUCOKINASE 1,
PUTATIVE

(Trypanosoma
cruzi) 		PF02685
(Glucokinase) 		4 ARG A  83
LEU A  24
PHE A  26
LEU A  15
 None
 1.02A 2einP-2q2rA:
undetectable
2einW-2q2rA:
undetectable		 2einP-2q2rA:
21.78
2einW-2q2rA:
10.96
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.
2q6z UROPORPHYRINOGEN
DECARBOXYLASE

(Homo sapiens) 		PF01208
(URO-D) 		4 LEU A 216
GLN A 215
PHE A 154
LEU A 199
 None
 1.07A 2einP-2q6zA:
undetectable
2einW-2q6zA:
undetectable		 2einP-2q6zA:
20.71
2einW-2q6zA:
9.43
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.
2xgo XCOGT

(Xanthomonas
campestris) 		PF13432
(TPR_16)
PF13844
(Glyco_transf_41) 		4 ARG A 532
LEU A 536
PHE A 543
LEU A 501
 None
 1.10A 2einP-2xgoA:
undetectable
2einW-2xgoA:
undetectable		 2einP-2xgoA:
16.90
2einW-2xgoA:
7.00
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.
2xn6 THYROXINE-BINDING
GLOBULIN

(Homo sapiens) 		PF00079
(Serpin) 		4 LEU A 180
PHE A 349
LEU A  60
PHE A 315
 None
 1.07A 2einP-2xn6A:
undetectable
2einW-2xn6A:
undetectable		 2einP-2xn6A:
20.83
2einW-2xn6A:
11.11
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.
2zou SPONDIN-1

(Homo sapiens) 		PF02014
(Reeler) 		5 LEU A 177
GLN A 172
PHE A 171
LEU A  82
PHE A  90
 EDO  A   6 (-3.8A)
EDO  A   6 (-4.9A)
None
None
None
 1.33A 2einP-2zouA:
undetectable
2einW-2zouA:
undetectable		 2einP-2zouA:
15.85
2einW-2zouA:
16.33
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.
3b86 GENERAL
ODORANT-BINDING
PROTEIN LUSH

(Drosophila
melanogaster) 		PF01395
(PBP_GOBP) 		4 LEU A  44
PHE A  21
LEU A  31
PHE A  36
 None
 1.03A 2einP-3b86A:
undetectable
2einW-3b86A:
undetectable		 2einP-3b86A:
17.60
2einW-3b86A:
22.00
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.
3b96 VERY LONG-CHAIN
SPECIFIC ACYL-COA
DEHYDROGENASE

(Homo sapiens) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 LEU A  42
GLN A  41
LEU A 481
PHE A  48
 None
 1.05A 2einP-3b96A:
3.0
2einW-3b96A:
undetectable		 2einP-3b96A:
18.56
2einW-3b96A:
6.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d1d RNA-INDUCED
TRANSCRIPTIONAL
SILENCING COMPLEX
PROTEIN TAS3

(Schizosaccharomyces
pombe) 		no annotation 4 LEU A 477
GLN A 478
LEU A 443
PHE A 449
 None
 1.10A 2einP-3d1dA:
undetectable
2einW-3d1dA:
undetectable		 2einP-3d1dA:
19.47
2einW-3d1dA:
20.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d3f YVGN PROTEIN

(Bacillus
subtilis) 		PF00248
(Aldo_ket_red) 		4 ARG A  71
LEU A 103
GLN A 102
LEU A 106
 None
 1.01A 2einP-3d3fA:
undetectable
2einW-3d3fA:
undetectable		 2einP-3d3fA:
20.40
2einW-3d3fA:
15.54
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.
3evz METHYLTRANSFERASE

(Pyrococcus
furiosus) 		PF05175
(MTS) 		4 LEU A 202
PHE A 153
LEU A 186
PHE A 182
 None
 1.05A 2einP-3evzA:
undetectable
2einW-3evzA:
undetectable		 2einP-3evzA:
19.78
2einW-3evzA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eyk HEMAGGLUTININ HA1
CHAIN

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 LEU A 118
GLN A  80
PHE A 120
LEU A 112
 None
 0.97A 2einP-3eykA:
undetectable
2einW-3eykA:
undetectable		 2einP-3eykA:
21.21
2einW-3eykA:
11.15
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.
3fmp ATP-DEPENDENT RNA
HELICASE DDX19B

(Homo sapiens) 		PF00270
(DEAD) 		4 LEU B 103
GLN B 102
PHE B 188
PHE B  94
 None
 1.10A 2einP-3fmpB:
undetectable
2einW-3fmpB:
undetectable		 2einP-3fmpB:
20.04
2einW-3fmpB:
7.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g1z PUTATIVE LYSYL-TRNA
SYNTHETASE

(Salmonella
enterica) 		PF00152
(tRNA-synt_2) 		4 ARG A 188
LEU A 192
GLN A 193
PHE A 196
 None
 0.73A 2einP-3g1zA:
undetectable
2einW-3g1zA:
undetectable		 2einP-3g1zA:
20.94
2einW-3g1zA:
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.
3lcr TAUTOMYCETIN
BIOSYNTHETIC PKS

(Streptomyces
sp. CK4412) 		PF00975
(Thioesterase) 		4 LEU A 229
GLN A 227
LEU A 178
PHE A 182
 None
 0.99A 2einP-3lcrA:
undetectable
2einW-3lcrA:
undetectable		 2einP-3lcrA:
20.45
2einW-3lcrA:
9.09
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.
3nbu GLUCOSE-6-PHOSPHATE
ISOMERASE

(Escherichia
coli) 		PF00342
(PGI) 		4 LEU A  15
GLN A  16
PHE A  19
LEU A  66
 None
 0.61A 2einP-3nbuA:
undetectable
2einW-3nbuA:
undetectable		 2einP-3nbuA:
18.63
2einW-3nbuA:
8.47
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.
3ocj PUTATIVE EXPORTED
PROTEIN

(Bordetella
parapertussis) 		PF13847
(Methyltransf_31) 		4 LEU A 252
GLN A 251
PHE A 254
LEU A  44
 None
None
GOL  A 303 ( 4.4A)
None
 1.01A 2einP-3ocjA:
undetectable
2einW-3ocjA:
undetectable		 2einP-3ocjA:
23.24
2einW-3ocjA:
11.22
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.
3opb SWI5-DEPENDENT HO
EXPRESSION PROTEIN 4

(Saccharomyces
cerevisiae) 		PF11701
(UNC45-central) 		4 LEU A 295
GLN A 294
LEU A 271
PHE A 267
 None
 0.87A 2einP-3opbA:
undetectable
2einW-3opbA:
undetectable		 2einP-3opbA:
14.10
2einW-3opbA:
5.23
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.
3os4 NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE

(Yersinia pestis) 		PF04095
(NAPRTase) 		4 LEU A 150
GLN A 149
LEU A 192
PHE A 196
 None
 1.06A 2einP-3os4A:
undetectable
2einW-3os4A:
undetectable		 2einP-3os4A:
20.76
2einW-3os4A:
12.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pl0 UNCHARACTERIZED
PROTEIN

(Methylibium
petroleiphilum) 		PF10014
(2OG-Fe_Oxy_2) 		4 LEU A  15
GLN A  16
LEU A 129
PHE A 130
 None
 0.76A 2einP-3pl0A:
undetectable
2einW-3pl0A:
undetectable		 2einP-3pl0A:
21.36
2einW-3pl0A:
11.42
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.
3qde CELLOBIOSE
PHOSPHORYLASE

(Ruminiclostridium
thermocellum) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		4 LEU A 134
GLN A 255
LEU A 146
PHE A  72
 None
 1.11A 2einP-3qdeA:
undetectable
2einW-3qdeA:
undetectable		 2einP-3qdeA:
15.31
2einW-3qdeA:
4.98
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.
3vsk PENICILLIN-BINDING
PROTEIN 3

(Staphylococcus
aureus) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		4 LEU A 471
GLN A 422
LEU A 518
PHE A 454
 None
 1.12A 2einP-3vskA:
undetectable
2einW-3vskA:
undetectable		 2einP-3vskA:
16.33
2einW-3vskA:
6.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wi3 DNA REPLICATION
REGULATOR SLD3

(Saccharomyces
cerevisiae) 		PF08639
(SLD3) 		4 GLN A 415
PHE A 412
LEU A 398
PHE A 393
 None
 1.02A 2einP-3wi3A:
1.7
2einW-3wi3A:
undetectable		 2einP-3wi3A:
18.93
2einW-3wi3A:
12.32
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.
4a8e PROBABLE TYROSINE
RECOMBINASE
XERC-LIKE

(Pyrococcus
abyssi) 		PF00589
(Phage_integrase)
PF02899
(Phage_int_SAM_1) 		4 ARG A 184
LEU A 181
LEU A 191
PHE A 192
 None
 0.93A 2einP-4a8eA:
undetectable
2einW-4a8eA:
undetectable		 2einP-4a8eA:
19.68
2einW-4a8eA:
12.25
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.
4c0d CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF04054
(Not1) 		4 LEU A1975
GLN A1976
LEU A2026
PHE A2034
 None
 0.88A 2einP-4c0dA:
2.8
2einW-4c0dA:
undetectable		 2einP-4c0dA:
14.62
2einW-4c0dA:
5.38
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.
4c23 L-FUCULOSE KINASE
FUCK

(Streptococcus
pneumoniae) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		4 LEU A 135
GLN A 134
PHE A 133
LEU A 197
 None
 1.01A 2einP-4c23A:
undetectable
2einW-4c23A:
undetectable		 2einP-4c23A:
19.10
2einW-4c23A:
8.46
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.
4e1e FARNESYL
PYROPHOSPHATE
SYNTHASE

(Trypanosoma
cruzi) 		PF00348
(polyprenyl_synt) 		4 LEU A 215
PHE A 210
LEU A 155
PHE A 222
 None
 1.13A 2einP-4e1eA:
2.2
2einW-4e1eA:
undetectable		 2einP-4e1eA:
20.44
2einW-4e1eA:
10.92
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.
4flx DNA POLYMERASE 1

(Pyrococcus
abyssi) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		4 ARG A 266
LEU A 352
PHE A 356
LEU A 333
 ARG  A 266 ( 0.6A)
LEU  A 352 ( 0.6A)
PHE  A 356 ( 1.3A)
LEU  A 333 ( 0.6A)
 1.04A 2einP-4flxA:
2.4
2einW-4flxA:
undetectable		 2einP-4flxA:
13.49
2einW-4flxA:
6.62
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.
4hdo KREV INTERACTION
TRAPPED PROTEIN 1

(Homo sapiens) 		PF00373
(FERM_M) 		4 LEU A 621
GLN A 622
PHE A 625
LEU A 608
 None
 0.86A 2einP-4hdoA:
undetectable
2einW-4hdoA:
undetectable		 2einP-4hdoA:
20.67
2einW-4hdoA:
14.62
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.
4ma5 PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE, ATPASE
SUBUNIT

(Francisella
tularensis) 		PF02222
(ATP-grasp) 		4 LEU A 137
GLN A 149
PHE A 150
LEU A 124
 None
ANP  A 401 ( 4.5A)
None
None
 0.97A 2einP-4ma5A:
undetectable
2einW-4ma5A:
undetectable		 2einP-4ma5A:
22.16
2einW-4ma5A:
13.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mp4 GLUTATHIONE
S-TRANSFERASE

(Acinetobacter
baumannii) 		PF13417
(GST_N_3)
PF14834
(GST_C_4) 		4 LEU A 169
GLN A 194
LEU A 143
PHE A 144
 None
 1.03A 2einP-4mp4A:
undetectable
2einW-4mp4A:
undetectable		 2einP-4mp4A:
23.13
2einW-4mp4A:
15.82
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.
4nfu SENESCENCE-ASSOCIATE
D CARBOXYLESTERASE
101

(Arabidopsis
thaliana) 		PF01764
(Lipase_3) 		4 LEU B 189
GLN B 186
LEU B 157
PHE B  95
 None
 1.07A 2einP-4nfuB:
2.9
2einW-4nfuB:
undetectable		 2einP-4nfuB:
18.15
2einW-4nfuB:
7.60
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.
4o92 GLUTATHIONE
S-TRANSFERASE

(Pichia
kudriavzevii) 		PF00043
(GST_C)
PF02798
(GST_N) 		4 LEU A 157
GLN A 158
LEU A 128
PHE A 170
 None
 1.07A 2einP-4o92A:
3.6
2einW-4o92A:
undetectable		 2einP-4o92A:
22.96
2einW-4o92A:
13.30
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.
4ofw PROTEIN DJ-1 HOMOLOG
D

(Arabidopsis
thaliana) 		PF01965
(DJ-1_PfpI) 		4 LEU A 220
GLN A 221
LEU A 378
PHE A 374
 None
 1.10A 2einP-4ofwA:
undetectable
2einW-4ofwA:
undetectable		 2einP-4ofwA:
21.24
2einW-4ofwA:
10.33
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.
4oya ADENYLATE CYCLASE
TYPE 10

(Homo sapiens) 		PF00211
(Guanylate_cyc) 		4 GLN A 375
PHE A 372
LEU A 299
PHE A 301
 None
 0.91A 2einP-4oyaA:
undetectable
2einW-4oyaA:
undetectable		 2einP-4oyaA:
19.62
2einW-4oyaA:
8.46
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.
4us5 LUCIFERASE-LIKE
MONOOXYGENASE

(Streptomyces
bottropensis) 		PF00296
(Bac_luciferase) 		4 LEU A 140
GLN A 139
LEU A 103
PHE A  90
 None
 0.99A 2einP-4us5A:
undetectable
2einW-4us5A:
undetectable		 2einP-4us5A:
20.29
2einW-4us5A:
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.
4w7v CELLULASE

(Xanthomonas
citri) 		PF00150
(Cellulase) 		4 LEU A 228
GLN A 229
LEU A 244
PHE A 247
 None
 1.09A 2einP-4w7vA:
undetectable
2einW-4w7vA:
undetectable		 2einP-4w7vA:
20.98
2einW-4w7vA:
11.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4x00 PUTATIVE HYDROLASE

(Burkholderia
cenocepacia) 		PF12697
(Abhydrolase_6) 		4 LEU A  59
GLN A  60
LEU A 273
PHE A 269
 None
 0.72A 2einP-4x00A:
undetectable
2einW-4x00A:
undetectable		 2einP-4x00A:
21.50
2einW-4x00A:
12.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4x3h ACTIVITY-REGULATED
CYTOSKELETON-ASSOCIA
TED PROTEIN

(Rattus
norvegicus) 		no annotation 4 LEU A 272
GLN A 273
LEU A 221
PHE A 220
 None
 1.02A 2einP-4x3hA:
undetectable
2einW-4x3hA:
undetectable		 2einP-4x3hA:
15.00
2einW-4x3hA:
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.
4xgt FRQ-INTERACTING RNA
HELICASE

(Neurospora
crassa) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF08148
(DSHCT)
PF13234
(rRNA_proc-arch) 		4 LEU A 524
GLN A 526
PHE A 525
LEU A 502
 None
 1.05A 2einP-4xgtA:
undetectable
2einW-4xgtA:
undetectable		 2einP-4xgtA:
12.69
2einW-4xgtA:
6.27
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.
4z61 PHYTOSULFOKINE
RECEPTOR 1

(Daucus carota) 		PF00560
(LRR_1)
PF13855
(LRR_8) 		4 LEU A 229
GLN A 228
PHE A 227
LEU A 211
 None
 1.00A 2einP-4z61A:
undetectable
2einW-4z61A:
undetectable		 2einP-4z61A:
16.59
2einW-4z61A:
5.76
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.
5a98 POLYHEDRIN

(Cypovirus 15) 		no annotation 4 LEU A 111
GLN A 110
LEU A 187
PHE A  53
 None
 1.00A 2einP-5a98A:
undetectable
2einW-5a98A:
undetectable		 2einP-5a98A:
21.31
2einW-5a98A:
12.96
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.
5a98 POLYHEDRIN

(Cypovirus 15) 		no annotation 4 LEU A 111
GLN A 110
LEU A 187
PHE A 189
 None
 1.09A 2einP-5a98A:
undetectable
2einW-5a98A:
undetectable		 2einP-5a98A:
21.31
2einW-5a98A:
12.96
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.
5c9h TELOMERASE REVERSE
TRANSCRIPTASE

(Tetrahymena
thermophila) 		PF12009
(Telomerase_RBD) 		4 GLN A 382
PHE A 379
LEU A 405
PHE A 401
 None
 0.86A 2einP-5c9hA:
undetectable
2einW-5c9hA:
undetectable		 2einP-5c9hA:
18.61
2einW-5c9hA:
11.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5d9a RNA-DIRECTED RNA
POLYMERASE CATALYTIC
SUBUNIT

(Influenza C
virus) 		PF00602
(Flu_PB1) 		4 LEU B 442
GLN B 443
LEU B 284
PHE B 498
 None
 1.13A 2einP-5d9aB:
undetectable
2einW-5d9aB:
undetectable		 2einP-5d9aB:
16.47
2einW-5d9aB:
5.61
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.
5du3 PLASMA PROTEASE C1
INHIBITOR

(Homo sapiens) 		PF00079
(Serpin) 		4 LEU A 394
PHE A 396
LEU A 131
PHE A 135
 None
 1.12A 2einP-5du3A:
undetectable
2einW-5du3A:
undetectable		 2einP-5du3A:
21.65
2einW-5du3A:
10.63
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.
5du9 CDA PEPTIDE
SYNTHETASE I

(Streptomyces
coelicolor) 		PF00668
(Condensation) 		4 LEU A 423
GLN A 424
PHE A 427
LEU A 229
 None
 0.73A 2einP-5du9A:
undetectable
2einW-5du9A:
undetectable		 2einP-5du9A:
20.97
2einW-5du9A:
7.92
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.
5e0c CELLULASE

(Bacillus sp.
BG-CS10) 		PF00150
(Cellulase)
PF03442
(CBM_X2) 		4 LEU A 429
GLN A 428
PHE A 427
LEU A 400
 None
 1.05A 2einP-5e0cA:
undetectable
2einW-5e0cA:
undetectable		 2einP-5e0cA:
20.19
2einW-5e0cA:
8.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e9c HEPARANASE

(Homo sapiens) 		PF03662
(Glyco_hydro_79n) 		4 LEU A 495
GLN A 494
LEU A 409
PHE A 531
 None
 1.01A 2einP-5e9cA:
undetectable
2einW-5e9cA:
undetectable		 2einP-5e9cA:
21.23
2einW-5e9cA:
7.81
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.
5fn3 PRESENILIN-1

(Homo sapiens) 		PF01080
(Presenilin) 		4 LEU B 392
PHE B 388
LEU B 443
PHE B 447
 None
 0.93A 2einP-5fn3B:
2.1
2einW-5fn3B:
undetectable		 2einP-5fn3B:
20.04
2einW-5fn3B:
7.86
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.
5fu7 CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF04054
(Not1) 		4 LEU A1975
GLN A1976
LEU A2026
PHE A2034
 None
 1.11A 2einP-5fu7A:
2.8
2einW-5fu7A:
undetectable		 2einP-5fu7A:
18.30
2einW-5fu7A:
7.81
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.
5gsm EXO-BETA-D-GLUCOSAMI
NIDASE

(Thermococcus
kodakarensis) 		PF02449
(Glyco_hydro_42) 		4 LEU A  25
GLN A  26
PHE A  27
LEU A  39
 None
 0.97A 2einP-5gsmA:
undetectable
2einW-5gsmA:
undetectable		 2einP-5gsmA:
16.50
2einW-5gsmA:
6.61
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.
5gwj DNA TOPOISOMERASE
2-BETA

(Homo sapiens) 		PF00521
(DNA_topoisoIV)
PF01751
(Toprim)
PF16898
(TOPRIM_C) 		4 LEU A 826
GLN A 801
LEU A 746
PHE A 834
 None
 1.12A 2einP-5gwjA:
2.2
2einW-5gwjA:
undetectable		 2einP-5gwjA:
15.12
2einW-5gwjA:
6.46
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.
5h64 SERINE/THREONINE-PRO
TEIN KINASE MTOR

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08771
(FRB_dom)
PF11865
(DUF3385) 		4 LEU A2204
GLN A2200
PHE A2202
LEU A2208
 None
 1.04A 2einP-5h64A:
3.6
2einW-5h64A:
undetectable		 2einP-5h64A:
6.94
2einW-5h64A:
2.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5iy5 CYTOCHROME C OXIDASE
SUBUNIT 3

(Bos taurus) 		PF00510
(COX3) 		5 ARG C 156
LEU C 160
GLN C 161
PHE C 164
LEU C 223
 CHD  C 307 (-4.0A)
CHD  C 307 ( 3.9A)
CHD  C 307 (-4.3A)
CHD  C 307 (-3.9A)
None
 0.46A 2einP-5iy5C:
36.7
2einW-5iy5C:
undetectable		 2einP-5iy5C:
100.00
2einW-5iy5C:
10.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k04 UNCHARACTERIZED
PROTEIN

(Candida
albicans) 		PF09797
(NatB_MDM20) 		4 ARG A 138
LEU A 142
PHE A 146
PHE A 177
 None
 1.08A 2einP-5k04A:
2.2
2einW-5k04A:
undetectable		 2einP-5k04A:
16.13
2einW-5k04A:
7.61
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.
5k8o 5-NITROANTHRANILIC
ACID AMINOHYDROLASE

(Bradyrhizobium
sp.) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 LEU A 345
GLN A 346
LEU A  81
PHE A  83
 None
 1.01A 2einP-5k8oA:
undetectable
2einW-5k8oA:
undetectable		 2einP-5k8oA:
17.58
2einW-5k8oA:
8.25
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.
5l94 CYTOCHROME P450

(Bacillus
megaterium) 		PF00067
(p450) 		4 LEU A 227
GLN A 226
LEU A 217
PHE A 235
 None
 0.97A 2einP-5l94A:
undetectable
2einW-5l94A:
undetectable		 2einP-5l94A:
19.00
2einW-5l94A:
9.02
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.
5la7 HEPARANASE

(Homo sapiens) 		PF03662
(Glyco_hydro_79n) 		4 LEU A 495
GLN A 494
LEU A 409
PHE A 531
 EDO  A 609 ( 4.5A)
None
None
None
 1.02A 2einP-5la7A:
undetectable
2einW-5la7A:
undetectable		 2einP-5la7A:
19.44
2einW-5la7A:
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.
5mpd 26S PROTEASOME
REGULATORY SUBUNIT
RPN5

(Saccharomyces
cerevisiae) 		PF01399
(PCI) 		4 LEU P 181
GLN P 183
PHE P 179
LEU P 216
 None
 1.06A 2einP-5mpdP:
undetectable
2einW-5mpdP:
undetectable		 2einP-5mpdP:
19.87
2einW-5mpdP:
8.24
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.
5mpd 26S PROTEASOME
REGULATORY SUBUNIT
RPN9

(Saccharomyces
cerevisiae) 		PF01399
(PCI) 		4 LEU O 254
GLN O 253
PHE O 252
LEU O 222
 None
 1.00A 2einP-5mpdO:
2.5
2einW-5mpdO:
undetectable		 2einP-5mpdO:
20.20
2einW-5mpdO:
10.73
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.
5n0c TETANUS TOXIN

(Clostridium
tetani) 		PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N) 		4 LEU A1255
GLN A1254
LEU A1198
PHE A1175
 None
 1.12A 2einP-5n0cA:
3.1
2einW-5n0cA:
undetectable		 2einP-5n0cA:
10.63
2einW-5n0cA:
3.88
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.
5uvn PARAQUAT-INDUCIBLE
PROTEIN B

(Escherichia
coli) 		PF02470
(MlaD) 		4 LEU A 202
GLN A 201
PHE A 203
PHE A 250
 None
 1.05A 2einP-5uvnA:
undetectable
2einW-5uvnA:
undetectable		 2einP-5uvnA:
20.54
2einW-5uvnA:
11.78
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.
5v91 FOSFOMYCIN
RESISTANCE PROTEIN

(Klebsiella
pneumoniae) 		PF00903
(Glyoxalase) 		4 LEU A  25
GLN A  24
LEU A  84
PHE A 104
 None
 1.08A 2einP-5v91A:
undetectable
2einW-5v91A:
undetectable		 2einP-5v91A:
20.65
2einW-5v91A:
17.16
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.
5viq MONOMERIC
NEAR-INFRARED
FLUORESCENT PROTEIN
MIRFP709

(Rhodopseudomonas
palustris) 		PF01590
(GAF)
PF08446
(PAS_2) 		4 LEU A 255
GLN A 256
PHE A 257
LEU A 218
 None
None
BLA  A 401 (-4.3A)
None
 0.96A 2einP-5viqA:
undetectable
2einW-5viqA:
undetectable		 2einP-5viqA:
19.88
2einW-5viqA:
12.78
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.
5vl3 B-CELL RECEPTOR CD22

(Homo sapiens) 		no annotation 4 LEU Q 163
GLN Q 164
PHE Q 199
LEU Q 174
 None
 1.10A 2einP-5vl3Q:
undetectable
2einW-5vl3Q:
undetectable		 2einP-5vl3Q:
21.85
2einW-5vl3Q:
10.79
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.
5wu7 UNCHARACTERIZED
PROTEIN

(Pyrococcus
horikoshii) 		PF03065
(Glyco_hydro_57)
PF09210
(DUF1957) 		4 LEU A 163
GLN A 162
LEU A 212
PHE A 220
 None
 1.04A 2einP-5wu7A:
3.1
2einW-5wu7A:
undetectable		 2einP-5wu7A:
16.58
2einW-5wu7A:
7.97
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.
5xge UNCHARACTERIZED
PROTEIN PA0861

(Pseudomonas
aeruginosa) 		no annotation 4 LEU A 658
GLN A 659
PHE A 660
LEU A 698
 None
 0.95A 2einP-5xgeA:
undetectable
2einW-5xgeA:
undetectable		 2einP-5xgeA:
undetectable
2einW-5xgeA:
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.
5xhx HELIX-TURN-HELIX
TRANSCRIPTIONAL
REGULATOR

(Pseudomonas
aeruginosa) 		no annotation 4 LEU A 141
GLN A 128
LEU A  30
PHE A  26
 None
 0.95A 2einP-5xhxA:
undetectable
2einW-5xhxA:
undetectable		 2einP-5xhxA:
21.93
2einW-5xhxA:
16.86
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.
5xog DNA-DIRECTED RNA
POLYMERASE SUBUNIT

(Komagataella
phaffii) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		4 LEU A 868
GLN A 866
PHE A 867
LEU A1002
 None
 0.77A 2einP-5xogA:
3.9
2einW-5xogA:
undetectable		 2einP-5xogA:
9.55
2einW-5xogA:
3.28
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.
5xsx CHITINASE

(Thermococcus
chitonophagus) 		no annotation 4 LEU A 619
PHE A 518
LEU A 525
PHE A 569
 None
 1.11A 2einP-5xsxA:
undetectable
2einW-5xsxA:
undetectable		 2einP-5xsxA:
undetectable
2einW-5xsxA:
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.
5y6f FLAGELLAR BRAKE
PROTEIN YCGR

(Escherichia
coli) 		no annotation 4 LEU A 163
GLN A 164
LEU A 139
PHE A 141
 None
 1.07A 2einP-5y6fA:
undetectable
2einW-5y6fA:
undetectable		 2einP-5y6fA:
undetectable
2einW-5y6fA:
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.
6c29 PUTATIVE METAL
RESISTANCE PROTEIN

(Proteus
mirabilis) 		no annotation 4 LEU A 167
GLN A 166
LEU A 227
PHE A 229
 None
 0.94A 2einP-6c29A:
undetectable
2einW-6c29A:
undetectable		 2einP-6c29A:
undetectable
2einW-6c29A:
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.
6c80 CYTOKININ OXIDASE
LUCKX1.1

(Linum
usitatissimum) 		no annotation 4 LEU A 268
GLN A 271
LEU A 318
PHE A 261
 None
 1.11A 2einP-6c80A:
undetectable
2einW-6c80A:
undetectable		 2einP-6c80A:
undetectable
2einW-6c80A:
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.
6cfp UBIQUITIN-LIKE
PROTEIN
SMT3,POLYMERASE
ACIDIC PROTEIN

(Saccharomyces
cerevisiae;
Influenza A
virus) 		no annotation 4 LEU A 694
GLN A 654
LEU A 268
PHE A 707
 None
 0.94A 2einP-6cfpA:
undetectable
2einW-6cfpA:
undetectable		 2einP-6cfpA:
undetectable
2einW-6cfpA:
undetectable