SIMILAR PATTERNS OF AMINO ACIDS FOR 2EIM_C_CHDC271

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
 0.91A 2eimC-1d2iA:
undetectable
2eimJ-1d2iA:
0.0		 2eimC-1d2iA:
19.62
2eimJ-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.
1ebl BETA-KETOACYL-ACP
SYNTHASE III

(Escherichia
coli) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		4 LEU A 298
GLN A 297
PHE A 317
LEU A 314
 None
 1.07A 2eimC-1eblA:
undetectable
2eimJ-1eblA:
undetectable		 2eimC-1eblA:
21.30
2eimJ-1eblA:
12.21
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.
1eco ERYTHROCRUORIN
(CARBONMONOXY)

(Chironomus
thummi) 		PF00042
(Globin) 		4 GLN A  10
PHE A  13
LEU A 125
PHE A 129
 None
 1.08A 2eimC-1ecoA:
undetectable
2eimJ-1ecoA:
0.0		 2eimC-1ecoA:
20.00
2eimJ-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
 0.96A 2eimC-1f2rI:
undetectable
2eimJ-1f2rI:
0.0		 2eimC-1f2rI:
17.97
2eimJ-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
 0.95A 2eimC-1gtkA:
undetectable
2eimJ-1gtkA:
0.0		 2eimC-1gtkA:
21.18
2eimJ-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.
1hkk CHITOTRIOSIDASE-1

(Homo sapiens) 		PF00704
(Glyco_hydro_18) 		4 LEU A  66
GLN A  65
LEU A  94
PHE A 132
 None
 0.90A 2eimC-1hkkA:
0.3
2eimJ-1hkkA:
0.0		 2eimC-1hkkA:
21.66
2eimJ-1hkkA:
12.77
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.
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
 0.94A 2eimC-1jkwA:
0.7
2eimJ-1jkwA:
0.0		 2eimC-1jkwA:
20.52
2eimJ-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
 1.00A 2eimC-1juvA:
undetectable
2eimJ-1juvA:
0.0		 2eimC-1juvA:
18.99
2eimJ-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.
1kaf TRANSCRIPTION
REGULATORY PROTEIN
MOTA

(Escherichia
virus T4) 		PF09158
(MotCF) 		4 LYS A 130
LEU A 128
LEU A 121
PHE A 152
 None
 1.04A 2eimC-1kafA:
undetectable
2eimJ-1kafA:
0.0		 2eimC-1kafA:
14.29
2eimJ-1kafA:
19.35
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.
1kkc MANGANESE SUPEROXIDE
DISMUTASE

(Aspergillus
fumigatus) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 LEU A  28
GLN A  29
LEU A  95
PHE A  91
 None
 0.84A 2eimC-1kkcA:
2.4
2eimJ-1kkcA:
undetectable		 2eimC-1kkcA:
19.93
2eimJ-1kkcA:
13.12
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.
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
 0.97A 2eimC-1ko0A:
undetectable
2eimJ-1ko0A:
undetectable		 2eimC-1ko0A:
16.36
2eimJ-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
 1.08A 2eimC-1pgrB:
undetectable
2eimJ-1pgrB:
undetectable		 2eimC-1pgrB:
19.10
2eimJ-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.
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
 0.91A 2eimC-1qsaA:
undetectable
2eimJ-1qsaA:
undetectable		 2eimC-1qsaA:
17.26
2eimJ-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.
1tuz DIACYLGLYCEROL
KINASE ALPHA

(Homo sapiens) 		PF14513
(DAG_kinase_N) 		4 LEU A  74
GLN A  76
PHE A  75
LEU A  57
 None
 1.00A 2eimC-1tuzA:
undetectable
2eimJ-1tuzA:
undetectable		 2eimC-1tuzA:
16.86
2eimJ-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.
1uw4 UPF3X

(Homo sapiens) 		PF03467
(Smg4_UPF3) 		4 LYS A  64
LEU A  67
GLN A  68
LEU A  58
 None
 1.09A 2eimC-1uw4A:
undetectable
2eimJ-1uw4A:
undetectable		 2eimC-1uw4A:
15.13
2eimJ-1uw4A:
18.48
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.
1wb0 CHITOTRIOSIDASE 1

(Homo sapiens) 		PF00704
(Glyco_hydro_18) 		4 LEU A  66
GLN A  65
LEU A  94
PHE A 132
 None
 0.83A 2eimC-1wb0A:
undetectable
2eimJ-1wb0A:
undetectable		 2eimC-1wb0A:
19.69
2eimJ-1wb0A:
9.22
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.
1yka MONOTHIOL
GLUTAREDOXIN YDHD

(Escherichia
coli) 		PF00462
(Glutaredoxin) 		4 LEU A  74
GLN A  73
LEU A  40
PHE A  47
 None
 1.09A 2eimC-1ykaA:
undetectable
2eimJ-1ykaA:
undetectable		 2eimC-1ykaA:
16.35
2eimJ-1ykaA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gs0 RNA POLYMERASE II
TRANSCRIPTION FACTOR
B SUBUNIT 1

(Saccharomyces
cerevisiae) 		PF08567
(PH_TFIIH) 		4 LYS A 101
LEU A 104
GLN A 105
PHE A  89
 None
 0.98A 2eimC-2gs0A:
undetectable
2eimJ-2gs0A:
undetectable		 2eimC-2gs0A:
14.18
2eimJ-2gs0A:
17.86
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.
2hi3 HOMEODOMAIN-ONLY
PROTEIN

(Mus musculus) 		PF00046
(Homeobox) 		4 ARG A  59
LEU A  55
GLN A  53
PHE A  51
 None
 0.89A 2eimC-2hi3A:
undetectable
2eimJ-2hi3A:
undetectable		 2eimC-2hi3A:
13.41
2eimJ-2hi3A:
18.31
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.
2ho0 REPRESSOR PROTEIN
CI101-229DM-K192A

(Escherichia
coli) 		PF00717
(Peptidase_S24) 		4 LYS A 193
LEU A 203
GLN A 204
PHE A 202
 None
 1.05A 2eimC-2ho0A:
undetectable
2eimJ-2ho0A:
undetectable		 2eimC-2ho0A:
19.11
2eimJ-2ho0A:
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.
2o36 THIMET
OLIGOPEPTIDASE

(Homo sapiens) 		PF01432
(Peptidase_M3) 		4 LEU A 564
GLN A 567
LEU A 601
PHE A 598
 None
 0.98A 2eimC-2o36A:
3.5
2eimJ-2o36A:
undetectable		 2eimC-2o36A:
17.45
2eimJ-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.
2oaa R.MVAI

(Kocuria varians) 		PF15515
(MvaI_BcnI) 		4 LEU A 156
GLN A 155
LEU A 190
PHE A 187
 None
 1.01A 2eimC-2oaaA:
undetectable
2eimJ-2oaaA:
undetectable		 2eimC-2oaaA:
20.00
2eimJ-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
 0.75A 2eimC-2optA:
2.9
2eimJ-2optA:
undetectable		 2eimC-2optA:
23.19
2eimJ-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.
2otn DIAMINOPIMELATE
EPIMERASE

(Bacillus
anthracis) 		PF01678
(DAP_epimerase) 		4 ARG A  81
LYS A 271
LEU A 258
LEU A  12
 None
 0.73A 2eimC-2otnA:
undetectable
2eimJ-2otnA:
undetectable		 2eimC-2otnA:
21.78
2eimJ-2otnA:
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.
2wci GLUTAREDOXIN-4

(Escherichia
coli) 		PF00462
(Glutaredoxin) 		4 LEU A  74
GLN A  73
LEU A  40
PHE A  47
 None
 1.05A 2eimC-2wciA:
undetectable
2eimJ-2wciA:
undetectable		 2eimC-2wciA:
18.63
2eimJ-2wciA:
17.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 0.95A 2eimC-2xgoA:
undetectable
2eimJ-2xgoA:
undetectable		 2eimC-2xgoA:
16.90
2eimJ-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.
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
 0.99A 2eimC-3b96A:
2.9
2eimJ-3b96A:
undetectable		 2eimC-3b96A:
18.56
2eimJ-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.
3ba3 PYRIDOXAMINE
5'-PHOSPHATE
OXIDASE-LIKE PROTEIN

(Lactobacillus
plantarum) 		no annotation 4 LEU A 123
GLN A  87
PHE A 121
LEU A  18
 None
 1.00A 2eimC-3ba3A:
undetectable
2eimJ-3ba3A:
undetectable		 2eimC-3ba3A:
21.19
2eimJ-3ba3A:
18.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ctt MALTASE-GLUCOAMYLASE

(Homo sapiens) 		PF00088
(Trefoil)
PF01055
(Glyco_hydro_31)
PF16863
(NtCtMGAM_N) 		4 ARG A 144
LEU A 151
PHE A 152
LEU A 266
 None
 1.07A 2eimC-3cttA:
undetectable
2eimJ-3cttA:
undetectable		 2eimC-3cttA:
14.24
2eimJ-3cttA:
5.12
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.
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
 0.97A 2eimC-3d1dA:
undetectable
2eimJ-3d1dA:
undetectable		 2eimC-3d1dA:
19.47
2eimJ-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.
3e4e CYTOCHROME P450 2E1

(Homo sapiens) 		PF00067
(p450) 		4 LYS A 461
LEU A 460
PHE A 458
LEU A 312
 None
 1.08A 2eimC-3e4eA:
undetectable
2eimJ-3e4eA:
undetectable		 2eimC-3e4eA:
19.83
2eimJ-3e4eA:
7.98
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.
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
 0.86A 2eimC-3g1zA:
undetectable
2eimJ-3g1zA:
undetectable		 2eimC-3g1zA:
20.94
2eimJ-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.
3hn2 2-DEHYDROPANTOATE
2-REDUCTASE

(Geobacter
metallireducens) 		PF02558
(ApbA)
PF08546
(ApbA_C) 		4 LEU A 197
GLN A 199
LEU A 293
PHE A 273
 None
 1.08A 2eimC-3hn2A:
undetectable
2eimJ-3hn2A:
undetectable		 2eimC-3hn2A:
22.00
2eimJ-3hn2A:
10.58
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.
3hrt METALLOREGULATOR
SCAR

(Streptococcus
gordonii) 		PF01325
(Fe_dep_repress)
PF02742
(Fe_dep_repr_C)
PF04023
(FeoA) 		4 ARG A  74
LYS A  75
LEU A  78
PHE A  82
 None
 0.81A 2eimC-3hrtA:
undetectable
2eimJ-3hrtA:
undetectable		 2eimC-3hrtA:
18.61
2eimJ-3hrtA:
14.49
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.
3kt4 PKHD-TYPE
HYDROXYLASE TPA1

(Saccharomyces
cerevisiae) 		PF10637
(Ofd1_CTDD)
PF13661
(2OG-FeII_Oxy_4) 		4 LEU A 355
GLN A 356
PHE A 359
PHE A 370
 None
 1.04A 2eimC-3kt4A:
undetectable
2eimJ-3kt4A:
undetectable		 2eimC-3kt4A:
18.26
2eimJ-3kt4A:
7.22
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.
3kwp PREDICTED
METHYLTRANSFERASE

(Lactobacillus
brevis) 		PF00590
(TP_methylase) 		4 LYS A 177
LEU A 180
GLN A 181
LEU A 195
 None
 0.86A 2eimC-3kwpA:
undetectable
2eimJ-3kwpA:
undetectable		 2eimC-3kwpA:
20.92
2eimJ-3kwpA:
14.23
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.
3l6c SERINE RACEMASE

(Rattus
norvegicus) 		PF00291
(PALP) 		4 LEU A 171
GLN A 173
LEU A 200
PHE A   9
 None
 0.94A 2eimC-3l6cA:
undetectable
2eimJ-3l6cA:
undetectable		 2eimC-3l6cA:
21.73
2eimJ-3l6cA:
12.28
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.
3mvu TENA FAMILY
TRANSCRIPTIONAL
REGULATOR

(Ruegeria sp.
TM1040) 		PF03070
(TENA_THI-4) 		4 LEU A 204
PHE A 208
LEU A 187
PHE A 195
 None
None
None
EDO  A 231 (-3.8A)
 0.94A 2eimC-3mvuA:
3.0
2eimJ-3mvuA:
undetectable		 2eimC-3mvuA:
20.30
2eimJ-3mvuA:
14.75
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.
3nbu GLUCOSE-6-PHOSPHATE
ISOMERASE

(Escherichia
coli) 		PF00342
(PGI) 		4 LEU A  15
GLN A  16
PHE A  19
LEU A  66
 None
 0.68A 2eimC-3nbuA:
undetectable
2eimJ-3nbuA:
undetectable		 2eimC-3nbuA:
18.63
2eimJ-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.
3on4 TRANSCRIPTIONAL
REGULATOR, TETR
FAMILY

(Legionella
pneumophila) 		PF00440
(TetR_N) 		4 LYS A  82
GLN A  86
PHE A  89
LEU A 135
 None
 1.02A 2eimC-3on4A:
2.7
2eimJ-3on4A:
undetectable		 2eimC-3on4A:
19.85
2eimJ-3on4A:
16.23
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.
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
 0.94A 2eimC-3opbA:
undetectable
2eimJ-3opbA:
undetectable		 2eimC-3opbA:
14.10
2eimJ-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.
3pl0 UNCHARACTERIZED
PROTEIN

(Methylibium
petroleiphilum) 		PF10014
(2OG-Fe_Oxy_2) 		4 LEU A  15
GLN A  16
LEU A 129
PHE A 130
 None
 0.85A 2eimC-3pl0A:
undetectable
2eimJ-3pl0A:
undetectable		 2eimC-3pl0A:
21.36
2eimJ-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.
3qc5 PLATELET BINDING
PROTEIN GSPB

(Streptococcus
gordonii) 		no annotation 4 LYS X 466
LEU X 465
GLN X 464
LEU X 434
 None
None
None
NA  X 609 (-4.7A)
 1.02A 2eimC-3qc5X:
undetectable
2eimJ-3qc5X:
undetectable		 2eimC-3qc5X:
19.45
2eimJ-3qc5X:
10.29
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.
3s98 INTERFERON
ALPHA/BETA RECEPTOR
1

(Homo sapiens) 		PF01108
(Tissue_fac)
PF09294
(Interfer-bind) 		4 LYS A 220
LEU A 219
GLN A 263
LEU A 278
 None
 1.09A 2eimC-3s98A:
undetectable
2eimJ-3s98A:
undetectable		 2eimC-3s98A:
20.62
2eimJ-3s98A:
12.12
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.
3tfm MYOSIN X

(Rattus
norvegicus) 		PF00169
(PH) 		4 LYS A  33
LEU A  32
PHE A  11
LEU A 212
 None
 1.06A 2eimC-3tfmA:
undetectable
2eimJ-3tfmA:
undetectable		 2eimC-3tfmA:
20.15
2eimJ-3tfmA:
17.99
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.
3u58 TETRAHYMENA TEB1 AB

(Tetrahymena
thermophila) 		PF01336
(tRNA_anti-codon) 		4 LYS A 457
LEU A 456
GLN A 455
LEU A 389
 None
 0.82A 2eimC-3u58A:
undetectable
2eimJ-3u58A:
undetectable		 2eimC-3u58A:
21.88
2eimJ-3u58A:
18.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 1.03A 2eimC-3vskA:
undetectable
2eimJ-3vskA:
undetectable		 2eimC-3vskA:
16.33
2eimJ-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
 0.97A 2eimC-3wi3A:
1.7
2eimJ-3wi3A:
undetectable		 2eimC-3wi3A:
18.93
2eimJ-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.
4abn TETRATRICOPEPTIDE
REPEAT PROTEIN 5

(Mus musculus) 		PF16669
(TTC5_OB) 		4 LYS A 281
PHE A 355
LEU A 274
PHE A 405
 None
 0.98A 2eimC-4abnA:
2.9
2eimJ-4abnA:
undetectable		 2eimC-4abnA:
19.53
2eimJ-4abnA:
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.
4c0d CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF04054
(Not1) 		4 GLN A2252
PHE A2251
LEU A2196
PHE A2192
 None
 0.89A 2eimC-4c0dA:
3.1
2eimJ-4c0dA:
undetectable		 2eimC-4c0dA:
14.62
2eimJ-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.
4c0d CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF04054
(Not1) 		4 LEU A1975
GLN A1976
LEU A2026
PHE A2034
 None
 0.95A 2eimC-4c0dA:
3.1
2eimJ-4c0dA:
undetectable		 2eimC-4c0dA:
14.62
2eimJ-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.
4cnm TROPHOBLAST
GLYCOPROTEIN

(Homo sapiens) 		PF01462
(LRRNT)
PF01463
(LRRCT)
PF13855
(LRR_8) 		4 LYS A 172
LEU A 175
LEU A 147
PHE A 138
 None
 1.05A 2eimC-4cnmA:
undetectable
2eimJ-4cnmA:
undetectable		 2eimC-4cnmA:
21.14
2eimJ-4cnmA:
12.98
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.
4e1e FARNESYL
PYROPHOSPHATE
SYNTHASE

(Trypanosoma
cruzi) 		PF00348
(polyprenyl_synt) 		4 LEU A 215
PHE A 210
LEU A 155
PHE A 222
 None
 1.04A 2eimC-4e1eA:
2.8
2eimJ-4e1eA:
undetectable		 2eimC-4e1eA:
20.44
2eimJ-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.
4hqf THROMBOSPONDIN-RELAT
ED ANONYMOUS
PROTEIN, TRAP

(Plasmodium
falciparum) 		PF00092
(VWA) 		4 ARG A 176
LYS A 173
LEU A 172
LEU A 202
 None
 1.05A 2eimC-4hqfA:
undetectable
2eimJ-4hqfA:
undetectable		 2eimC-4hqfA:
20.74
2eimJ-4hqfA:
10.11
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.
4j0m SERINE/THREONINE-PRO
TEIN KINASE
BRI1-LIKE 1

(Arabidopsis
thaliana) 		PF08263
(LRRNT_2)
PF13516
(LRR_6)
PF13855
(LRR_8) 		4 LEU A 228
PHE A 230
LEU A 203
PHE A 199
 None
 1.02A 2eimC-4j0mA:
undetectable
2eimJ-4j0mA:
undetectable		 2eimC-4j0mA:
16.01
2eimJ-4j0mA:
5.59
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.
4lnq INTERFERON-ACTIVABLE
PROTEIN 202

(Mus musculus) 		PF02760
(HIN) 		4 LEU A 218
PHE A 239
LEU A 216
PHE A 188
 None
 1.03A 2eimC-4lnqA:
undetectable
2eimJ-4lnqA:
undetectable		 2eimC-4lnqA:
19.62
2eimJ-4lnqA:
14.29
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.
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
 0.85A 2eimC-4ma5A:
undetectable
2eimJ-4ma5A:
undetectable		 2eimC-4ma5A:
22.16
2eimJ-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.
4ma5 PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE, ATPASE
SUBUNIT

(Francisella
tularensis) 		PF02222
(ATP-grasp) 		4 LYS A 138
LEU A 137
GLN A 149
LEU A 124
 ANP  A 401 ( 2.8A)
None
ANP  A 401 ( 4.5A)
None
 0.95A 2eimC-4ma5A:
undetectable
2eimJ-4ma5A:
undetectable		 2eimC-4ma5A:
22.16
2eimJ-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.
4n6q VOSA

(Aspergillus
nidulans) 		PF11754
(Velvet) 		4 LYS A 132
LEU A 131
PHE A 129
LEU A 121
 None
 0.79A 2eimC-4n6qA:
undetectable
2eimJ-4n6qA:
undetectable		 2eimC-4n6qA:
22.18
2eimJ-4n6qA:
16.48
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.
4oya ADENYLATE CYCLASE
TYPE 10

(Homo sapiens) 		PF00211
(Guanylate_cyc) 		4 GLN A 375
PHE A 372
LEU A 299
PHE A 301
 None
 0.97A 2eimC-4oyaA:
undetectable
2eimJ-4oyaA:
undetectable		 2eimC-4oyaA:
19.62
2eimJ-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.
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2

(Mus musculus) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		4 LYS A 115
LEU A 118
GLN A 370
PHE A 362
 None
 1.03A 2eimC-4ph9A:
undetectable
2eimJ-4ph9A:
undetectable		 2eimC-4ph9A:
20.75
2eimJ-4ph9A:
8.65
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.
4qtu PUTATIVE
METHYLTRANSFERASE
BUD23

(Saccharomyces
cerevisiae) 		PF08241
(Methyltransf_11) 		4 LYS B 149
PHE B 106
LEU B 144
PHE B 154
 None
 1.07A 2eimC-4qtuB:
undetectable
2eimJ-4qtuB:
undetectable		 2eimC-4qtuB:
21.80
2eimJ-4qtuB:
15.98
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.
4tuf MAJOR EXTRACELLULAR
ENDOGLUCANASE

(Xanthomonas
campestris) 		PF00150
(Cellulase) 		4 LYS A  45
LEU A  44
GLN A  43
LEU A 175
 None
 1.00A 2eimC-4tufA:
undetectable
2eimJ-4tufA:
undetectable		 2eimC-4tufA:
21.01
2eimJ-4tufA:
10.65
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.
4ud4 POLY(A) RNA
POLYMERASE PROTEIN
CID1

(Schizosaccharomyces
pombe) 		PF01909
(NTP_transf_2)
PF03828
(PAP_assoc) 		5 LYS A 144
LEU A 145
GLN A 158
LEU A 125
PHE A 121
 None
 0.90A 2eimC-4ud4A:
undetectable
2eimJ-4ud4A:
undetectable		 2eimC-4ud4A:
19.95
2eimJ-4ud4A:
10.26
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.
4us5 LUCIFERASE-LIKE
MONOOXYGENASE

(Streptomyces
bottropensis) 		PF00296
(Bac_luciferase) 		4 LEU A 140
GLN A 139
LEU A 103
PHE A  90
 None
 0.92A 2eimC-4us5A:
undetectable
2eimJ-4us5A:
undetectable		 2eimC-4us5A:
20.29
2eimJ-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.
4wn9 NITROGENASE
MOLYBDENUM-IRON
PROTEIN ALPHA CHAIN

(Clostridium
pasteurianum) 		PF00148
(Oxidored_nitro) 		4 LEU A 334
GLN A 335
LEU A 503
PHE A 499
 None
None
XE  A 604 ( 4.2A)
XE  A 604 (-3.8A)
 0.79A 2eimC-4wn9A:
undetectable
2eimJ-4wn9A:
undetectable		 2eimC-4wn9A:
17.15
2eimJ-4wn9A:
8.88
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.
4wn9 NITROGENASE
MOLYBDENUM-IRON
PROTEIN ALPHA CHAIN

(Clostridium
pasteurianum) 		PF00148
(Oxidored_nitro) 		4 LYS A 331
LEU A 334
LEU A 503
PHE A 499
 None
None
XE  A 604 ( 4.2A)
XE  A 604 (-3.8A)
 0.66A 2eimC-4wn9A:
undetectable
2eimJ-4wn9A:
undetectable		 2eimC-4wn9A:
17.15
2eimJ-4wn9A:
8.88
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.
4x00 PUTATIVE HYDROLASE

(Burkholderia
cenocepacia) 		PF12697
(Abhydrolase_6) 		4 LEU A  59
GLN A  60
LEU A 273
PHE A 269
 None
 0.81A 2eimC-4x00A:
undetectable
2eimJ-4x00A:
undetectable		 2eimC-4x00A:
21.50
2eimJ-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.
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
 0.92A 2eimC-4xgtA:
undetectable
2eimJ-4xgtA:
undetectable		 2eimC-4xgtA:
12.69
2eimJ-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.
4xt1 G-PROTEIN COUPLED
RECEPTOR HOMOLOG
US28

(Cytomegalovirus) 		PF00001
(7tm_1) 		4 LEU A 306
PHE A 309
LEU A 302
PHE A 293
 None
None
None
OLC  A 405 (-3.9A)
 1.07A 2eimC-4xt1A:
0.0
2eimJ-4xt1A:
undetectable		 2eimC-4xt1A:
21.81
2eimJ-4xt1A:
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.
4y99 TROPONIN T, CARDIAC
MUSCLE

(Homo sapiens) 		PF00992
(Troponin) 		4 LYS B 247
LEU B 250
GLN B 251
PHE B 254
 None
 0.68A 2eimC-4y99B:
undetectable
2eimJ-4y99B:
2.4		 2eimC-4y99B:
15.56
2eimJ-4y99B:
16.98
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.
5boi GERMINATION PROTEIN
YPEB

(Bacillus
megaterium) 		PF03413
(PepSY)
PF14620
(YPEB) 		4 LYS A 438
LEU A 439
GLN A 440
LEU A 414
 None
 0.92A 2eimC-5boiA:
undetectable
2eimJ-5boiA:
undetectable		 2eimC-5boiA:
20.21
2eimJ-5boiA:
14.22
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.
5bza BETA-N-ACETYLHEXOSAM
INIDASE

(Thermotoga
neapolitana) 		PF00933
(Glyco_hydro_3) 		4 LEU A 463
GLN A 460
PHE A 459
LEU A 343
 None
 0.93A 2eimC-5bzaA:
undetectable
2eimJ-5bzaA:
undetectable		 2eimC-5bzaA:
17.12
2eimJ-5bzaA:
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.
5c9h TELOMERASE REVERSE
TRANSCRIPTASE

(Tetrahymena
thermophila) 		PF12009
(Telomerase_RBD) 		4 GLN A 382
PHE A 379
LEU A 405
PHE A 401
 None
 0.89A 2eimC-5c9hA:
undetectable
2eimJ-5c9hA:
undetectable		 2eimC-5c9hA:
18.61
2eimJ-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
 0.91A 2eimC-5d9aB:
undetectable
2eimJ-5d9aB:
undetectable		 2eimC-5d9aB:
16.47
2eimJ-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.
5du9 CDA PEPTIDE
SYNTHETASE I

(Streptomyces
coelicolor) 		PF00668
(Condensation) 		4 LEU A 423
GLN A 424
PHE A 427
LEU A 229
 None
 0.77A 2eimC-5du9A:
undetectable
2eimJ-5du9A:
undetectable		 2eimC-5du9A:
20.97
2eimJ-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
 1.09A 2eimC-5e0cA:
undetectable
2eimJ-5e0cA:
undetectable		 2eimC-5e0cA:
20.19
2eimJ-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.
5fn3 PRESENILIN-1

(Homo sapiens) 		PF01080
(Presenilin) 		4 LEU B 392
PHE B 388
LEU B 443
PHE B 447
 None
 1.04A 2eimC-5fn3B:
2.1
2eimJ-5fn3B:
undetectable		 2eimC-5fn3B:
20.04
2eimJ-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.
5ggy IRON(III) ABC
TRANSPORTER,
PERIPLASMIC
IRON-COMPOUND-BINDIN
G PROTEIN

(Vibrio cholerae) 		PF01497
(Peripla_BP_2) 		4 LYS A 185
LEU A 188
GLN A 189
LEU A 312
 None
 0.84A 2eimC-5ggyA:
undetectable
2eimJ-5ggyA:
undetectable		 2eimC-5ggyA:
20.56
2eimJ-5ggyA:
13.42
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.
5gs0 TOLL-LIKE RECEPTOR 3

(Homo sapiens) 		PF13516
(LRR_6)
PF13855
(LRR_8) 		4 LYS A 147
LEU A 149
LEU A 128
PHE A 119
 None
 1.08A 2eimC-5gs0A:
undetectable
2eimJ-5gs0A:
undetectable		 2eimC-5gs0A:
15.66
2eimJ-5gs0A:
8.92
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.
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
 0.98A 2eimC-5gsmA:
undetectable
2eimJ-5gsmA:
undetectable		 2eimC-5gsmA:
16.50
2eimJ-5gsmA:
6.61
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
 0.51A 2eimC-5iy5C:
36.9
2eimJ-5iy5C:
undetectable		 2eimC-5iy5C:
100.00
2eimJ-5iy5C:
10.36
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
LYS C 157
LEU C 160
PHE C 164
LEU C 223
 CHD  C 307 (-4.0A)
None
CHD  C 307 ( 3.9A)
CHD  C 307 (-3.9A)
None
 0.37A 2eimC-5iy5C:
36.9
2eimJ-5iy5C:
undetectable		 2eimC-5iy5C:
100.00
2eimJ-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.
5j32 3-ISOPROPYLMALATE
DEHYDROGENASE 2,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00180
(Iso_dh) 		4 LYS A  62
LEU A  65
GLN A  66
LEU A 345
 None
 0.92A 2eimC-5j32A:
undetectable
2eimJ-5j32A:
undetectable		 2eimC-5j32A:
21.50
2eimJ-5j32A:
10.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jlt MIDDLE TRANSCRIPTION
REGULATORY PROTEIN
MOTA

(Escherichia
virus T4) 		PF09158
(MotCF) 		4 LYS A 130
LEU A 128
LEU A 121
PHE A 152
 None
 0.98A 2eimC-5jltA:
undetectable
2eimJ-5jltA:
undetectable		 2eimC-5jltA:
16.67
2eimJ-5jltA:
18.18
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.
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
 0.97A 2eimC-5k8oA:
undetectable
2eimJ-5k8oA:
undetectable		 2eimC-5k8oA:
17.58
2eimJ-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.
5ksw DIHYDROOROTATE
DEHYDROGENASE

(Lactococcus
lactis) 		PF01180
(DHO_dh) 		4 LYS A 170
LEU A 131
LEU A 155
PHE A 145
 FMN  A 401 (-2.9A)
None
None
None
 0.97A 2eimC-5kswA:
undetectable
2eimJ-5kswA:
undetectable		 2eimC-5kswA:
19.93
2eimJ-5kswA:
14.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 0.93A 2eimC-5la7A:
undetectable
2eimJ-5la7A:
undetectable		 2eimC-5la7A:
19.44
2eimJ-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.
5lut BLM HELICASE

(Gallus gallus) 		PF08072
(BDHCT) 		4 LYS A 343
LEU A 346
GLN A 347
LEU A 333
 None
 0.70A 2eimC-5lutA:
undetectable
2eimJ-5lutA:
undetectable		 2eimC-5lutA:
12.60
2eimJ-5lutA:
24.59
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.
5mjs TUBULIN BETA CHAIN

(Schizosaccharomyces
pombe) 		no annotation 4 LEU A 135
GLN A 134
PHE A 133
LEU A 151
 None
 0.93A 2eimC-5mjsA:
undetectable
2eimJ-5mjsA:
undetectable		 2eimC-5mjsA:
undetectable
2eimJ-5mjsA:
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.
5mpd 26S PROTEASOME
REGULATORY SUBUNIT
RPN9

(Saccharomyces
cerevisiae) 		PF01399
(PCI) 		4 LEU O 254
GLN O 253
PHE O 252
LEU O 222
 None
 1.07A 2eimC-5mpdO:
2.4
2eimJ-5mpdO:
undetectable		 2eimC-5mpdO:
20.20
2eimJ-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
 1.09A 2eimC-5n0cA:
2.7
2eimJ-5n0cA:
undetectable		 2eimC-5n0cA:
10.63
2eimJ-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.
5uem 354NC37 FAB HEAVY
CHAIN
354NC37 FAB LIGHT
CHAIN

(Homo sapiens;
Homo sapiens) 		no annotation
no annotation 		4 LYS L  39
GLN L  37
PHE L  36
LEU H  39
 None
 1.04A 2eimC-5uemL:
undetectable
2eimJ-5uemL:
undetectable		 2eimC-5uemL:
undetectable
2eimJ-5uemL:
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.
5uvn PARAQUAT-INDUCIBLE
PROTEIN B

(Escherichia
coli) 		PF02470
(MlaD) 		4 LEU A 202
GLN A 201
PHE A 203
PHE A 250
 None
 0.95A 2eimC-5uvnA:
undetectable
2eimJ-5uvnA:
undetectable		 2eimC-5uvnA:
20.54
2eimJ-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
 1.03A 2eimC-5v91A:
undetectable
2eimJ-5v91A:
undetectable		 2eimC-5v91A:
20.65
2eimJ-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.
5vl3 B-CELL RECEPTOR CD22

(Homo sapiens) 		no annotation 4 LEU Q 163
GLN Q 164
PHE Q 199
LEU Q 174
 None
 1.09A 2eimC-5vl3Q:
undetectable
2eimJ-5vl3Q:
undetectable		 2eimC-5vl3Q:
21.85
2eimJ-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.
5xhx HELIX-TURN-HELIX
TRANSCRIPTIONAL
REGULATOR

(Pseudomonas
aeruginosa) 		no annotation 4 LEU A 141
GLN A 128
LEU A  30
PHE A  26
 None
 0.94A 2eimC-5xhxA:
undetectable
2eimJ-5xhxA:
undetectable		 2eimC-5xhxA:
21.93
2eimJ-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
 0.85A 2eimC-5xogA:
3.9
2eimJ-5xogA:
undetectable		 2eimC-5xogA:
9.55
2eimJ-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.
5y4u -

(-) 		no annotation 4 LEU A 220
GLN A 219
LEU A 186
PHE A 193
 None
 1.01A 2eimC-5y4uA:
undetectable
2eimJ-5y4uA:
undetectable		 2eimC-5y4uA:
undetectable
2eimJ-5y4uA:
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
 0.92A 2eimC-6c29A:
undetectable
2eimJ-6c29A:
undetectable		 2eimC-6c29A:
undetectable
2eimJ-6c29A:
undetectable