SIMILAR PATTERNS OF AMINO ACIDS FOR 2X45_C_HSMC1162

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.
1arl APO-CARBOXYPEPTIDASE
A=ALPHA= (COX)

(Bos taurus) 		PF00246
(Peptidase_M14) 		3 GLU A 270
HIS A  69
GLU A  72
 None
 0.88A 2x45C-1arlA:
0.0		 2x45C-1arlA:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dtd CARBOXYPEPTIDASE A2

(Homo sapiens) 		PF00246
(Peptidase_M14) 		3 GLU A 626
HIS A 424
GLU A 427
 GLU  A 300 (-4.2A)
ZN  A 301 ( 3.4A)
ZN  A 301 (-2.6A)
 0.84A 2x45C-1dtdA:
0.0		 2x45C-1dtdA:
18.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hc7 PROLYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon)
PF09180
(ProRS-C_1) 		3 GLU A  26
HIS A 330
GLU A 338
 None
 0.80A 2x45C-1hc7A:
0.0		 2x45C-1hc7A:
14.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jqg CARBOXYPEPTIDASE A

(Helicoverpa
armigera) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		3 GLU A 270
HIS A  69
GLU A  72
 ZN  A 413 ( 4.9A)
ZN  A 413 (-3.2A)
ZN  A 413 (-2.4A)
 0.79A 2x45C-1jqgA:
0.0		 2x45C-1jqgA:
14.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kwm PROCARBOXYPEPTIDASE
B

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		3 GLU A 270
HIS A  69
GLU A  72
 None
ZN  A 400 (-3.9A)
ZN  A 400 (-2.1A)
 0.87A 2x45C-1kwmA:
0.0		 2x45C-1kwmA:
14.86
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.
1lpf DIHYDROLIPOAMIDE
DEHYDROGENASE

(Pseudomonas
fluorescens) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		3 GLU A 455
HIS A 470
GLU A 459
 None
 0.87A 2x45C-1lpfA:
0.4		 2x45C-1lpfA:
15.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1miq PLASMEPSIN

(Plasmodium
vivax) 		PF00026
(Asp) 		3 GLU A 175
HIS A  78
GLU A 174
 None
 0.60A 2x45C-1miqA:
0.0		 2x45C-1miqA:
17.13
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.
1nf2 PHOSPHATASE

(Thermotoga
maritima) 		PF08282
(Hydrolase_3) 		3 GLU A 117
HIS A 101
GLU A 118
 None
 0.82A 2x45C-1nf2A:
0.0		 2x45C-1nf2A:
16.04
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.
1nsa PROCARBOXYPEPTIDASE
B

(Sus scrofa) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		3 GLU A 270
HIS A  69
GLU A  72
 ZN  A 501 ( 4.9A)
ZN  A 501 (-3.3A)
ZN  A 501 (-2.0A)
 0.77A 2x45C-1nsaA:
0.0		 2x45C-1nsaA:
16.46
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.
1o1z GLYCEROPHOSPHODIESTE
R PHOSPHODIESTERASE

(Thermotoga
maritima) 		PF03009
(GDPD) 		3 GLU A  97
HIS A   6
GLU A  33
 None
 0.71A 2x45C-1o1zA:
undetectable		 2x45C-1o1zA:
18.67
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.
1pca PROCARBOXYPEPTIDASE
A PCPA

(Sus scrofa) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		3 GLU A 270
HIS A  69
GLU A  72
 VAL  A 700 (-3.2A)
ZN  A 400 (-3.2A)
ZN  A 400 (-1.9A)
 0.82A 2x45C-1pcaA:
undetectable		 2x45C-1pcaA:
16.58
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.
1q1l CHORISMATE SYNTHASE

(Aquifex
aeolicus) 		PF01264
(Chorismate_synt) 		3 GLU A  40
HIS A 191
GLU A 361
 None
 0.88A 2x45C-1q1lA:
undetectable		 2x45C-1q1lA:
14.96
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.
1t8q GLYCEROPHOSPHORYL
DIESTER
PHOSPHODIESTERASE,
PERIPLASMIC

(Escherichia
coli) 		PF03009
(GDPD) 		3 GLU A 171
HIS A  36
GLU A  63
 MG  A1601 ( 2.9A)
GOL  A1605 (-3.7A)
MG  A1601 ( 2.7A)
 0.64A 2x45C-1t8qA:
undetectable		 2x45C-1t8qA:
16.76
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.
1vd6 GLYCEROPHOSPHORYL
DIESTER
PHOSPHODIESTERASE

(Thermus
thermophilus) 		PF03009
(GDPD) 		3 GLU A 100
HIS A  13
GLU A  40
 GOL  A 300 (-3.0A)
GOL  A 300 (-3.9A)
GOL  A 300 (-3.4A)
 0.74A 2x45C-1vd6A:
undetectable		 2x45C-1vd6A:
16.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1x2g LIPOATE-PROTEIN
LIGASE A

(Escherichia
coli) 		PF03099
(BPL_LplA_LipB)
PF10437
(Lip_prot_lig_C) 		3 GLU A  21
HIS A 149
GLU A  20
 None
 0.79A 2x45C-1x2gA:
undetectable		 2x45C-1x2gA:
17.72
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.
1zcc GLYCEROPHOSPHODIESTE
R PHOSPHODIESTERASE

(Agrobacterium
fabrum) 		PF03009
(GDPD) 		3 GLU A 108
HIS A   7
GLU A  34
 SO4  A4770 ( 3.7A)
SO4  A4770 (-4.2A)
None
 0.65A 2x45C-1zccA:
undetectable		 2x45C-1zccA:
18.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zli CARBOXYPEPTIDASE B

(Homo sapiens) 		PF00246
(Peptidase_M14) 		3 GLU A 270
HIS A  69
GLU A  72
 ZN  A 501 ( 4.8A)
ZN  A 501 (-3.1A)
ZN  A 501 (-2.1A)
 0.80A 2x45C-1zliA:
undetectable		 2x45C-1zliA:
18.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bco SUCCINYLGLUTAMATE
DESUCCINYLASE

(Vibrio
parahaemolyticus) 		PF04952
(AstE_AspA) 		3 GLU A 219
HIS A  63
GLU A  66
 ZN  A 501 ( 4.7A)
ZN  A 501 (-3.3A)
ZN  A 501 (-2.1A)
 0.78A 2x45C-2bcoA:
undetectable		 2x45C-2bcoA:
15.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c1c CARBOXYPEPTIDASE B

(Helicoverpa zea) 		PF00246
(Peptidase_M14) 		3 GLU A 270
HIS A  69
GLU A  72
 ZN  A 625 ( 4.6A)
ZN  A 625 (-3.0A)
ZN  A 625 (-2.2A)
 0.88A 2x45C-2c1cA:
undetectable		 2x45C-2c1cA:
17.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gqd 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Staphylococcus
aureus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		3 GLU A 114
HIS A 198
GLU A 117
 None
 0.79A 2x45C-2gqdA:
undetectable		 2x45C-2gqdA:
15.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2k2o MYOFERLIN

(Homo sapiens) 		no annotation 3 GLU A 976
HIS A 927
GLU A 929
 None
 0.81A 2x45C-2k2oA:
undetectable		 2x45C-2k2oA:
26.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2lfd DIIRON PROTEIN

(Escherichia
coli) 		no annotation 3 GLU A  11
HIS A  77
GLU A  44
 ZN  A 400 (-1.9A)
ZN  A 300 (-3.3A)
ZN  A 300 (-1.5A)
 0.87A 2x45C-2lfdA:
undetectable		 2x45C-2lfdA:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o55 PUTATIVE
GLYCEROPHOSPHODIESTE
R PHOSPHODIESTERASE

(Galdieria
sulphuraria) 		PF03009
(GDPD) 		3 GLU A 116
HIS A  14
GLU A  43
 SO4  A   2 (-4.1A)
SO4  A   1 (-3.9A)
None
 0.83A 2x45C-2o55A:
undetectable		 2x45C-2o55A:
18.39
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.
2otd GLYCEROPHOSPHODIESTE
R PHOSPHODIESTERASE

(Shigella
flexneri) 		PF03009
(GDPD) 		3 GLU A 114
HIS A  12
GLU A  39
 PO4  A 301 (-3.4A)
PO4  A 301 (-4.0A)
PO4  A 301 (-3.9A)
 0.69A 2x45C-2otdA:
undetectable		 2x45C-2otdA:
19.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p76 GLYCEROPHOSPHORYL
DIESTER
PHOSPHODIESTERASE

(Staphylococcus
aureus) 		PF03009
(GDPD) 		3 GLU A 169
HIS A  59
GLU A  87
 NA  A 401 ( 3.0A)
GOL  A 501 (-3.8A)
NA  A 401 ( 3.1A)
 0.57A 2x45C-2p76A:
undetectable		 2x45C-2p76A:
19.38
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.
2pcu CARBOXYPEPTIDASE A4

(Homo sapiens) 		PF00246
(Peptidase_M14) 		3 GLU A 270
HIS A  69
GLU A  72
 ZN  A 999 (-4.6A)
ZN  A 999 ( 3.1A)
ZN  A 999 (-2.1A)
 0.81A 2x45C-2pcuA:
undetectable		 2x45C-2pcuA:
17.39
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.
2pz0 GLYCEROPHOSPHORYL
DIESTER
PHOSPHODIESTERASE

(Caldanaerobacter
subterraneus) 		PF03009
(GDPD) 		3 GLU A 119
HIS A  17
GLU A  44
 CA  A 501 ( 3.2A)
GOL  A 401 (-3.8A)
CA  A 501 ( 2.9A)
 0.83A 2x45C-2pz0A:
undetectable		 2x45C-2pz0A:
19.61
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.
2q1z ANTI-SIGMA FACTOR
CHRR,
TRANSCRIPTIONAL
ACTIVATOR CHRR

(Rhodobacter
sphaeroides) 		PF12973
(Cupin_7)
PF13490
(zf-HC2) 		3 GLU B 169
HIS B 141
GLU B 147
 None
ZN  B 197 (-3.5A)
ZN  B 197 (-2.2A)
 0.81A 2x45C-2q1zB:
undetectable		 2x45C-2q1zB:
17.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2uzx HEPATOCYTE GROWTH
FACTOR RECEPTOR

(Homo sapiens) 		PF01403
(Sema)
PF01437
(PSI)
PF01833
(TIG) 		3 GLU B 493
HIS B  60
GLU B  75
 None
 0.78A 2x45C-2uzxB:
undetectable		 2x45C-2uzxB:
10.49
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.
2vj5 PROTEIN MXIC

(Shigella
flexneri) 		PF07201
(HrpJ) 		3 GLU A 335
HIS A 325
GLU A 331
 None
 0.61A 2x45C-2vj5A:
undetectable		 2x45C-2vj5A:
16.22
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.
2voy SARCOPLASMIC/ENDOPLA
SMIC RETICULUM
CALCIUM ATPASE 1

(Oryctolagus
cuniculus) 		PF00690
(Cation_ATPase_N)
no annotation 		3 GLU E 113
HIS B  38
GLU B  40
 None
 0.86A 2x45C-2voyE:
undetectable		 2x45C-2voyE:
12.90
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.
2vx4 CELLVIBRIO JAPONICUS
MANNANASE CJMAN26C

(Cellvibrio
japonicus) 		PF02156
(Glyco_hydro_26) 		3 GLU A  85
HIS A 220
GLU A 338
 None
 0.88A 2x45C-2vx4A:
undetectable		 2x45C-2vx4A:
17.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2x46 ALLERGEN ARG R 1

(Argas reflexus) 		PF02098
(His_binding) 		3 GLU A  47
HIS A 114
GLU A 119
 None
 0.54A 2x45C-2x46A:
29.4		 2x45C-2x46A:
99.31
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.
2y1h PUTATIVE
DEOXYRIBONUCLEASE
TATDN3

(Homo sapiens) 		PF01026
(TatD_DNase) 		3 GLU A  44
HIS A 147
GLU A 107
 PO4  A1275 (-3.2A)
ZN  A1273 ( 3.1A)
ZN  A1274 (-2.4A)
 0.79A 2x45C-2y1hA:
undetectable		 2x45C-2y1hA:
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.
3a9l POLY-GAMMA-GLUTAMATE
HYDROLASE

(Bacillus virus
NIT1) 		PF05908
(Gamma_PGA_hydro) 		3 GLU A 165
HIS A  78
GLU A  45
 PO4  A 261 (-3.2A)
PO4  A 261 (-3.9A)
ZN  A 251 ( 2.1A)
 0.81A 2x45C-3a9lA:
undetectable		 2x45C-3a9lA:
21.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3al2 DNA TOPOISOMERASE
2-BINDING PROTEIN 1

(Homo sapiens) 		PF00533
(BRCT) 		3 GLU A1296
HIS A1285
GLU A1288
 None
 0.83A 2x45C-3al2A:
undetectable		 2x45C-3al2A:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ch0 GLYCEROPHOSPHODIESTE
R PHOSPHODIESTERASE

(Cytophaga
hutchinsonii) 		PF03009
(GDPD) 		3 GLU A 135
HIS A  13
GLU A  40
 CIT  A 272 (-2.9A)
CIT  A 272 (-3.9A)
CIT  A 272 (-3.6A)
 0.65A 2x45C-3ch0A:
undetectable		 2x45C-3ch0A:
23.77
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.
3chi P-AMINOBENZOATE
N-OXYGENASE

(Streptomyces
thioluteus) 		PF11583
(AurF) 		3 GLU A 101
HIS A 230
GLU A 196
 FEO  A 501 (-2.1A)
FEO  A 501 (-3.2A)
FEO  A 501 (-2.1A)
 0.70A 2x45C-3chiA:
undetectable		 2x45C-3chiA:
15.00
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.
3chi P-AMINOBENZOATE
N-OXYGENASE

(Streptomyces
thioluteus) 		PF11583
(AurF) 		3 GLU A 196
HIS A 139
GLU A 101
 FEO  A 501 (-2.1A)
FEO  A 501 (-3.3A)
FEO  A 501 (-2.1A)
 0.64A 2x45C-3chiA:
undetectable		 2x45C-3chiA:
15.00
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.
3d4u CARBOXYPEPTIDASE B2

(Bos taurus) 		PF00246
(Peptidase_M14) 		3 GLU A 270
HIS A  69
GLU A  72
 ZN  A 309 ( 4.8A)
ZN  A 309 ( 3.1A)
ZN  A 309 (-2.1A)
 0.82A 2x45C-3d4uA:
undetectable		 2x45C-3d4uA:
17.77
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.
3f6a HYDROLASE, NUDIX
FAMILY

(Clostridium
perfringens) 		PF00293
(NUDIX) 		3 GLU A  51
HIS A  34
GLU A  48
 None
 0.80A 2x45C-3f6aA:
undetectable		 2x45C-3f6aA:
19.25
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.
3fh2 PROBABLE
ATP-DEPENDENT
PROTEASE (HEAT SHOCK
PROTEIN)

(Corynebacterium
glutamicum) 		PF02861
(Clp_N) 		3 GLU A  18
HIS A  39
GLU A  19
 None
 0.87A 2x45C-3fh2A:
undetectable		 2x45C-3fh2A:
18.79
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.
3fju CARBOXYPEPTIDASE A1

(Homo sapiens) 		PF00246
(Peptidase_M14) 		3 GLU A 270
HIS A  69
GLU A  72
 ACT  A 515 (-4.3A)
ZN  A 999 ( 3.1A)
ZN  A 999 (-2.1A)
 0.77A 2x45C-3fjuA:
undetectable		 2x45C-3fjuA:
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.
3ian CHITINASE

(Lactococcus
lactis) 		PF00704
(Glyco_hydro_18) 		3 GLU A 314
HIS A 354
GLU A 352
 None
 0.82A 2x45C-3ianA:
undetectable		 2x45C-3ianA:
19.81
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.
3ieh PUTATIVE
METALLOPEPTIDASE

(Shewanella
baltica) 		PF04952
(AstE_AspA) 		3 GLU A 245
HIS A  75
GLU A  78
 ZN  A 276 ( 4.4A)
ZN  A 276 ( 3.2A)
ZN  A 276 (-2.0A)
 0.88A 2x45C-3iehA:
undetectable		 2x45C-3iehA:
17.73
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.
3ilv GLUTAMINE-DEPENDENT
NAD(+) SYNTHETASE

(Cytophaga
hutchinsonii) 		PF00795
(CN_hydrolase)
PF02540
(NAD_synthase) 		3 GLU A  44
HIS A 120
GLU A 122
 None
 0.78A 2x45C-3ilvA:
undetectable		 2x45C-3ilvA:
11.85
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.
3jb9 SMALL NUCLEAR
RIBONUCLEOPROTEIN SM
D3
SMALL NUCLEAR
RIBONUCLEOPROTEIN-AS
SOCIATED PROTEIN B

(Schizosaccharomyces
pombe) 		PF01423
(LSM) 		3 GLU E  73
HIS D  65
GLU D  21
 U  C  99 ( 4.7A)
None
None
 0.88A 2x45C-3jb9E:
undetectable		 2x45C-3jb9E:
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.
3k2k PUTATIVE
CARBOXYPEPTIDASE

(Burkholderia
mallei) 		PF00246
(Peptidase_M14) 		3 GLU A 271
HIS A 171
GLU A 174
 None
CL  A 387 (-4.6A)
None
 0.81A 2x45C-3k2kA:
undetectable		 2x45C-3k2kA:
15.28
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.
3k2k PUTATIVE
CARBOXYPEPTIDASE

(Burkholderia
mallei) 		PF00246
(Peptidase_M14) 		3 GLU A 271
HIS A 268
GLU A 344
 None
 0.81A 2x45C-3k2kA:
undetectable		 2x45C-3k2kA:
15.28
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.
3k2k PUTATIVE
CARBOXYPEPTIDASE

(Burkholderia
mallei) 		PF00246
(Peptidase_M14) 		3 GLU A 344
HIS A 171
GLU A 174
 None
CL  A 387 (-4.6A)
None
 0.70A 2x45C-3k2kA:
undetectable		 2x45C-3k2kA:
15.28
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.
3ks5 GLYCEROPHOSPHORYL
DIESTER
PHOSPHODIESTERASE

(Agrobacterium
fabrum) 		PF03009
(GDPD) 		3 GLU A 104
HIS A   7
GLU A  34
 FE  A 250 (-3.3A)
ACT  A 252 ( 3.6A)
FE  A 250 ( 2.6A)
 0.77A 2x45C-3ks5A:
undetectable		 2x45C-3ks5A:
17.31
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.
3l12 PUTATIVE
GLYCEROPHOSPHORYL
DIESTER
PHOSPHODIESTERASE

(Ruegeria
pomeroyi) 		PF03009
(GDPD) 		3 GLU A 148
HIS A  22
GLU A  49
 MG  A 313 (-2.9A)
UNL  A 317 ( 3.8A)
MG  A 313 (-2.6A)
 0.85A 2x45C-3l12A:
undetectable		 2x45C-3l12A:
17.09
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.
3l2n PEPTIDASE M14,
CARBOXYPEPTIDASE A

(Shewanella
denitrificans) 		PF00246
(Peptidase_M14) 		3 GLU A 262
HIS A 166
GLU A 169
 None
CA  A 377 (-3.2A)
CA  A 377 (-2.1A)
 0.72A 2x45C-3l2nA:
undetectable		 2x45C-3l2nA:
16.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l2n PEPTIDASE M14,
CARBOXYPEPTIDASE A

(Shewanella
denitrificans) 		PF00246
(Peptidase_M14) 		3 GLU A 335
HIS A 166
GLU A 169
 UNL  A 378 ( 3.3A)
CA  A 377 (-3.2A)
CA  A 377 (-2.1A)
 0.83A 2x45C-3l2nA:
undetectable		 2x45C-3l2nA:
16.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lad DIHYDROLIPOAMIDE
DEHYDROGENASE

(Azotobacter
vinelandii) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		3 GLU A 455
HIS A 470
GLU A 459
 None
 0.83A 2x45C-3ladA:
undetectable		 2x45C-3ladA:
14.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lms CARBOXYPEPTIDASE B2

(Homo sapiens) 		PF00246
(Peptidase_M14) 		3 GLU A 270
HIS A  69
GLU A  72
 GLY  A 501 ( 4.6A)
ZN  A 309 ( 3.1A)
ZN  A 309 (-2.0A)
 0.74A 2x45C-3lmsA:
undetectable		 2x45C-3lmsA:
17.19
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.
3na6 SUCCINYLGLUTAMATE
DESUCCINYLASE/ASPART
OACYLASE

(Ruegeria sp.
TM1040) 		PF04952
(AstE_AspA) 		3 GLU A 209
HIS A  58
GLU A  61
 None
CL  A 331 (-4.5A)
None
 0.87A 2x45C-3na6A:
undetectable		 2x45C-3na6A:
16.35
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.
3no3 GLYCEROPHOSPHODIESTE
R PHOSPHODIESTERASE

(Parabacteroides
distasonis) 		PF03009
(GDPD) 		3 GLU A 123
HIS A  30
GLU A  59
 MG  A 301 ( 2.8A)
GOL  A 303 (-3.8A)
MG  A 301 ( 2.6A)
 0.78A 2x45C-3no3A:
undetectable		 2x45C-3no3A:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3osl CARBOXYPEPTIDASE B2

(Bos taurus) 		PF00246
(Peptidase_M14) 		3 GLU A 385
HIS A 181
GLU A 184
 ZN  A 999 ( 4.8A)
ZN  A 999 (-3.1A)
ZN  A 999 (-2.1A)
 0.82A 2x45C-3oslA:
undetectable		 2x45C-3oslA:
14.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oyz MALATE SYNTHASE

(Haloferax
volcanii) 		PF03328
(HpcH_HpaI) 		3 GLU A 426
HIS A 413
GLU A 417
 None
 0.58A 2x45C-3oyzA:
undetectable		 2x45C-3oyzA:
14.98
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.
3q31 CARBONIC ANHYDRASE

(Aspergillus
oryzae) 		PF00194
(Carb_anhydrase) 		3 GLU A 222
HIS A  63
GLU A 221
 None
 0.85A 2x45C-3q31A:
undetectable		 2x45C-3q31A:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qvq PHOSPHODIESTERASE
OLEI02445

(Oleispira
antarctica) 		PF03009
(GDPD) 		3 GLU A 116
HIS A  14
GLU A  41
 G3P  A 301 ( 2.3A)
G3P  A 301 (-4.0A)
MG  A 310 ( 2.6A)
 0.77A 2x45C-3qvqA:
undetectable		 2x45C-3qvqA:
16.34
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.
3u0b OXIDOREDUCTASE,
SHORT CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY PROTEIN

(Mycolicibacterium
smegmatis) 		PF13561
(adh_short_C2) 		3 GLU A  93
HIS A 129
GLU A  91
 None
 0.77A 2x45C-3u0bA:
undetectable		 2x45C-3u0bA:
17.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vva ALTERNATIVE OXIDASE,
MITOCHONDRIAL

(Trypanosoma
brucei) 		PF01786
(AOX) 		3 GLU A 215
HIS A  77
GLU A 214
 None
 0.87A 2x45C-3vvaA:
undetectable		 2x45C-3vvaA:
16.82
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.
3wst PROTEIN ARGININE
N-METHYLTRANSFERASE
7

(Caenorhabditis
elegans) 		PF13649
(Methyltransf_25) 		3 GLU A 373
HIS A 482
GLU A 480
 None
 0.87A 2x45C-3wstA:
undetectable		 2x45C-3wstA:
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.
3ze6 PERIPLASMIC [NIFESE]
HYDROGENASE, SMALL
SUBUNIT

(Desulfovibrio
vulgaris) 		PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		3 GLU A  55
HIS A  96
GLU A  93
 None
 0.86A 2x45C-3ze6A:
undetectable		 2x45C-3ze6A:
19.34
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.
4a39 METALLO-CARBOXYPEPTI
DASE

(Pseudomonas
aeruginosa) 		PF00246
(Peptidase_M14) 		3 GLU A 263
HIS A 167
GLU A 170
 None
ZN  A1376 ( 3.1A)
ZN  A1376 ( 2.0A)
 0.77A 2x45C-4a39A:
undetectable		 2x45C-4a39A:
14.18
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.
4a39 METALLO-CARBOXYPEPTI
DASE

(Pseudomonas
aeruginosa) 		PF00246
(Peptidase_M14) 		3 GLU A 335
HIS A 167
GLU A 170
 GEM  A1377 (-2.7A)
ZN  A1376 ( 3.1A)
ZN  A1376 ( 2.0A)
 0.84A 2x45C-4a39A:
undetectable		 2x45C-4a39A:
14.18
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.
4b61 ALGINATE PRODUCTION
PROTEIN ALGE

(Pseudomonas
aeruginosa) 		PF13372
(Alginate_exp) 		3 GLU A 100
HIS A 364
GLU A 368
 None
 0.84A 2x45C-4b61A:
undetectable		 2x45C-4b61A:
15.33
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.
4b6z FAMILY M14
UNASSIGNED PEPTIDASE

(Burkholderia
cenocepacia) 		PF00246
(Peptidase_M14) 		3 GLU A 271
HIS A 171
GLU A 174
 None
ZN  A 385 ( 3.2A)
ZN  A 385 (-2.1A)
 0.71A 2x45C-4b6zA:
undetectable		 2x45C-4b6zA:
16.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b6z FAMILY M14
UNASSIGNED PEPTIDASE

(Burkholderia
cenocepacia) 		PF00246
(Peptidase_M14) 		3 GLU A 344
HIS A 171
GLU A 174
 ZN  A 385 ( 4.9A)
ZN  A 385 ( 3.2A)
ZN  A 385 (-2.1A)
 0.86A 2x45C-4b6zA:
undetectable		 2x45C-4b6zA:
16.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cyv HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		3 GLU B 164
HIS B 142
GLU B 165
 None
 0.62A 2x45C-4cyvB:
undetectable		 2x45C-4cyvB:
18.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ixa RESPONSE REGULATOR
SAER

(Staphylococcus
epidermidis) 		PF00486
(Trans_reg_C) 		3 GLU A 206
HIS A 199
GLU A 203
 None
 0.59A 2x45C-4ixaA:
undetectable		 2x45C-4ixaA:
19.59
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.
4k3j HEPATOCYTE GROWTH
FACTOR BETA CHAIN

(Homo sapiens) 		PF01403
(Sema)
PF01437
(PSI) 		3 GLU B 493
HIS B  60
GLU B  75
 None
 0.78A 2x45C-4k3jB:
undetectable		 2x45C-4k3jB:
12.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kxb GLUTAMYL
AMINOPEPTIDASE

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		3 GLU A 360
HIS A 393
GLU A 394
 BES  A1017 (-2.9A)
ZN  A1001 ( 3.3A)
BES  A1017 (-3.1A)
 0.88A 2x45C-4kxbA:
undetectable		 2x45C-4kxbA:
10.01
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.
4oec GLYCEROPHOSPHORYL
DIESTER
PHOSPHODIESTERASE

(Thermococcus
kodakarensis) 		PF03009
(GDPD) 		3 GLU A 106
HIS A  12
GLU A  39
 MG  A 401 (-2.8A)
None
MG  A 401 (-2.6A)
 0.77A 2x45C-4oecA:
undetectable		 2x45C-4oecA:
17.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oko RAPID ENCYSTMENT
PHENOTYPE PROTEIN 34
KDA

(Francisella
tularensis) 		PF00246
(Peptidase_M14) 		3 GLU A 272
HIS A  86
GLU A  89
 ACT  A 402 (-3.4A)
ZN  A 401 ( 3.0A)
ZN  A 401 (-1.9A)
 0.86A 2x45C-4okoA:
undetectable		 2x45C-4okoA:
16.93
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.
4qam X-LINKED RETINITIS
PIGMENTOSA GTPASE
REGULATOR-INTERACTIN
G PROTEIN 1

(Homo sapiens) 		no annotation 3 GLU B1245
HIS B1174
GLU B1121
 None
 0.85A 2x45C-4qamB:
undetectable		 2x45C-4qamB:
19.21
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.
4r7o GLYCEROPHOSPHORYL
DIESTER
PHOSPHODIESTERASE,
PUTATIVE

(Bacillus
anthracis) 		PF03009
(GDPD) 		3 GLU A 152
HIS A  43
GLU A  70
 MG  A 401 ( 3.1A)
GOL  A 405 (-3.8A)
MG  A 401 ( 3.2A)
 0.61A 2x45C-4r7oA:
undetectable		 2x45C-4r7oA:
18.79
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.
4r85 CYTOSINE DEAMINASE

(Klebsiella
pneumoniae) 		PF07969
(Amidohydro_3) 		3 GLU A 273
HIS A 209
GLU A 212
 17E  A 501 (-4.3A)
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
 0.81A 2x45C-4r85A:
undetectable		 2x45C-4r85A:
14.12
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.
4uf4 CARBOXYPEPTIDASE A1

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		3 GLU A 380
HIS A 179
GLU A 182
 O2V  A1419 (-1.8A)
ZN  A1420 ( 3.1A)
ZN  A1420 (-1.9A)
 0.86A 2x45C-4uf4A:
undetectable		 2x45C-4uf4A:
15.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wss HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		3 GLU A 492
HIS A 470
GLU A 493
 None
 0.70A 2x45C-4wssA:
undetectable		 2x45C-4wssA:
15.04
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.
4zdl O-PHOSPHOSERYL-TRNA(
SEC) SELENIUM
TRANSFERASE

(Homo sapiens) 		PF05889
(SepSecS) 		3 GLU A 194
HIS A 368
GLU A 197
 None
 0.87A 2x45C-4zdlA:
undetectable		 2x45C-4zdlA:
13.99
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.
5fsr D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE
DACD

(Escherichia
coli) 		PF00768
(Peptidase_S11)
PF07943
(PBP5_C) 		3 GLU A 248
HIS A  14
GLU A 249
 None
 0.81A 2x45C-5fsrA:
undetectable		 2x45C-5fsrA:
17.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hop LMO0182 PROTEIN

(Listeria
monocytogenes) 		no annotation 3 GLU A 229
HIS A  13
GLU A  16
 None
 0.65A 2x45C-5hopA:
undetectable		 2x45C-5hopA:
19.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hva DR2231

(Deinococcus
radiodurans) 		PF01503
(PRA-PH) 		3 GLU A  47
HIS A  78
GLU A  79
 MG  A 201 (-2.7A)
None
MG  A 201 (-2.6A)
 0.64A 2x45C-5hvaA:
undetectable		 2x45C-5hvaA:
18.42
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.
5j1q CARBOXYPEPTIDASE B

(Sus scrofa) 		PF00246
(Peptidase_M14) 		3 GLU A 270
HIS A  69
GLU A  72
 CXA  A 402 (-3.0A)
ZN  A 401 ( 3.2A)
ZN  A 401 ( 1.9A)
 0.81A 2x45C-5j1qA:
undetectable		 2x45C-5j1qA:
18.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j6s ENDOPLASMIC
RETICULUM
AMINOPEPTIDASE 2

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		3 GLU A 337
HIS A 370
GLU A 371
 6GA  A1015 (-4.0A)
ZN  A1001 ( 3.2A)
6GA  A1015 (-3.0A)
 0.79A 2x45C-5j6sA:
undetectable		 2x45C-5j6sA:
9.17
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.
5jyd SHORT CHAIN
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF13561
(adh_short_C2) 		3 GLU A 110
HIS A  56
GLU A  58
 IOD  A 908 ( 4.4A)
None
None
 0.79A 2x45C-5jydA:
undetectable		 2x45C-5jydA:
18.35
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.
5mc9 LAMININ SUBUNIT
BETA-1
LAMININ SUBUNIT
GAMMA-1

(Mus musculus) 		no annotation 3 GLU B1767
HIS C1585
GLU C1588
 None
 0.39A 2x45C-5mc9B:
undetectable		 2x45C-5mc9B:
16.18
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.
5mqs BETA-L-ARABINOBIOSID
ASE

(Bacteroides
thetaiotaomicron) 		PF13088
(BNR_2) 		3 GLU A 874
HIS A 930
GLU A 927
 None
 0.81A 2x45C-5mqsA:
undetectable		 2x45C-5mqsA:
8.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mrv CARBOXYPEPTIDASE O

(Homo sapiens) 		no annotation 3 GLU A 290
HIS A  88
GLU A  91
 ZN  A 401 ( 4.6A)
ZN  A 401 (-3.2A)
ZN  A 401 (-1.9A)
 0.86A 2x45C-5mrvA:
undetectable		 2x45C-5mrvA:
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.
5t9c GLYCEROPHOSPHORYL
DIESTER
PHOSPHODIESTERASE

(Bacillus
subtilis) 		PF03009
(GDPD) 		3 GLU E 152
HIS E  43
GLU E  70
 CA  E 301 ( 3.2A)
G3P  E 302 ( 4.0A)
CA  E 301 ( 2.9A)
 0.56A 2x45C-5t9cE:
undetectable		 2x45C-5t9cE:
19.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xgv PYRE3

(Streptomyces
rugosporus) 		no annotation 3 GLU A 101
HIS A  34
GLU A  32
 None
FAD  A 501 (-3.8A)
FAD  A 501 (-2.6A)
 0.81A 2x45C-5xgvA:
undetectable		 2x45C-5xgvA:
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.
6anr COLIBACTIN
SELF-PROTECTION
PROTEIN CLBS

(Escherichia
coli) 		no annotation 3 GLU A  81
HIS A  65
GLU A  80
 None
 0.82A 2x45C-6anrA:
undetectable		 2x45C-6anrA:
19.72
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.
6bnp UNCONVENTIONAL
MYOSIN-VI

(Sus scrofa) 		no annotation 3 GLU I 575
HIS I 465
GLU I 589
 None
 0.65A 2x45C-6bnpI:
undetectable		 2x45C-6bnpI:
15.33
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.
6btm ALTERNATIVE COMPLEX
III SUBUNIT B

(Flavobacterium
johnsoniae) 		no annotation 3 GLU B 736
HIS B 999
GLU B1002
 None
 0.82A 2x45C-6btmB:
undetectable		 2x45C-6btmB:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cet GATOR COMPLEX
PROTEIN DEPDC5

(Homo sapiens) 		no annotation 3 GLU D1497
HIS D1375
GLU D1350
 None
 0.74A 2x45C-6cetD:
undetectable		 2x45C-6cetD:
18.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6eot DIPEPTIDYL PEPTIDASE
8

(Homo sapiens) 		no annotation 3 GLU A 376
HIS A 798
GLU A 793
 None
 0.88A 2x45C-6eotA:
undetectable		 2x45C-6eotA:
17.01
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.
6f79 -

(-) 		no annotation 3 GLU A 277
HIS A  69
GLU A  72
 0X9  A 407 (-3.2A)
ZN  A 401 ( 3.1A)
ZN  A 401 ( 1.9A)
 0.80A 2x45C-6f79A:
undetectable		 2x45C-6f79A:
undetectable